From 2c9c3179cfd4964daeca8bbdcb958be8dc481eb9 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Tue, 1 Oct 2024 10:47:15 +0200 Subject: [PATCH 01/16] prodigy module --- .../modules/scoring/prodigy/__init__.py | 77 +++++ .../modules/scoring/prodigy/defaults.yaml | 57 +++ .../modules/scoring/prodigy/prodigy.py | 327 ++++++++++++++++++ .../modules/scoring/prodigy/prodigyv2.py | 327 ++++++++++++++++++ 4 files changed, 788 insertions(+) create mode 100644 src/haddock/modules/scoring/prodigy/__init__.py create mode 100644 src/haddock/modules/scoring/prodigy/defaults.yaml create mode 100644 src/haddock/modules/scoring/prodigy/prodigy.py create mode 100644 src/haddock/modules/scoring/prodigy/prodigyv2.py diff --git a/src/haddock/modules/scoring/prodigy/__init__.py b/src/haddock/modules/scoring/prodigy/__init__.py new file mode 100644 index 000000000..d7b49cece --- /dev/null +++ b/src/haddock/modules/scoring/prodigy/__init__.py @@ -0,0 +1,77 @@ +"""EM scoring module. + +This module performs energy minimization and scoring of the models generated in +the previous step of the workflow. No restraints are applied during this step. +""" + +from pathlib import Path + +from haddock.core.defaults import MODULE_DEFAULT_YAML +from haddock.core.typing import FilePath +from haddock.libs.libontology import PDBFile +from haddock.modules import get_engine +from haddock.modules.scoring import ScoringModule +from haddock.modules.scoring.prodigy.prodigy import AnyProdigyJob, CheckInstall + + +RECIPE_PATH = Path(__file__).resolve().parent +DEFAULT_CONFIG = Path(RECIPE_PATH, MODULE_DEFAULT_YAML) + + +class HaddockModule(ScoringModule): + """HADDOCK3 module to perform energy minimization scoring.""" + + name = RECIPE_PATH.name + + def __init__( + self, order: int, path: Path, initial_params: FilePath = DEFAULT_CONFIG + ) -> None: + super().__init__(order, path, initial_params) + + @classmethod + def confirm_installation(cls) -> None: + """Confirm module is installed.""" + CheckInstall() + return + + def _run(self) -> None: + """Execute module.""" + # Retrieve previous models + try: + models_to_score = self.previous_io.retrieve_models(individualize=True) + except Exception as e: + self.finish_with_error(e) + + # Pool of Prodigy jobs to be executed + jobs: list[AnyProdigyJob] = [] + self.output_models: list[PDBFile] = [] + + for mi, model in enumerate(models_to_score): + self.output_models.append(model) + prodigy_worker = AnyProdigyJob( + model, + self.params, + index=mi, + ) + jobs.append(prodigy_worker) + + # Run CNS Jobs + self.log(f"Running {len(jobs)} Prodigy Jobs") + Engine = get_engine(self.params["mode"], self.params) + engine = Engine(jobs) + engine.run() + self.log("Prodigy jobs have finished") + + # Check for generated output, fail it not all expected files are found + for model_score in engine.results: + # point score stored in engine + prodigy_score = model_score.score + model_index = model_score.index + # Point corresponding model + self.output_models[model_index].score = prodigy_score + + output_fname = "prodigy.tsv" + self.log(f"Saving output to {output_fname}") + self.output(output_fname) + + self.export_io_models() diff --git a/src/haddock/modules/scoring/prodigy/defaults.yaml b/src/haddock/modules/scoring/prodigy/defaults.yaml new file mode 100644 index 000000000..da43ac84f --- /dev/null +++ b/src/haddock/modules/scoring/prodigy/defaults.yaml @@ -0,0 +1,57 @@ +scoring_mode: + default: protein + type: string + minchars: 1 + maxchars: 20 + choices: + - protein + - ligand + title: Scoring mode of PRODIGY + short: Scoring mode of PRODIGY + long: Choose protein when scoring protein complexes, and ligands when a small + molecule is involved. + group: scoring + explevel: easy +distance_cutoff: + default: .nan + type: float + min: 1.00 + max: 100.00 + precision: 2 + title: Add text + short: Add text + long: Add text. + If not set, will take the default input values for the + prodigy-prot or prodigy-lig, depending on the selected `scoring_mode`. + group: scoring + explevel: expert +accessibility_cutoff: + default: 0.05 + type: float + min: 0.00 + max: 1.00 + precision: 2 + title: Add text + short: Add text + long: Add text + group: scoring + explevel: expert +temperature: + default: 25.00 + type: float + min: -273.15 + max: 95.00 + precision: 2 + title: Add text + short: Add text + long: Add text + group: conversion + explevel: expert +to_pkd: + default: true + type: boolean + title: Add text + short: Add text + long: Add text + group: conversion + explevel: expert \ No newline at end of file diff --git a/src/haddock/modules/scoring/prodigy/prodigy.py b/src/haddock/modules/scoring/prodigy/prodigy.py new file mode 100644 index 000000000..179e2f551 --- /dev/null +++ b/src/haddock/modules/scoring/prodigy/prodigy.py @@ -0,0 +1,327 @@ +"""Set of functionalities to run prodigy.""" + + +import subprocess +from abc import ABC, abstractmethod + +import numpy as np + +from haddock.core.exceptions import ModuleError +from haddock.core.typing import FilePath, Optional, ParamDict, Union +from haddock.libs.libontology import PDBFile + + +# Define conversion constants +R_GAZ_CONST = 8.314 +CALS_TO_JOULES = 4.184 +KELVIN_TO_CELCIUS = 273.15 + + +class CheckInstall: + """Verify that installation of prodigy is ok.""" + + def __init__(self): + """Verify that installation of prodigy is ok. + + Raises + ------ + ModuleError + Raised when prodigy subprocess failed. + """ + try: + self.run_helps() + except FileNotFoundError: + raise ModuleError( + "Issue detected with the installation of Prodigy. " + "Consider installing it with: " + "pip install prodigy-prot prodigy-lig" + ) + + @staticmethod + def run_helps() -> None: + """Run prodigy CLI with help.""" + for ext in ("",):#"-lig"): + prodigy_help = subprocess.Popen( + [f"prodigy{ext}", "--help"], + stdout=subprocess.PIPE, + stderr=subprocess.PIPE, + ) + _help_string = prodigy_help.stdout.read().decode('utf-8') + return None + + +class ProdigyWorker(ABC): + def __init__(self, model: FilePath, params: ParamDict): + self.model = model + self.topKd = params["to_pkd"] + self.temperature = params["temperature"] + self.acc_cutoff = params["accessibility_cutoff"] + self.dist_cutoff = self.set_distance_cutoff(params["distance_cutoff"]) + self.score = None + self.error = None + + def _run(self) -> None: + """Main computation function.""" + prodigy_stdout = self.evaluate_complex() + deltaG = self.extract_deltaG(prodigy_stdout) + self.score = self.pkd_converter(deltaG) + + def run(self) -> None: + """Wrapper of the run function.""" + try: + self._run() + except ModuleError as error: + self.error = error + + def evaluate_complex(self) -> str: + """Run prodigy and return stdout. + + Returns + ------- + prodigy_stdout : str + Standard output of prodigy (in quiet mode). + """ + # Build command line + cmd_ = self.gen_cmd_line() + # Subprocess run + prodigy_stdout = self.subprocess_run(cmd_) + return prodigy_stdout + + def pkd_converter(self, deltaG: float) -> float: + if self.topKd: + return self.deltaG_to_pKd( + deltaG, + kelvins=self.temperature + KELVIN_TO_CELCIUS, + ) + else: + return deltaG + + @staticmethod + def deltaG_to_pKd(deltaG: float, kelvins: float = 298.3) -> float: + """Convert a deltaG (in Kcal/mol) to pKd. + + Parameters + ---------- + deltaG : float + DeltaG value (in Kcal/mol) + kelvins : float, optional + Temperature at which to perform the conversion. + By default 298.3 (25 degrees Celcius) + + Returns + ------- + pKd : float + The corresponding pKd value at given temperature. + """ + # Convert Kcals to joules + deltaG_joules = deltaG * CALS_TO_JOULES * 1000 + # Use formula + Kd = np.exp(-deltaG_joules / (R_GAZ_CONST * kelvins)) + # Convert to pKd + _pKd = np.log10(Kd) + # Reduce number of decimals + pKd = round(_pKd, 2) + return -pKd + + @staticmethod + def subprocess_run(cmd_: list[Union[str, FilePath]]) -> Optional[str]: + print(" ".join([str(v) for v in cmd_])) + # Run it + run = subprocess.Popen( + cmd_, + stdout=subprocess.PIPE, + stderr=subprocess.PIPE, + ) + # Check that run went smooth + stderr = run.stderr.read().decode("utf-8") + if stderr != "": + raise ModuleError(stderr) + # Gather standard output + stdout = run.stdout.read().decode("utf-8") + return stdout + + @abstractmethod + def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + pass + + @abstractmethod + def extract_deltaG(stdout: str) -> str: + pass + + @abstractmethod + def gen_cmd_line(self) -> list[Union[str, FilePath]]: + pass + + +class ProdigyProt(ProdigyWorker): + def __init__(self, model: FilePath, params: ParamDict): + super().__init__(model, params) + + def gen_cmd_line(self) -> list[Union[str, FilePath]]: + # Build command line + cmd_ = [ + "prodigy", + self.model, + "--distance-cutoff", str(self.dist_cutoff), + "--acc-threshold", str(self.acc_cutoff), + "--temperature", str(self.temperature), + "--quiet", + ] + return cmd_ + + @staticmethod + def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + """Set distance cutoff to use for analysis of contacts. + + Parameters + ---------- + _dist_cutoff : Optional[float] + Distance set by the user. Can be None if undefined. + + Returns + ------- + dist_cutoff : float + The distance cutoff to use for this run. + Set to default software value (5.5) if undefined. + """ + # User defined value + if not np.isnan(_dist_cutoff): + dist_cutoff = _dist_cutoff + # Not defined case + else: + dist_cutoff = 5.5 + return dist_cutoff + + @staticmethod + def extract_deltaG(prodigy_predictions: str) -> float: + """Extract score from prodigy-prot + + This function is ment to be used when the flag --quiet is used. + + Parameters + ---------- + prodigy_predictions : str + Standard output of prodigy (prodigy-protein) + + Returns + ------- + deltaG: float + The predicted deltaG + """ + deltaG_str = prodigy_predictions.strip().split()[-1] + deltaG = float(deltaG_str) + return round(deltaG, 3) + + +class ProdigyLig(ProdigyWorker): + def __init__(self, model: FilePath, params: ParamDict): + super().__init__(model, params) + + def gen_cmd_line(self) -> list[Union[str, FilePath]]: + # Build command line + cmd_ = [ + "prodigy_lig", + "--chains", ",".join(chains), f"{ligchain}:{ligname}", + "--distance_cutoff", self.dist_cutoff, + "--input_file", self.model, + ] + return cmd_ + + @staticmethod + def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + """Set distance cutoff to use for analysis of contacts. + + Parameters + ---------- + _dist_cutoff : Optional[float] + Distance set by the user. Can be None if undefined. + + Returns + ------- + dist_cutoff : float + The distance cutoff to use for this run. + Set to default software value (10.5) if undefined. + """ + # User defined value + if not np.isnan(_dist_cutoff): + dist_cutoff = _dist_cutoff + # Not defined case + else: + dist_cutoff = 10.5 + return dist_cutoff + + @staticmethod + def extract_deltaG(prodigy_predictions: str) -> float: + """Extract delatG from prodigy-lig predictions. + + Parameters + ---------- + prodigy_lig_predictions : str + Standard output of prodigy-lig. + + Returns + ------- + deltaG : float + The predicted deltaG + """ + # Point line and value + prediction_lines = prodigy_predictions.split('\n') + second_line = prediction_lines[1].strip() + predicted_DG_string = second_line.split()[-1] + # Cast to float + _deltaG = float(predicted_DG_string) + # Reduce number of decimals + deltaG = round(_deltaG, 2) + return deltaG + + +class ModelScore: + """Simple class for holding score for a model.""" + + def __init__(self, model_index: int): + self.index = model_index + self.score = None + self.error = None + + +class AnyProdigyJob: + """Managing the computation of prodigy scores within haddock3.""" + + def __init__(self, model: PDBFile, params: ParamDict, index: int = 1): + worker = self.get_worker(params["scoring_mode"]) + self.worker = worker(model.rel_path, params) + self.score = ModelScore(index) + + def _run(self) -> ModelScore: + """Main computation function.""" + try: + self.worker.run() + except Exception as e: + print(e) + else: + self.score.score = self.worker.score + self.score.error = self.worker.error + return self.score + + def run(self) -> ModelScore: + """Wrapper to the _run function.""" + return self._run() + + @staticmethod + def get_worker(mode: str) -> Union[ProdigyProt, ProdigyLig]: + """Find appropriated class that will handle the computation. + + Parameters + ---------- + mode : str + Prodigy scoring mode, either protein or ligand + + Returns + ------- + Union[ProdigyProt, ProdigyLig] + The prodigy class that will handle the computation + """ + if mode == "protein": + return ProdigyProt + else: + return ProdigyLig diff --git a/src/haddock/modules/scoring/prodigy/prodigyv2.py b/src/haddock/modules/scoring/prodigy/prodigyv2.py new file mode 100644 index 000000000..179e2f551 --- /dev/null +++ b/src/haddock/modules/scoring/prodigy/prodigyv2.py @@ -0,0 +1,327 @@ +"""Set of functionalities to run prodigy.""" + + +import subprocess +from abc import ABC, abstractmethod + +import numpy as np + +from haddock.core.exceptions import ModuleError +from haddock.core.typing import FilePath, Optional, ParamDict, Union +from haddock.libs.libontology import PDBFile + + +# Define conversion constants +R_GAZ_CONST = 8.314 +CALS_TO_JOULES = 4.184 +KELVIN_TO_CELCIUS = 273.15 + + +class CheckInstall: + """Verify that installation of prodigy is ok.""" + + def __init__(self): + """Verify that installation of prodigy is ok. + + Raises + ------ + ModuleError + Raised when prodigy subprocess failed. + """ + try: + self.run_helps() + except FileNotFoundError: + raise ModuleError( + "Issue detected with the installation of Prodigy. " + "Consider installing it with: " + "pip install prodigy-prot prodigy-lig" + ) + + @staticmethod + def run_helps() -> None: + """Run prodigy CLI with help.""" + for ext in ("",):#"-lig"): + prodigy_help = subprocess.Popen( + [f"prodigy{ext}", "--help"], + stdout=subprocess.PIPE, + stderr=subprocess.PIPE, + ) + _help_string = prodigy_help.stdout.read().decode('utf-8') + return None + + +class ProdigyWorker(ABC): + def __init__(self, model: FilePath, params: ParamDict): + self.model = model + self.topKd = params["to_pkd"] + self.temperature = params["temperature"] + self.acc_cutoff = params["accessibility_cutoff"] + self.dist_cutoff = self.set_distance_cutoff(params["distance_cutoff"]) + self.score = None + self.error = None + + def _run(self) -> None: + """Main computation function.""" + prodigy_stdout = self.evaluate_complex() + deltaG = self.extract_deltaG(prodigy_stdout) + self.score = self.pkd_converter(deltaG) + + def run(self) -> None: + """Wrapper of the run function.""" + try: + self._run() + except ModuleError as error: + self.error = error + + def evaluate_complex(self) -> str: + """Run prodigy and return stdout. + + Returns + ------- + prodigy_stdout : str + Standard output of prodigy (in quiet mode). + """ + # Build command line + cmd_ = self.gen_cmd_line() + # Subprocess run + prodigy_stdout = self.subprocess_run(cmd_) + return prodigy_stdout + + def pkd_converter(self, deltaG: float) -> float: + if self.topKd: + return self.deltaG_to_pKd( + deltaG, + kelvins=self.temperature + KELVIN_TO_CELCIUS, + ) + else: + return deltaG + + @staticmethod + def deltaG_to_pKd(deltaG: float, kelvins: float = 298.3) -> float: + """Convert a deltaG (in Kcal/mol) to pKd. + + Parameters + ---------- + deltaG : float + DeltaG value (in Kcal/mol) + kelvins : float, optional + Temperature at which to perform the conversion. + By default 298.3 (25 degrees Celcius) + + Returns + ------- + pKd : float + The corresponding pKd value at given temperature. + """ + # Convert Kcals to joules + deltaG_joules = deltaG * CALS_TO_JOULES * 1000 + # Use formula + Kd = np.exp(-deltaG_joules / (R_GAZ_CONST * kelvins)) + # Convert to pKd + _pKd = np.log10(Kd) + # Reduce number of decimals + pKd = round(_pKd, 2) + return -pKd + + @staticmethod + def subprocess_run(cmd_: list[Union[str, FilePath]]) -> Optional[str]: + print(" ".join([str(v) for v in cmd_])) + # Run it + run = subprocess.Popen( + cmd_, + stdout=subprocess.PIPE, + stderr=subprocess.PIPE, + ) + # Check that run went smooth + stderr = run.stderr.read().decode("utf-8") + if stderr != "": + raise ModuleError(stderr) + # Gather standard output + stdout = run.stdout.read().decode("utf-8") + return stdout + + @abstractmethod + def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + pass + + @abstractmethod + def extract_deltaG(stdout: str) -> str: + pass + + @abstractmethod + def gen_cmd_line(self) -> list[Union[str, FilePath]]: + pass + + +class ProdigyProt(ProdigyWorker): + def __init__(self, model: FilePath, params: ParamDict): + super().__init__(model, params) + + def gen_cmd_line(self) -> list[Union[str, FilePath]]: + # Build command line + cmd_ = [ + "prodigy", + self.model, + "--distance-cutoff", str(self.dist_cutoff), + "--acc-threshold", str(self.acc_cutoff), + "--temperature", str(self.temperature), + "--quiet", + ] + return cmd_ + + @staticmethod + def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + """Set distance cutoff to use for analysis of contacts. + + Parameters + ---------- + _dist_cutoff : Optional[float] + Distance set by the user. Can be None if undefined. + + Returns + ------- + dist_cutoff : float + The distance cutoff to use for this run. + Set to default software value (5.5) if undefined. + """ + # User defined value + if not np.isnan(_dist_cutoff): + dist_cutoff = _dist_cutoff + # Not defined case + else: + dist_cutoff = 5.5 + return dist_cutoff + + @staticmethod + def extract_deltaG(prodigy_predictions: str) -> float: + """Extract score from prodigy-prot + + This function is ment to be used when the flag --quiet is used. + + Parameters + ---------- + prodigy_predictions : str + Standard output of prodigy (prodigy-protein) + + Returns + ------- + deltaG: float + The predicted deltaG + """ + deltaG_str = prodigy_predictions.strip().split()[-1] + deltaG = float(deltaG_str) + return round(deltaG, 3) + + +class ProdigyLig(ProdigyWorker): + def __init__(self, model: FilePath, params: ParamDict): + super().__init__(model, params) + + def gen_cmd_line(self) -> list[Union[str, FilePath]]: + # Build command line + cmd_ = [ + "prodigy_lig", + "--chains", ",".join(chains), f"{ligchain}:{ligname}", + "--distance_cutoff", self.dist_cutoff, + "--input_file", self.model, + ] + return cmd_ + + @staticmethod + def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + """Set distance cutoff to use for analysis of contacts. + + Parameters + ---------- + _dist_cutoff : Optional[float] + Distance set by the user. Can be None if undefined. + + Returns + ------- + dist_cutoff : float + The distance cutoff to use for this run. + Set to default software value (10.5) if undefined. + """ + # User defined value + if not np.isnan(_dist_cutoff): + dist_cutoff = _dist_cutoff + # Not defined case + else: + dist_cutoff = 10.5 + return dist_cutoff + + @staticmethod + def extract_deltaG(prodigy_predictions: str) -> float: + """Extract delatG from prodigy-lig predictions. + + Parameters + ---------- + prodigy_lig_predictions : str + Standard output of prodigy-lig. + + Returns + ------- + deltaG : float + The predicted deltaG + """ + # Point line and value + prediction_lines = prodigy_predictions.split('\n') + second_line = prediction_lines[1].strip() + predicted_DG_string = second_line.split()[-1] + # Cast to float + _deltaG = float(predicted_DG_string) + # Reduce number of decimals + deltaG = round(_deltaG, 2) + return deltaG + + +class ModelScore: + """Simple class for holding score for a model.""" + + def __init__(self, model_index: int): + self.index = model_index + self.score = None + self.error = None + + +class AnyProdigyJob: + """Managing the computation of prodigy scores within haddock3.""" + + def __init__(self, model: PDBFile, params: ParamDict, index: int = 1): + worker = self.get_worker(params["scoring_mode"]) + self.worker = worker(model.rel_path, params) + self.score = ModelScore(index) + + def _run(self) -> ModelScore: + """Main computation function.""" + try: + self.worker.run() + except Exception as e: + print(e) + else: + self.score.score = self.worker.score + self.score.error = self.worker.error + return self.score + + def run(self) -> ModelScore: + """Wrapper to the _run function.""" + return self._run() + + @staticmethod + def get_worker(mode: str) -> Union[ProdigyProt, ProdigyLig]: + """Find appropriated class that will handle the computation. + + Parameters + ---------- + mode : str + Prodigy scoring mode, either protein or ligand + + Returns + ------- + Union[ProdigyProt, ProdigyLig] + The prodigy class that will handle the computation + """ + if mode == "protein": + return ProdigyProt + else: + return ProdigyLig From 837d4f41bde9e38051de8ec1f8055035d42e95db Mon Sep 17 00:00:00 2001 From: VGPReys Date: Tue, 1 Oct 2024 10:47:59 +0200 Subject: [PATCH 02/16] add examples --- .../thirdparty/prodigy/data/homotrimer.pdb | 2844 +++++++++++++ examples/thirdparty/prodigy/data/prot-lig.pdb | 2984 +++++++++++++ .../thirdparty/prodigy/data/prot-prot.pdb | 3686 +++++++++++++++++ .../prodigy/prodigy-protein-ligand-test.cfg | 5 + .../prodigy/prodigy-protein-protein-test.cfg | 10 + 5 files changed, 9529 insertions(+) create mode 100644 examples/thirdparty/prodigy/data/homotrimer.pdb create mode 100644 examples/thirdparty/prodigy/data/prot-lig.pdb create mode 100644 examples/thirdparty/prodigy/data/prot-prot.pdb create mode 100644 examples/thirdparty/prodigy/prodigy-protein-ligand-test.cfg create mode 100644 examples/thirdparty/prodigy/prodigy-protein-protein-test.cfg diff --git a/examples/thirdparty/prodigy/data/homotrimer.pdb b/examples/thirdparty/prodigy/data/homotrimer.pdb new file mode 100644 index 000000000..c8cfb1da1 --- /dev/null +++ b/examples/thirdparty/prodigy/data/homotrimer.pdb @@ -0,0 +1,2844 @@ +ATOM 1 N SER A 2 59.687 62.109 75.379 1.00 16.24 A +ATOM 2 CA SER A 2 58.545 61.990 74.424 1.00 15.30 A +ATOM 3 C SER A 2 57.256 61.682 75.199 1.00 13.90 A +ATOM 4 O SER A 2 57.298 61.094 76.306 1.00 15.02 A +ATOM 5 CB SER A 2 58.796 60.983 73.331 1.00 16.11 A +ATOM 6 OG SER A 2 58.666 59.642 73.778 1.00 18.37 A +ATOM 7 N LYS A 3 56.142 62.095 74.598 1.00 12.13 A +ATOM 8 CA LYS A 3 54.855 61.881 75.274 1.00 11.35 A +ATOM 9 C LYS A 3 53.732 61.619 74.285 1.00 8.65 A +ATOM 10 O LYS A 3 53.724 61.974 73.102 1.00 7.83 A +ATOM 11 CB LYS A 3 54.508 63.089 76.165 1.00 13.69 A +ATOM 12 CG LYS A 3 54.208 64.314 75.337 1.00 15.79 A +ATOM 13 CD LYS A 3 54.056 65.631 76.074 1.00 17.79 A +ATOM 14 CE LYS A 3 55.391 66.208 76.498 1.00 18.86 A +ATOM 15 NZ LYS A 3 55.266 67.628 76.966 1.00 20.35 A +ATOM 16 N THR A 4 52.734 60.953 74.837 1.00 7.14 A +ATOM 17 CA THR A 4 51.526 60.662 74.068 1.00 6.44 A +ATOM 18 C THR A 4 50.711 61.943 73.856 1.00 5.57 A +ATOM 19 O THR A 4 50.616 62.800 74.785 1.00 6.47 A +ATOM 20 CB THR A 4 50.619 59.713 74.950 1.00 7.10 A +ATOM 21 OG1 THR A 4 51.320 58.447 75.034 1.00 8.40 A +ATOM 22 CG2 THR A 4 49.209 59.526 74.383 1.00 7.78 A +ATOM 23 N ILE A 5 50.115 62.056 72.684 1.00 4.90 A +ATOM 24 CA ILE A 5 49.139 63.114 72.395 1.00 5.03 A +ATOM 25 C ILE A 5 47.762 62.401 72.500 1.00 5.26 A +ATOM 26 O ILE A 5 47.535 61.375 71.875 1.00 5.95 A +ATOM 27 CB ILE A 5 49.304 63.748 70.997 1.00 5.22 A +ATOM 28 CG1 ILE A 5 50.722 64.326 70.810 1.00 5.41 A +ATOM 29 CG2 ILE A 5 48.204 64.802 70.734 1.00 6.47 A +ATOM 30 CD1 ILE A 5 51.050 64.678 69.334 1.00 4.98 A +ATOM 31 N ALA A 6 46.901 62.990 73.340 1.00 5.80 A +ATOM 32 CA ALA A 6 45.548 62.428 73.548 1.00 7.32 A +ATOM 33 C ALA A 6 44.573 63.599 73.578 1.00 7.57 A +ATOM 34 O ALA A 6 44.680 64.516 74.414 1.00 10.07 A +ATOM 35 CB ALA A 6 45.481 61.583 74.808 1.00 8.24 A +ATOM 36 N THR A 7 43.666 63.612 72.613 1.00 6.19 A +ATOM 37 CA THR A 7 42.676 64.681 72.481 1.00 6.55 A +ATOM 38 C THR A 7 41.286 64.145 72.188 1.00 5.76 A +ATOM 39 O THR A 7 41.146 63.171 71.468 1.00 6.20 A +ATOM 40 CB THR A 7 43.117 65.663 71.330 1.00 7.01 A +ATOM 41 OG1 THR A 7 42.032 66.622 71.214 1.00 7.16 A +ATOM 42 CG2 THR A 7 43.363 65.012 69.980 1.00 7.30 A +ATOM 43 N GLU A 8 40.282 64.754 72.807 1.00 6.37 A +ATOM 44 CA GLU A 8 38.895 64.376 72.568 1.00 6.48 A +ATOM 45 C GLU A 8 38.497 64.803 71.162 1.00 6.14 A +ATOM 46 O GLU A 8 37.460 64.341 70.650 1.00 6.07 A +ATOM 47 CB GLU A 8 37.922 65.033 73.559 1.00 7.91 A +ATOM 48 CG GLU A 8 37.722 66.540 73.490 1.00 9.70 A +ATOM 49 CD GLU A 8 38.814 67.395 74.051 1.00 11.36 A +ATOM 50 OE1 GLU A 8 39.958 66.979 74.261 1.00 12.18 A +ATOM 51 OE2 GLU A 8 38.489 68.603 74.276 1.00 13.35 A +ATOM 52 N ASN A 9 39.286 65.675 70.529 1.00 6.75 A +ATOM 53 CA ASN A 9 38.967 66.220 69.204 1.00 7.05 A +ATOM 54 C ASN A 9 39.238 65.308 68.025 1.00 7.06 A +ATOM 55 O ASN A 9 38.959 65.680 66.872 1.00 6.95 A +ATOM 56 CB ASN A 9 39.590 67.590 69.019 1.00 7.91 A +ATOM 57 CG ASN A 9 39.030 68.573 70.034 1.00 9.05 A +ATOM 58 OD1 ASN A 9 37.816 68.514 70.332 1.00 10.43 A +ATOM 59 ND2 ASN A 9 39.902 69.410 70.545 1.00 9.59 A +ATOM 60 N ALA A 10 39.839 64.140 68.250 1.00 5.82 A +ATOM 61 CA ALA A 10 40.069 63.131 67.198 1.00 5.77 A +ATOM 62 C ALA A 10 39.464 61.835 67.795 1.00 6.13 A +ATOM 63 O ALA A 10 39.310 61.744 69.012 1.00 5.80 A +ATOM 64 CB ALA A 10 41.527 62.935 66.850 1.00 6.12 A +ATOM 65 N PRO A 11 39.127 60.887 66.939 1.00 6.62 A +ATOM 66 CA PRO A 11 38.556 59.626 67.427 1.00 6.86 A +ATOM 67 C PRO A 11 39.432 58.991 68.470 1.00 6.78 A +ATOM 68 O PRO A 11 40.681 58.925 68.299 1.00 6.19 A +ATOM 69 CB PRO A 11 38.483 58.750 66.191 1.00 7.77 A +ATOM 70 CG PRO A 11 38.512 59.680 65.012 1.00 8.11 A +ATOM 71 CD PRO A 11 39.270 60.918 65.475 1.00 7.42 A +ATOM 72 N ALA A 12 38.830 58.469 69.527 1.00 8.21 A +ATOM 73 CA ALA A 12 39.572 57.836 70.624 1.00 9.55 A +ATOM 74 C ALA A 12 40.348 56.629 70.099 1.00 10.63 A +ATOM 75 O ALA A 12 39.905 55.909 69.197 1.00 9.79 A +ATOM 76 CB ALA A 12 38.589 57.344 71.687 1.00 10.50 A +ATOM 77 N ALA A 13 41.520 56.468 70.685 1.00 11.95 A +ATOM 78 CA ALA A 13 42.435 55.363 70.356 1.00 14.35 A +ATOM 79 C ALA A 13 42.006 54.159 71.201 1.00 15.86 A +ATOM 80 O ALA A 13 42.446 54.077 72.361 1.00 17.22 A +ATOM 81 CB ALA A 13 43.882 55.728 70.640 1.00 14.52 A +ATOM 82 N ILE A 14 41.192 53.335 70.571 1.00 16.89 A +ATOM 83 CA ILE A 14 40.701 52.121 71.268 1.00 18.21 A +ATOM 84 C ILE A 14 41.712 50.983 71.151 1.00 18.11 A +ATOM 85 O ILE A 14 42.096 50.420 72.218 1.00 19.37 A +ATOM 86 CB ILE A 14 39.249 51.808 70.805 1.00 19.06 A +ATOM 87 CG1 ILE A 14 38.352 53.063 71.045 1.00 19.75 A +ATOM 88 CG2 ILE A 14 38.616 50.571 71.498 1.00 19.75 A +ATOM 89 CD1 ILE A 14 36.972 52.904 70.339 1.00 20.29 A +ATOM 90 N GLY A 15 42.164 50.671 69.955 1.00 17.28 A +ATOM 91 CA GLY A 15 43.173 49.589 69.783 1.00 15.10 A +ATOM 92 C GLY A 15 44.499 49.929 70.474 1.00 13.16 A +ATOM 93 O GLY A 15 44.655 50.901 71.233 1.00 14.07 A +ATOM 94 N PRO A 16 45.491 49.082 70.180 1.00 11.29 A +ATOM 95 CA PRO A 16 46.834 49.214 70.743 1.00 9.14 A +ATOM 96 C PRO A 16 47.663 50.263 70.025 1.00 8.00 A +ATOM 97 O PRO A 16 48.680 49.940 69.393 1.00 6.68 A +ATOM 98 CB PRO A 16 47.384 47.790 70.627 1.00 9.25 A +ATOM 99 CG PRO A 16 46.821 47.323 69.299 1.00 9.12 A +ATOM 100 CD PRO A 16 45.393 47.874 69.312 1.00 10.61 A +ATOM 101 N TYR A 17 47.238 51.512 70.158 1.00 6.92 A +ATOM 102 CA TYR A 17 47.969 52.643 69.552 1.00 6.14 A +ATOM 103 C TYR A 17 47.559 53.900 70.301 1.00 5.54 A +ATOM 104 O TYR A 17 46.568 53.863 71.069 1.00 7.15 A +ATOM 105 CB TYR A 17 47.653 52.770 68.038 1.00 6.78 A +ATOM 106 CG TYR A 17 46.184 53.035 67.760 1.00 7.73 A +ATOM 107 CD1 TYR A 17 45.725 54.354 67.570 1.00 8.18 A +ATOM 108 CD2 TYR A 17 45.220 52.031 67.736 1.00 8.87 A +ATOM 109 CE1 TYR A 17 44.386 54.645 67.316 1.00 9.51 A +ATOM 110 CE2 TYR A 17 43.868 52.309 67.498 1.00 10.50 A +ATOM 111 CZ TYR A 17 43.463 53.612 67.302 1.00 10.45 A +ATOM 112 OH TYR A 17 42.136 53.906 67.069 1.00 12.81 A +ATOM 113 N VAL A 18 48.285 54.974 70.101 1.00 5.53 A +ATOM 114 CA VAL A 18 47.936 56.302 70.616 1.00 5.01 A +ATOM 115 C VAL A 18 47.657 57.143 69.366 1.00 5.01 A +ATOM 116 O VAL A 18 48.112 56.823 68.264 1.00 5.04 A +ATOM 117 CB VAL A 18 48.995 56.929 71.510 1.00 5.59 A +ATOM 118 CG1 VAL A 18 49.086 56.116 72.797 1.00 6.33 A +ATOM 119 CG2 VAL A 18 50.342 57.091 70.825 1.00 6.00 A +ATOM 120 N GLN A 19 46.945 58.244 69.553 1.00 4.48 A +ATOM 121 CA GLN A 19 46.600 59.142 68.446 1.00 4.00 A +ATOM 122 C GLN A 19 47.834 59.775 67.805 1.00 3.80 A +ATOM 123 O GLN A 19 47.857 60.035 66.598 1.00 3.75 A +ATOM 124 CB GLN A 19 45.663 60.267 68.895 1.00 5.03 A +ATOM 125 CG GLN A 19 44.310 59.743 69.363 1.00 5.44 A +ATOM 126 CD GLN A 19 43.542 60.837 70.048 1.00 5.87 A +ATOM 127 OE1 GLN A 19 44.130 61.623 70.789 1.00 7.44 A +ATOM 128 NE2 GLN A 19 42.220 60.896 69.850 1.00 6.86 A +ATOM 129 N GLY A 20 48.826 60.101 68.629 1.00 4.08 A +ATOM 130 CA GLY A 20 50.054 60.731 68.083 1.00 3.84 A +ATOM 131 C GLY A 20 51.077 60.795 69.194 1.00 3.63 A +ATOM 132 O GLY A 20 50.763 60.515 70.366 1.00 3.92 A +ATOM 133 N VAL A 21 52.293 61.175 68.820 1.00 3.33 A +ATOM 134 CA VAL A 21 53.390 61.313 69.766 1.00 3.95 A +ATOM 135 C VAL A 21 54.047 62.676 69.576 1.00 3.79 A +ATOM 136 O VAL A 21 54.224 63.146 68.449 1.00 4.94 A +ATOM 137 CB VAL A 21 54.401 60.160 69.624 1.00 3.78 A +ATOM 138 CG1 VAL A 21 53.754 58.864 70.091 1.00 4.83 A +ATOM 139 CG2 VAL A 21 54.888 60.047 68.190 1.00 4.51 A +ATOM 140 N ASP A 22 54.402 63.260 70.702 1.00 4.14 A +ATOM 141 CA ASP A 22 55.097 64.566 70.749 1.00 4.70 A +ATOM 142 C ASP A 22 56.528 64.213 71.148 1.00 4.45 A +ATOM 143 O ASP A 22 56.763 63.839 72.315 1.00 5.58 A +ATOM 144 CB ASP A 22 54.398 65.504 71.720 1.00 6.22 A +ATOM 145 CG ASP A 22 55.106 66.810 71.968 1.00 7.08 A +ATOM 146 OD1 ASP A 22 54.461 67.693 72.601 1.00 8.97 A +ATOM 147 OD2 ASP A 22 56.249 66.976 71.563 1.00 7.76 A +ATOM 148 N LEU A 23 57.471 64.305 70.241 1.00 4.71 A +ATOM 149 CA LEU A 23 58.871 63.966 70.471 1.00 5.58 A +ATOM 150 C LEU A 23 59.745 65.149 70.823 1.00 6.38 A +ATOM 151 O LEU A 23 60.979 64.983 70.882 1.00 8.55 A +ATOM 152 CB LEU A 23 59.403 63.270 69.193 1.00 5.54 A +ATOM 153 CG LEU A 23 58.507 62.154 68.674 1.00 6.24 A +ATOM 154 CD1 LEU A 23 59.178 61.512 67.451 1.00 6.77 A +ATOM 155 CD2 LEU A 23 58.259 61.054 69.707 1.00 6.93 A +ATOM 156 N GLY A 24 59.166 66.286 71.039 1.00 6.72 A +ATOM 157 CA GLY A 24 59.920 67.523 71.338 1.00 7.67 A +ATOM 158 C GLY A 24 59.707 68.400 70.084 1.00 7.60 A +ATOM 159 O GLY A 24 58.600 68.942 69.915 1.00 8.31 A +ATOM 160 N ASN A 25 60.704 68.474 69.248 1.00 7.01 A +ATOM 161 CA ASN A 25 60.524 69.301 68.036 1.00 7.87 A +ATOM 162 C ASN A 25 59.570 68.622 67.049 1.00 7.17 A +ATOM 163 O ASN A 25 58.790 69.317 66.371 1.00 7.79 A +ATOM 164 CB ASN A 25 61.872 69.507 67.343 1.00 9.22 A +ATOM 165 CG ASN A 25 61.713 70.393 66.113 1.00 10.32 A +ATOM 166 OD1 ASN A 25 61.175 71.506 66.200 1.00 12.32 A +ATOM 167 ND2 ASN A 25 62.167 69.869 64.967 1.00 11.31 A +ATOM 168 N MET A 26 59.596 67.320 66.912 1.00 6.21 A +ATOM 169 CA MET A 26 58.766 66.599 65.949 1.00 5.60 A +ATOM 170 C MET A 26 57.556 65.937 66.583 1.00 5.14 A +ATOM 171 O MET A 26 57.663 65.301 67.653 1.00 5.60 A +ATOM 172 CB MET A 26 59.657 65.517 65.295 1.00 6.37 A +ATOM 173 CG MET A 26 58.892 64.822 64.201 1.00 7.10 A +ATOM 174 SD MET A 26 59.952 63.718 63.237 1.00 8.83 A +ATOM 175 CE MET A 26 60.817 64.935 62.195 1.00 9.98 A +ATOM 176 N ILE A 27 56.435 66.080 65.904 1.00 4.19 A +ATOM 177 CA ILE A 27 55.172 65.439 66.272 1.00 4.28 A +ATOM 178 C ILE A 27 54.845 64.446 65.142 1.00 3.82 A +ATOM 179 O ILE A 27 54.992 64.828 63.960 1.00 3.92 A +ATOM 180 CB ILE A 27 54.038 66.521 66.370 1.00 6.29 A +ATOM 181 CG1 ILE A 27 54.078 67.247 67.744 1.00 7.15 A +ATOM 182 CG2 ILE A 27 52.630 65.945 66.085 1.00 7.40 A +ATOM 183 CD1 ILE A 27 55.432 67.892 68.089 1.00 7.34 A +ATOM 184 N ILE A 28 54.416 63.256 65.496 1.00 3.50 A +ATOM 185 CA ILE A 28 54.000 62.289 64.494 1.00 3.86 A +ATOM 186 C ILE A 28 52.595 61.811 64.841 1.00 3.50 A +ATOM 187 O ILE A 28 52.349 61.387 66.009 1.00 4.39 A +ATOM 188 CB ILE A 28 54.955 61.051 64.397 1.00 4.84 A +ATOM 189 CG1 ILE A 28 56.417 61.518 64.271 1.00 5.31 A +ATOM 190 CG2 ILE A 28 54.508 60.136 63.234 1.00 5.87 A +ATOM 191 CD1 ILE A 28 57.405 60.336 64.133 1.00 5.89 A +ATOM 192 N THR A 29 51.698 61.836 63.885 1.00 3.96 A +ATOM 193 CA THR A 29 50.363 61.295 64.117 1.00 4.14 A +ATOM 194 C THR A 29 50.241 59.858 63.625 1.00 3.59 A +ATOM 195 O THR A 29 50.957 59.398 62.751 1.00 4.36 A +ATOM 196 CB THR A 29 49.229 62.148 63.402 1.00 4.08 A +ATOM 197 OG1 THR A 29 49.151 61.797 62.003 1.00 3.82 A +ATOM 198 CG2 THR A 29 49.413 63.662 63.547 1.00 4.97 A +ATOM 199 N SER A 30 49.245 59.184 64.195 1.00 3.82 A +ATOM 200 CA SER A 30 48.819 57.896 63.673 1.00 3.64 A +ATOM 201 C SER A 30 48.083 58.225 62.342 1.00 3.76 A +ATOM 202 O SER A 30 47.678 59.377 62.094 1.00 4.49 A +ATOM 203 CB SER A 30 47.782 57.269 64.615 1.00 3.92 A +ATOM 204 OG SER A 30 48.466 56.635 65.679 1.00 4.47 A +ATOM 205 N GLY A 31 47.915 57.202 61.521 1.00 3.83 A +ATOM 206 CA GLY A 31 47.176 57.299 60.254 1.00 4.29 A +ATOM 207 C GLY A 31 45.727 57.583 60.617 1.00 4.32 A +ATOM 208 O GLY A 31 45.108 56.714 61.268 1.00 6.10 A +ATOM 209 N GLN A 32 45.164 58.708 60.248 1.00 3.41 A +ATOM 210 CA GLN A 32 43.789 59.085 60.581 1.00 3.93 A +ATOM 211 C GLN A 32 42.841 58.647 59.469 1.00 3.99 A +ATOM 212 O GLN A 32 43.019 58.943 58.292 1.00 4.71 A +ATOM 213 CB GLN A 32 43.678 60.603 60.781 1.00 4.22 A +ATOM 214 CG GLN A 32 44.494 61.116 61.955 1.00 3.95 A +ATOM 215 CD GLN A 32 44.181 60.387 63.233 1.00 4.74 A +ATOM 216 OE1 GLN A 32 43.025 60.399 63.674 1.00 5.56 A +ATOM 217 NE2 GLN A 32 45.179 59.688 63.775 1.00 4.99 A +ATOM 218 N ILE A 33 41.772 58.014 59.924 1.00 5.20 A +ATOM 219 CA ILE A 33 40.684 57.594 59.037 1.00 5.52 A +ATOM 220 C ILE A 33 39.527 58.558 59.277 1.00 5.61 A +ATOM 221 O ILE A 33 39.471 59.271 60.308 1.00 5.33 A +ATOM 222 CB ILE A 33 40.335 56.109 59.247 1.00 6.50 A +ATOM 223 CG1 ILE A 33 39.958 55.811 60.720 1.00 7.36 A +ATOM 224 CG2 ILE A 33 41.489 55.181 58.775 1.00 7.63 A +ATOM 225 CD1 ILE A 33 39.290 54.422 60.854 1.00 8.30 A +ATOM 226 N PRO A 34 38.606 58.600 58.333 1.00 5.57 A +ATOM 227 CA PRO A 34 37.522 59.576 58.367 1.00 5.47 A +ATOM 228 C PRO A 34 36.371 59.282 59.321 1.00 5.79 A +ATOM 229 O PRO A 34 35.192 59.360 58.907 1.00 7.27 A +ATOM 230 CB PRO A 34 37.030 59.664 56.914 1.00 5.88 A +ATOM 231 CG PRO A 34 37.325 58.276 56.396 1.00 6.23 A +ATOM 232 CD PRO A 34 38.678 57.937 57.019 1.00 5.26 A +ATOM 233 N VAL A 35 36.721 58.985 60.555 1.00 5.68 A +ATOM 234 CA VAL A 35 35.706 58.775 61.601 1.00 6.40 A +ATOM 235 C VAL A 35 35.492 60.117 62.295 1.00 5.88 A +ATOM 236 O VAL A 35 36.425 60.824 62.677 1.00 5.93 A +ATOM 237 CB VAL A 35 36.200 57.731 62.615 1.00 7.54 A +ATOM 238 CG1 VAL A 35 35.300 57.671 63.850 1.00 7.74 A +ATOM 239 CG2 VAL A 35 36.356 56.376 61.976 1.00 7.73 A +ATOM 240 N ASN A 36 34.209 60.449 62.453 1.00 6.56 A +ATOM 241 CA ASN A 36 33.832 61.711 63.134 1.00 7.61 A +ATOM 242 C ASN A 36 34.009 61.509 64.632 1.00 7.47 A +ATOM 243 O ASN A 36 33.398 60.575 65.195 1.00 8.51 A +ATOM 244 CB ASN A 36 32.397 62.016 62.735 1.00 9.42 A +ATOM 245 CG ASN A 36 31.815 63.262 63.346 1.00 11.61 A +ATOM 246 OD1 ASN A 36 31.911 63.471 64.567 1.00 12.84 A +ATOM 247 ND2 ASN A 36 31.143 64.047 62.500 1.00 12.39 A +ATOM 248 N PRO A 37 34.757 62.330 65.329 1.00 7.10 A +ATOM 249 CA PRO A 37 34.975 62.151 66.766 1.00 8.07 A +ATOM 250 C PRO A 37 33.759 62.412 67.622 1.00 8.69 A +ATOM 251 O PRO A 37 33.731 62.001 68.790 1.00 9.39 A +ATOM 252 CB PRO A 37 36.114 63.114 67.097 1.00 8.93 A +ATOM 253 CG PRO A 37 35.942 64.190 66.064 1.00 9.33 A +ATOM 254 CD PRO A 37 35.519 63.459 64.793 1.00 8.45 A +ATOM 255 N LYS A 38 32.797 63.140 67.088 1.00 9.24 A +ATOM 256 CA LYS A 38 31.560 63.446 67.841 1.00 11.17 A +ATOM 257 C LYS A 38 30.604 62.270 67.772 1.00 11.35 A +ATOM 258 O LYS A 38 30.007 61.908 68.821 1.00 12.18 A +ATOM 259 CB LYS A 38 30.905 64.682 67.259 1.00 12.66 A +ATOM 260 CG LYS A 38 29.693 65.260 67.972 1.00 13.74 A +ATOM 261 CD LYS A 38 29.220 66.600 67.360 1.00 14.42 A +ATOM 262 CE LYS A 38 30.156 67.638 67.528 1.00 17.20 A +ATOM 263 NZ LYS A 38 30.401 67.909 68.973 1.00 18.80 A +ATOM 264 N THR A 39 30.410 61.667 66.605 1.00 11.29 A +ATOM 265 CA THR A 39 29.447 60.585 66.426 1.00 11.38 A +ATOM 266 C THR A 39 29.945 59.192 66.161 1.00 11.67 A +ATOM 267 O THR A 39 29.146 58.231 66.283 1.00 12.12 A +ATOM 268 CB THR A 39 28.498 60.967 65.202 1.00 11.46 A +ATOM 269 OG1 THR A 39 29.377 60.899 64.024 1.00 11.47 A +ATOM 270 CG2 THR A 39 27.870 62.342 65.321 1.00 12.27 A +ATOM 271 N GLY A 40 31.191 59.069 65.724 1.00 11.14 A +ATOM 272 CA GLY A 40 31.757 57.763 65.397 1.00 11.25 A +ATOM 273 C GLY A 40 31.414 57.343 63.969 1.00 11.36 A +ATOM 274 O GLY A 40 31.858 56.264 63.543 1.00 12.70 A +ATOM 275 N GLU A 41 30.667 58.149 63.248 1.00 11.11 A +ATOM 276 CA GLU A 41 30.278 57.815 61.871 1.00 11.71 A +ATOM 277 C GLU A 41 31.296 58.245 60.833 1.00 10.19 A +ATOM 278 O GLU A 41 32.099 59.139 61.111 1.00 10.11 A +ATOM 279 CB GLU A 41 28.947 58.517 61.534 1.00 13.86 A +ATOM 280 CG GLU A 41 27.808 57.967 62.414 1.00 16.75 A +ATOM 281 CD GLU A 41 26.469 58.606 62.196 1.00 18.82 A +ATOM 282 OE1 GLU A 41 26.338 59.711 61.693 1.00 19.76 A +ATOM 283 OE2 GLU A 41 25.559 57.848 62.618 1.00 20.70 A +ATOM 284 N VAL A 42 31.202 57.633 59.670 1.00 9.39 A +ATOM 285 CA VAL A 42 32.092 57.933 58.529 1.00 8.66 A +ATOM 286 C VAL A 42 31.207 58.479 57.415 1.00 8.84 A +ATOM 287 O VAL A 42 30.227 57.758 57.073 1.00 8.91 A +ATOM 288 CB VAL A 42 32.799 56.643 58.081 1.00 8.81 A +ATOM 289 CG1 VAL A 42 33.559 56.885 56.777 1.00 8.55 A +ATOM 290 CG2 VAL A 42 33.725 56.120 59.169 1.00 9.11 A +ATOM 291 N PRO A 43 31.514 59.617 56.877 1.00 8.44 A +ATOM 292 CA PRO A 43 30.715 60.210 55.791 1.00 9.28 A +ATOM 293 C PRO A 43 30.918 59.367 54.546 1.00 9.79 A +ATOM 294 O PRO A 43 32.000 58.768 54.342 1.00 9.85 A +ATOM 295 CB PRO A 43 31.207 61.650 55.701 1.00 9.38 A +ATOM 296 CG PRO A 43 32.652 61.567 56.141 1.00 9.11 A +ATOM 297 CD PRO A 43 32.661 60.480 57.216 1.00 8.87 A +ATOM 298 N ALA A 44 29.882 59.303 53.711 1.00 11.00 A +ATOM 299 CA ALA A 44 29.932 58.508 52.480 1.00 11.90 A +ATOM 300 C ALA A 44 30.874 59.042 51.404 1.00 12.03 A +ATOM 301 O ALA A 44 31.691 58.329 50.802 1.00 13.47 A +ATOM 302 CB ALA A 44 28.484 58.433 51.963 1.00 12.50 A +ATOM 303 N ASP A 45 30.762 60.303 51.148 1.00 11.52 A +ATOM 304 CA ASP A 45 31.428 61.135 50.149 1.00 11.81 A +ATOM 305 C ASP A 45 32.946 61.109 50.292 1.00 10.80 A +ATOM 306 O ASP A 45 33.415 61.365 51.424 1.00 9.73 A +ATOM 307 CB ASP A 45 30.749 62.522 50.311 1.00 12.76 A +ATOM 308 CG ASP A 45 31.268 63.505 49.304 1.00 14.25 A +ATOM 309 OD1 ASP A 45 32.157 64.292 49.667 1.00 13.77 A +ATOM 310 OD2 ASP A 45 30.805 63.527 48.132 1.00 15.41 A +ATOM 311 N VAL A 46 33.695 60.863 49.235 1.00 10.67 A +ATOM 312 CA VAL A 46 35.167 60.837 49.368 1.00 9.52 A +ATOM 313 C VAL A 46 35.756 62.188 49.754 1.00 7.84 A +ATOM 314 O VAL A 46 36.743 62.245 50.509 1.00 7.66 A +ATOM 315 CB VAL A 46 35.839 60.208 48.136 1.00 10.26 A +ATOM 316 CG1 VAL A 46 35.681 61.046 46.877 1.00 10.79 A +ATOM 317 CG2 VAL A 46 37.284 59.868 48.431 1.00 10.65 A +ATOM 318 N ALA A 47 35.185 63.265 49.237 1.00 7.55 A +ATOM 319 CA ALA A 47 35.697 64.600 49.612 1.00 7.95 A +ATOM 320 C ALA A 47 35.497 64.795 51.114 1.00 7.45 A +ATOM 321 O ALA A 47 36.408 65.283 51.831 1.00 7.40 A +ATOM 322 CB ALA A 47 35.003 65.692 48.813 1.00 8.33 A +ATOM 323 N ALA A 48 34.327 64.432 51.602 1.00 6.86 A +ATOM 324 CA ALA A 48 34.040 64.567 53.034 1.00 6.14 A +ATOM 325 C ALA A 48 34.976 63.666 53.826 1.00 5.74 A +ATOM 326 O ALA A 48 35.401 64.063 54.919 1.00 5.87 A +ATOM 327 CB ALA A 48 32.576 64.257 53.277 1.00 6.39 A +ATOM 328 N GLN A 49 35.270 62.494 53.331 1.00 5.59 A +ATOM 329 CA GLN A 49 36.209 61.597 54.043 1.00 5.03 A +ATOM 330 C GLN A 49 37.590 62.247 54.116 1.00 4.68 A +ATOM 331 O GLN A 49 38.233 62.234 55.172 1.00 5.23 A +ATOM 332 CB GLN A 49 36.255 60.225 53.385 1.00 5.71 A +ATOM 333 CG GLN A 49 34.994 59.395 53.671 1.00 6.17 A +ATOM 334 CD GLN A 49 35.202 57.921 53.381 1.00 5.93 A +ATOM 335 OE1 GLN A 49 36.340 57.420 53.335 1.00 5.99 A +ATOM 336 NE2 GLN A 49 34.110 57.175 53.220 1.00 6.38 A +ATOM 337 N ALA A 50 38.029 62.786 52.982 1.00 4.71 A +ATOM 338 CA ALA A 50 39.364 63.431 53.010 1.00 4.54 A +ATOM 339 C ALA A 50 39.396 64.554 54.046 1.00 4.94 A +ATOM 340 O ALA A 50 40.349 64.694 54.833 1.00 4.87 A +ATOM 341 CB ALA A 50 39.764 63.973 51.649 1.00 5.66 A +ATOM 342 N ARG A 51 38.327 65.338 54.078 1.00 5.38 A +ATOM 343 CA ARG A 51 38.260 66.439 55.051 1.00 5.49 A +ATOM 344 C ARG A 51 38.200 65.950 56.478 1.00 5.04 A +ATOM 345 O ARG A 51 38.845 66.565 57.349 1.00 6.12 A +ATOM 346 CB ARG A 51 37.136 67.419 54.730 1.00 6.73 A +ATOM 347 CG ARG A 51 37.074 68.640 55.631 1.00 7.56 A +ATOM 348 CD ARG A 51 36.205 69.722 55.064 1.00 8.32 A +ATOM 349 NE ARG A 51 36.735 70.418 53.902 1.00 8.95 A +ATOM 350 CZ ARG A 51 37.601 71.442 53.925 1.00 9.18 A +ATOM 351 NH1 ARG A 51 38.084 71.924 55.070 1.00 8.39 A +ATOM 352 NH2 ARG A 51 37.999 71.993 52.772 1.00 10.81 A +ATOM 353 N GLN A 52 37.460 64.896 56.762 1.00 4.75 A +ATOM 354 CA GLN A 52 37.375 64.365 58.134 1.00 4.61 A +ATOM 355 C GLN A 52 38.755 63.848 58.546 1.00 4.34 A +ATOM 356 O GLN A 52 39.161 64.060 59.715 1.00 4.87 A +ATOM 357 CB GLN A 52 36.296 63.303 58.235 1.00 5.74 A +ATOM 358 CG GLN A 52 36.148 62.806 59.657 1.00 5.80 A +ATOM 359 CD GLN A 52 35.679 63.854 60.622 1.00 6.30 A +ATOM 360 OE1 GLN A 52 34.471 64.133 60.690 1.00 7.97 A +ATOM 361 NE2 GLN A 52 36.576 64.428 61.386 1.00 7.04 A +ATOM 362 N SER A 53 39.438 63.125 57.667 1.00 4.36 A +ATOM 363 CA SER A 53 40.796 62.658 58.016 1.00 4.64 A +ATOM 364 C SER A 53 41.730 63.831 58.319 1.00 4.34 A +ATOM 365 O SER A 53 42.486 63.783 59.298 1.00 4.42 A +ATOM 366 CB SER A 53 41.346 61.801 56.895 1.00 5.03 A +ATOM 367 OG SER A 53 40.874 60.480 56.920 1.00 7.71 A +ATOM 368 N LEU A 54 41.672 64.858 57.494 1.00 4.12 A +ATOM 369 CA LEU A 54 42.501 66.053 57.715 1.00 4.70 A +ATOM 370 C LEU A 54 42.130 66.747 59.020 1.00 3.93 A +ATOM 371 O LEU A 54 43.026 67.222 59.740 1.00 4.71 A +ATOM 372 CB LEU A 54 42.407 66.961 56.508 1.00 5.03 A +ATOM 373 CG LEU A 54 43.166 66.430 55.288 1.00 5.82 A +ATOM 374 CD1 LEU A 54 42.760 67.223 54.045 1.00 5.88 A +ATOM 375 CD2 LEU A 54 44.673 66.492 55.463 1.00 6.70 A +ATOM 376 N ASP A 55 40.853 66.819 59.334 1.00 4.46 A +ATOM 377 CA ASP A 55 40.440 67.461 60.595 1.00 4.76 A +ATOM 378 C ASP A 55 40.976 66.648 61.777 1.00 5.09 A +ATOM 379 O ASP A 55 41.316 67.240 62.801 1.00 4.83 A +ATOM 380 CB ASP A 55 38.926 67.603 60.620 1.00 6.75 A +ATOM 381 CG ASP A 55 38.396 68.831 59.894 1.00 8.66 A +ATOM 382 OD1 ASP A 55 37.229 68.842 59.457 1.00 10.67 A +ATOM 383 OD2 ASP A 55 39.156 69.804 59.813 1.00 10.74 A +ATOM 384 N ASN A 56 40.966 65.338 61.607 1.00 4.45 A +ATOM 385 CA ASN A 56 41.477 64.473 62.713 1.00 3.71 A +ATOM 386 C ASN A 56 42.971 64.745 62.874 1.00 3.25 A +ATOM 387 O ASN A 56 43.473 64.821 64.018 1.00 4.24 A +ATOM 388 CB ASN A 56 41.182 62.994 62.455 1.00 4.47 A +ATOM 389 CG ASN A 56 39.696 62.707 62.655 1.00 4.53 A +ATOM 390 OD1 ASN A 56 38.956 63.521 63.249 1.00 5.62 A +ATOM 391 ND2 ASN A 56 39.213 61.580 62.124 1.00 4.94 A +ATOM 392 N VAL A 57 43.710 64.803 61.766 1.00 4.41 A +ATOM 393 CA VAL A 57 45.156 65.125 61.842 1.00 4.09 A +ATOM 394 C VAL A 57 45.322 66.462 62.535 1.00 3.73 A +ATOM 395 O VAL A 57 46.150 66.644 63.454 1.00 4.05 A +ATOM 396 CB VAL A 57 45.777 65.167 60.449 1.00 4.49 A +ATOM 397 CG1 VAL A 57 47.143 65.858 60.478 1.00 5.66 A +ATOM 398 CG2 VAL A 57 45.886 63.791 59.829 1.00 5.00 A +ATOM 399 N LYS A 58 44.563 67.461 62.121 1.00 3.78 A +ATOM 400 CA LYS A 58 44.626 68.814 62.701 1.00 4.51 A +ATOM 401 C LYS A 58 44.385 68.786 64.200 1.00 4.64 A +ATOM 402 O LYS A 58 45.078 69.453 64.970 1.00 4.91 A +ATOM 403 CB LYS A 58 43.566 69.685 62.023 1.00 5.87 A +ATOM 404 CG LYS A 58 43.368 71.037 62.715 1.00 6.61 A +ATOM 405 CD LYS A 58 42.422 71.911 61.914 1.00 8.95 A +ATOM 406 CE LYS A 58 41.827 73.036 62.736 1.00 9.79 A +ATOM 407 NZ LYS A 58 40.944 73.903 61.926 1.00 10.97 A +ATOM 408 N ALA A 59 43.393 68.027 64.648 1.00 4.57 A +ATOM 409 CA ALA A 59 43.097 67.955 66.089 1.00 4.83 A +ATOM 410 C ALA A 59 44.313 67.483 66.884 1.00 4.63 A +ATOM 411 O ALA A 59 44.584 67.996 67.993 1.00 4.41 A +ATOM 412 CB ALA A 59 41.941 67.000 66.337 1.00 5.64 A +ATOM 413 N ILE A 60 45.015 66.485 66.365 1.00 4.27 A +ATOM 414 CA ILE A 60 46.183 65.916 67.056 1.00 4.66 A +ATOM 415 C ILE A 60 47.337 66.898 67.056 1.00 3.81 A +ATOM 416 O ILE A 60 48.023 67.079 68.071 1.00 4.20 A +ATOM 417 CB ILE A 60 46.509 64.546 66.403 1.00 4.36 A +ATOM 418 CG1 ILE A 60 45.317 63.588 66.623 1.00 4.56 A +ATOM 419 CG2 ILE A 60 47.835 63.966 66.941 1.00 4.23 A +ATOM 420 CD1 ILE A 60 45.375 62.373 65.655 1.00 5.34 A +ATOM 421 N VAL A 61 47.603 67.504 65.896 1.00 3.65 A +ATOM 422 CA VAL A 61 48.677 68.511 65.787 1.00 4.56 A +ATOM 423 C VAL A 61 48.400 69.698 66.702 1.00 4.22 A +ATOM 424 O VAL A 61 49.299 70.160 67.411 1.00 4.43 A +ATOM 425 CB VAL A 61 48.830 68.907 64.309 1.00 4.74 A +ATOM 426 CG1 VAL A 61 49.722 70.122 64.101 1.00 5.69 A +ATOM 427 CG2 VAL A 61 49.318 67.725 63.493 1.00 5.47 A +ATOM 428 N GLU A 62 47.153 70.151 66.723 1.00 4.43 A +ATOM 429 CA GLU A 62 46.812 71.288 67.592 1.00 4.95 A +ATOM 430 C GLU A 62 46.887 70.885 69.052 1.00 5.30 A +ATOM 431 O GLU A 62 47.256 71.723 69.907 1.00 5.38 A +ATOM 432 CB GLU A 62 45.453 71.893 67.274 1.00 5.58 A +ATOM 433 CG GLU A 62 45.458 72.586 65.906 1.00 7.08 A +ATOM 434 CD GLU A 62 44.237 73.352 65.533 1.00 8.46 A +ATOM 435 OE1 GLU A 62 44.288 74.252 64.697 1.00 10.06 A +ATOM 436 OE2 GLU A 62 43.157 73.067 66.109 1.00 10.50 A +ATOM 437 N ALA A 63 46.584 69.650 69.401 1.00 5.02 A +ATOM 438 CA ALA A 63 46.655 69.190 70.802 1.00 4.80 A +ATOM 439 C ALA A 63 48.101 69.229 71.281 1.00 4.67 A +ATOM 440 O ALA A 63 48.351 69.284 72.498 1.00 5.23 A +ATOM 441 CB ALA A 63 46.025 67.832 70.900 1.00 4.87 A +ATOM 442 N ALA A 64 49.063 69.195 70.374 1.00 4.95 A +ATOM 443 CA ALA A 64 50.469 69.277 70.725 1.00 5.12 A +ATOM 444 C ALA A 64 50.966 70.720 70.686 1.00 5.56 A +ATOM 445 O ALA A 64 52.193 70.916 70.844 1.00 6.36 A +ATOM 446 CB ALA A 64 51.305 68.378 69.816 1.00 6.01 A +ATOM 447 N GLY A 65 50.111 71.682 70.458 1.00 5.32 A +ATOM 448 CA GLY A 65 50.514 73.092 70.438 1.00 5.69 A +ATOM 449 C GLY A 65 50.980 73.563 69.073 1.00 5.00 A +ATOM 450 O GLY A 65 51.580 74.662 69.029 1.00 6.60 A +ATOM 451 N LEU A 66 50.731 72.813 68.006 1.00 4.89 A +ATOM 452 CA LEU A 66 51.180 73.201 66.660 1.00 5.10 A +ATOM 453 C LEU A 66 49.989 73.579 65.820 1.00 5.52 A +ATOM 454 O LEU A 66 48.832 73.428 66.215 1.00 6.12 A +ATOM 455 CB LEU A 66 52.009 72.059 66.064 1.00 5.47 A +ATOM 456 CG LEU A 66 53.366 71.886 66.729 1.00 7.05 A +ATOM 457 CD1 LEU A 66 54.150 70.805 65.995 1.00 7.79 A +ATOM 458 CD2 LEU A 66 54.124 73.209 66.813 1.00 8.50 A +ATOM 459 N LYS A 67 50.268 74.007 64.601 1.00 5.84 A +ATOM 460 CA LYS A 67 49.228 74.408 63.637 1.00 6.22 A +ATOM 461 C LYS A 67 49.343 73.532 62.402 1.00 5.40 A +ATOM 462 O LYS A 67 50.377 72.892 62.130 1.00 5.50 A +ATOM 463 CB LYS A 67 49.489 75.855 63.194 1.00 8.08 A +ATOM 464 CG LYS A 67 49.479 76.860 64.348 1.00 10.38 A +ATOM 465 CD LYS A 67 49.838 78.259 63.839 1.00 13.10 A +ATOM 466 CE LYS A 67 49.778 79.272 64.978 1.00 14.74 A +ATOM 467 NZ LYS A 67 49.892 80.648 64.415 1.00 16.76 A +ATOM 468 N VAL A 68 48.260 73.571 61.611 1.00 5.45 A +ATOM 469 CA VAL A 68 48.274 72.874 60.318 1.00 5.05 A +ATOM 470 C VAL A 68 49.501 73.341 59.513 1.00 5.56 A +ATOM 471 O VAL A 68 50.091 72.512 58.804 1.00 5.83 A +ATOM 472 CB VAL A 68 46.958 73.124 59.566 1.00 5.97 A +ATOM 473 CG1 VAL A 68 47.047 72.733 58.097 1.00 6.44 A +ATOM 474 CG2 VAL A 68 45.781 72.484 60.292 1.00 7.15 A +ATOM 475 N GLY A 69 49.861 74.607 59.620 1.00 5.71 A +ATOM 476 CA GLY A 69 51.014 75.148 58.890 1.00 6.22 A +ATOM 477 C GLY A 69 52.347 74.533 59.314 1.00 5.67 A +ATOM 478 O GLY A 69 53.347 74.754 58.601 1.00 6.75 A +ATOM 479 N ASP A 70 52.380 73.824 60.435 1.00 4.83 A +ATOM 480 CA ASP A 70 53.599 73.148 60.912 1.00 5.11 A +ATOM 481 C ASP A 70 53.725 71.723 60.358 1.00 4.14 A +ATOM 482 O ASP A 70 54.733 71.075 60.662 1.00 4.50 A +ATOM 483 CB ASP A 70 53.647 73.177 62.438 1.00 5.29 A +ATOM 484 CG ASP A 70 53.641 74.595 63.006 1.00 6.10 A +ATOM 485 OD1 ASP A 70 52.875 74.820 63.965 1.00 6.91 A +ATOM 486 OD2 ASP A 70 54.367 75.421 62.444 1.00 6.71 A +ATOM 487 N ILE A 71 52.727 71.273 59.653 1.00 4.31 A +ATOM 488 CA ILE A 71 52.803 69.910 59.080 1.00 4.32 A +ATOM 489 C ILE A 71 53.793 69.964 57.903 1.00 3.98 A +ATOM 490 O ILE A 71 53.583 70.796 57.004 1.00 5.01 A +ATOM 491 CB ILE A 71 51.394 69.417 58.633 1.00 4.70 A +ATOM 492 CG1 ILE A 71 50.449 69.260 59.861 1.00 4.36 A +ATOM 493 CG2 ILE A 71 51.552 68.095 57.847 1.00 4.30 A +ATOM 494 CD1 ILE A 71 48.952 69.090 59.494 1.00 4.71 A +ATOM 495 N VAL A 72 54.776 69.082 57.918 1.00 3.47 A +ATOM 496 CA VAL A 72 55.822 69.101 56.889 1.00 3.99 A +ATOM 497 C VAL A 72 55.826 67.872 56.023 1.00 3.90 A +ATOM 498 O VAL A 72 56.434 67.929 54.930 1.00 4.27 A +ATOM 499 CB VAL A 72 57.201 69.355 57.550 1.00 4.41 A +ATOM 500 CG1 VAL A 72 57.263 70.752 58.134 1.00 5.07 A +ATOM 501 CG2 VAL A 72 57.520 68.283 58.575 1.00 5.77 A +ATOM 502 N LYS A 73 55.155 66.779 56.414 1.00 3.52 A +ATOM 503 CA LYS A 73 55.125 65.579 55.571 1.00 4.16 A +ATOM 504 C LYS A 73 53.841 64.797 55.868 1.00 4.31 A +ATOM 505 O LYS A 73 53.541 64.631 57.077 1.00 4.84 A +ATOM 506 CB LYS A 73 56.294 64.647 55.893 1.00 5.02 A +ATOM 507 CG LYS A 73 56.361 63.285 55.194 1.00 5.28 A +ATOM 508 CD LYS A 73 56.411 63.319 53.682 1.00 5.37 A +ATOM 509 CE LYS A 73 56.630 61.976 53.030 1.00 6.08 A +ATOM 510 NZ LYS A 73 55.657 60.916 53.409 1.00 6.35 A +ATOM 511 N THR A 74 53.193 64.350 54.825 1.00 3.73 A +ATOM 512 CA THR A 74 52.052 63.456 55.013 1.00 3.85 A +ATOM 513 C THR A 74 52.262 62.249 54.103 1.00 3.84 A +ATOM 514 O THR A 74 53.017 62.260 53.119 1.00 3.85 A +ATOM 515 CB THR A 74 50.705 64.155 54.626 1.00 4.06 A +ATOM 516 OG1 THR A 74 50.782 64.451 53.208 1.00 4.62 A +ATOM 517 CG2 THR A 74 50.387 65.381 55.461 1.00 4.69 A +ATOM 518 N THR A 75 51.537 61.192 54.460 1.00 3.73 A +ATOM 519 CA THR A 75 51.389 60.053 53.559 1.00 4.09 A +ATOM 520 C THR A 75 49.849 59.881 53.439 1.00 4.02 A +ATOM 521 O THR A 75 49.180 59.787 54.483 1.00 4.60 A +ATOM 522 CB THR A 75 52.052 58.716 53.947 1.00 5.33 A +ATOM 523 OG1 THR A 75 53.481 59.053 53.995 1.00 6.90 A +ATOM 524 CG2 THR A 75 51.782 57.597 52.938 1.00 6.26 A +ATOM 525 N VAL A 76 49.388 59.859 52.221 1.00 3.79 A +ATOM 526 CA VAL A 76 47.970 59.705 51.923 1.00 4.37 A +ATOM 527 C VAL A 76 47.772 58.362 51.232 1.00 4.23 A +ATOM 528 O VAL A 76 48.259 58.120 50.109 1.00 5.09 A +ATOM 529 CB VAL A 76 47.518 60.873 51.017 1.00 5.09 A +ATOM 530 CG1 VAL A 76 46.034 60.718 50.674 1.00 6.10 A +ATOM 531 CG2 VAL A 76 47.745 62.256 51.642 1.00 5.44 A +ATOM 532 N PHE A 77 47.079 57.500 51.943 1.00 3.73 A +ATOM 533 CA PHE A 77 46.755 56.152 51.434 1.00 4.03 A +ATOM 534 C PHE A 77 45.307 56.221 50.948 1.00 3.31 A +ATOM 535 O PHE A 77 44.458 56.607 51.785 1.00 5.04 A +ATOM 536 CB PHE A 77 46.861 55.114 52.535 1.00 3.99 A +ATOM 537 CG PHE A 77 48.187 55.025 53.226 1.00 3.46 A +ATOM 538 CD1 PHE A 77 48.378 55.589 54.494 1.00 4.75 A +ATOM 539 CD2 PHE A 77 49.243 54.338 52.632 1.00 4.57 A +ATOM 540 CE1 PHE A 77 49.580 55.436 55.186 1.00 5.64 A +ATOM 541 CE2 PHE A 77 50.457 54.208 53.314 1.00 5.55 A +ATOM 542 CZ PHE A 77 50.626 54.721 54.585 1.00 5.75 A +ATOM 543 N VAL A 78 45.018 55.872 49.713 1.00 3.70 A +ATOM 544 CA VAL A 78 43.641 55.909 49.221 1.00 4.71 A +ATOM 545 C VAL A 78 43.220 54.528 48.751 1.00 4.55 A +ATOM 546 O VAL A 78 44.038 53.710 48.352 1.00 4.79 A +ATOM 547 CB VAL A 78 43.447 56.948 48.100 1.00 5.00 A +ATOM 548 CG1 VAL A 78 43.745 58.363 48.575 1.00 6.84 A +ATOM 549 CG2 VAL A 78 44.287 56.648 46.861 1.00 5.75 A +ATOM 550 N LYS A 79 41.906 54.334 48.753 1.00 5.21 A +ATOM 551 CA LYS A 79 41.315 53.107 48.222 1.00 5.74 A +ATOM 552 C LYS A 79 41.199 53.200 46.696 1.00 6.17 A +ATOM 553 O LYS A 79 41.240 52.134 46.034 1.00 6.76 A +ATOM 554 CB LYS A 79 39.956 52.842 48.840 1.00 6.81 A +ATOM 555 CG LYS A 79 39.231 51.634 48.264 1.00 8.82 A +ATOM 556 CD LYS A 79 39.989 50.323 48.396 1.00 10.71 A +ATOM 557 CE LYS A 79 39.447 49.209 47.516 1.00 11.66 A +ATOM 558 NZ LYS A 79 39.707 49.470 46.072 1.00 13.37 A +ATOM 559 N ASP A 80 41.078 54.376 46.123 1.00 6.31 A +ATOM 560 CA ASP A 80 40.898 54.487 44.661 1.00 6.74 A +ATOM 561 C ASP A 80 41.474 55.764 44.088 1.00 6.52 A +ATOM 562 O ASP A 80 40.896 56.841 44.340 1.00 7.52 A +ATOM 563 CB ASP A 80 39.382 54.361 44.370 1.00 7.41 A +ATOM 564 CG ASP A 80 39.052 54.297 42.895 1.00 8.15 A +ATOM 565 OD1 ASP A 80 37.864 54.054 42.544 1.00 10.21 A +ATOM 566 OD2 ASP A 80 39.923 54.466 42.034 1.00 8.03 A +ATOM 567 N LEU A 81 42.574 55.668 43.364 1.00 6.91 A +ATOM 568 CA LEU A 81 43.190 56.846 42.760 1.00 8.19 A +ATOM 569 C LEU A 81 42.250 57.501 41.754 1.00 8.43 A +ATOM 570 O LEU A 81 42.540 58.657 41.386 1.00 9.36 A +ATOM 571 CB LEU A 81 44.569 56.573 42.188 1.00 8.43 A +ATOM 572 CG LEU A 81 45.680 56.623 43.238 1.00 8.40 A +ATOM 573 CD1 LEU A 81 46.935 56.024 42.606 1.00 9.27 A +ATOM 574 CD2 LEU A 81 45.909 58.050 43.682 1.00 9.04 A +ATOM 575 N ASN A 82 41.191 56.839 41.326 1.00 8.67 A +ATOM 576 CA ASN A 82 40.271 57.540 40.394 1.00 9.87 A +ATOM 577 C ASN A 82 39.557 58.691 41.113 1.00 10.44 A +ATOM 578 O ASN A 82 39.033 59.592 40.434 1.00 11.63 A +ATOM 579 CB ASN A 82 39.283 56.608 39.715 1.00 10.51 A +ATOM 580 CG ASN A 82 39.992 55.772 38.642 1.00 10.87 A +ATOM 581 OD1 ASN A 82 40.917 56.248 38.003 1.00 11.41 A +ATOM 582 ND2 ASN A 82 39.530 54.538 38.505 1.00 11.83 A +ATOM 583 N ASP A 83 39.542 58.688 42.430 1.00 10.73 A +ATOM 584 CA ASP A 83 38.901 59.787 43.195 1.00 11.58 A +ATOM 585 C ASP A 83 39.956 60.809 43.606 1.00 11.57 A +ATOM 586 O ASP A 83 39.650 61.760 44.366 1.00 11.86 A +ATOM 587 CB ASP A 83 38.174 59.225 44.409 1.00 12.86 A +ATOM 588 CG ASP A 83 36.833 58.600 44.116 1.00 13.31 A +ATOM 589 OD1 ASP A 83 36.447 57.683 44.833 1.00 14.31 A +ATOM 590 OD2 ASP A 83 36.124 59.090 43.183 1.00 15.40 A +ATOM 591 N PHE A 84 41.173 60.688 43.112 1.00 11.64 A +ATOM 592 CA PHE A 84 42.211 61.630 43.566 1.00 12.27 A +ATOM 593 C PHE A 84 42.034 63.088 43.200 1.00 11.14 A +ATOM 594 O PHE A 84 42.522 63.933 43.995 1.00 10.67 A +ATOM 595 CB PHE A 84 43.608 61.082 43.296 1.00 13.85 A +ATOM 596 CG PHE A 84 44.516 61.435 44.457 1.00 15.36 A +ATOM 597 CD1 PHE A 84 45.490 62.419 44.313 1.00 16.41 A +ATOM 598 CD2 PHE A 84 44.347 60.771 45.675 1.00 15.95 A +ATOM 599 CE1 PHE A 84 46.316 62.724 45.396 1.00 17.08 A +ATOM 600 CE2 PHE A 84 45.182 61.074 46.757 1.00 16.89 A +ATOM 601 CZ PHE A 84 46.170 62.051 46.612 1.00 16.95 A +ATOM 602 N ALA A 85 41.392 63.448 42.102 1.00 10.77 A +ATOM 603 CA ALA A 85 41.220 64.879 41.794 1.00 10.60 A +ATOM 604 C ALA A 85 40.407 65.535 42.914 1.00 9.89 A +ATOM 605 O ALA A 85 40.689 66.653 43.346 1.00 9.55 A +ATOM 606 CB ALA A 85 40.575 65.072 40.425 1.00 11.44 A +ATOM 607 N THR A 86 39.403 64.784 43.359 1.00 10.27 A +ATOM 608 CA THR A 86 38.507 65.263 44.420 1.00 10.82 A +ATOM 609 C THR A 86 39.247 65.418 45.740 1.00 9.25 A +ATOM 610 O THR A 86 39.123 66.418 46.473 1.00 8.54 A +ATOM 611 CB THR A 86 37.245 64.317 44.584 1.00 12.16 A +ATOM 612 OG1 THR A 86 36.607 64.271 43.272 1.00 13.99 A +ATOM 613 CG2 THR A 86 36.315 64.815 45.690 1.00 12.79 A +ATOM 614 N VAL A 87 40.011 64.392 46.057 1.00 8.71 A +ATOM 615 CA VAL A 87 40.822 64.395 47.289 1.00 8.40 A +ATOM 616 C VAL A 87 41.809 65.555 47.232 1.00 7.98 A +ATOM 617 O VAL A 87 41.965 66.265 48.236 1.00 8.35 A +ATOM 618 CB VAL A 87 41.540 63.043 47.470 1.00 8.84 A +ATOM 619 CG1 VAL A 87 42.621 63.167 48.539 1.00 9.19 A +ATOM 620 CG2 VAL A 87 40.533 61.950 47.778 1.00 9.80 A +ATOM 621 N ASN A 88 42.472 65.711 46.109 1.00 7.83 A +ATOM 622 CA ASN A 88 43.463 66.775 45.933 1.00 9.07 A +ATOM 623 C ASN A 88 42.851 68.144 46.146 1.00 8.46 A +ATOM 624 O ASN A 88 43.450 69.026 46.768 1.00 7.86 A +ATOM 625 CB ASN A 88 44.145 66.740 44.572 1.00 10.40 A +ATOM 626 CG ASN A 88 45.540 66.169 44.610 1.00 11.76 A +ATOM 627 OD1 ASN A 88 46.210 66.239 45.662 1.00 12.61 A +ATOM 628 ND2 ASN A 88 45.921 65.615 43.454 1.00 13.35 A +ATOM 629 N ALA A 89 41.664 68.340 45.587 1.00 7.67 A +ATOM 630 CA ALA A 89 40.975 69.637 45.742 1.00 7.58 A +ATOM 631 C ALA A 89 40.678 69.934 47.212 1.00 6.88 A +ATOM 632 O ALA A 89 40.867 71.066 47.682 1.00 7.11 A +ATOM 633 CB ALA A 89 39.713 69.635 44.884 1.00 8.02 A +ATOM 634 N THR A 90 40.173 68.916 47.898 1.00 7.04 A +ATOM 635 CA THR A 90 39.858 69.089 49.326 1.00 7.07 A +ATOM 636 C THR A 90 41.132 69.328 50.133 1.00 6.37 A +ATOM 637 O THR A 90 41.163 70.183 51.031 1.00 6.22 A +ATOM 638 CB THR A 90 39.083 67.823 49.853 1.00 7.91 A +ATOM 639 OG1 THR A 90 37.752 67.848 49.254 1.00 10.49 A +ATOM 640 CG2 THR A 90 39.020 67.792 51.378 1.00 9.07 A +ATOM 641 N TYR A 91 42.164 68.549 49.837 1.00 6.16 A +ATOM 642 CA TYR A 91 43.451 68.653 50.539 1.00 5.79 A +ATOM 643 C TYR A 91 44.026 70.048 50.341 1.00 5.81 A +ATOM 644 O TYR A 91 44.488 70.724 51.278 1.00 6.66 A +ATOM 645 CB TYR A 91 44.344 67.546 50.008 1.00 5.88 A +ATOM 646 CG TYR A 91 45.698 67.369 50.645 1.00 5.59 A +ATOM 647 CD1 TYR A 91 45.958 66.295 51.497 1.00 5.96 A +ATOM 648 CD2 TYR A 91 46.730 68.267 50.394 1.00 6.04 A +ATOM 649 CE1 TYR A 91 47.210 66.067 52.070 1.00 5.47 A +ATOM 650 CE2 TYR A 91 47.994 68.093 50.940 1.00 6.05 A +ATOM 651 CZ TYR A 91 48.210 66.985 51.768 1.00 5.90 A +ATOM 652 OH TYR A 91 49.467 66.804 52.315 1.00 5.93 A +ATOM 653 N GLU A 92 44.002 70.502 49.095 1.00 6.05 A +ATOM 654 CA GLU A 92 44.514 71.841 48.771 1.00 6.75 A +ATOM 655 C GLU A 92 43.765 72.917 49.548 1.00 6.71 A +ATOM 656 O GLU A 92 44.350 73.846 50.151 1.00 7.08 A +ATOM 657 CB GLU A 92 44.437 72.138 47.269 1.00 8.59 A +ATOM 658 CG GLU A 92 44.989 73.518 46.875 1.00 11.80 A +ATOM 659 CD GLU A 92 45.544 73.634 45.500 1.00 15.28 A +ATOM 660 OE1 GLU A 92 46.349 74.486 45.106 1.00 18.01 A +ATOM 661 OE2 GLU A 92 45.182 72.757 44.704 1.00 17.25 A +ATOM 662 N ALA A 93 42.434 72.824 49.534 1.00 6.56 A +ATOM 663 CA ALA A 93 41.573 73.786 50.239 1.00 7.09 A +ATOM 664 C ALA A 93 41.900 73.817 51.726 1.00 6.90 A +ATOM 665 O ALA A 93 42.030 74.895 52.313 1.00 7.00 A +ATOM 666 CB ALA A 93 40.092 73.460 50.036 1.00 7.57 A +ATOM 667 N PHE A 94 42.042 72.618 52.302 1.00 6.67 A +ATOM 668 CA PHE A 94 42.332 72.516 53.752 1.00 6.61 A +ATOM 669 C PHE A 94 43.597 73.288 54.131 1.00 5.97 A +ATOM 670 O PHE A 94 43.607 74.054 55.105 1.00 6.59 A +ATOM 671 CB PHE A 94 42.401 71.034 54.101 1.00 7.02 A +ATOM 672 CG PHE A 94 42.599 70.771 55.555 1.00 7.23 A +ATOM 673 CD1 PHE A 94 41.464 70.713 56.358 1.00 8.12 A +ATOM 674 CD2 PHE A 94 43.862 70.605 56.098 1.00 8.71 A +ATOM 675 CE1 PHE A 94 41.545 70.478 57.717 1.00 9.74 A +ATOM 676 CE2 PHE A 94 43.979 70.367 57.485 1.00 9.96 A +ATOM 677 CZ PHE A 94 42.813 70.332 58.243 1.00 9.82 A +ATOM 678 N PHE A 95 44.675 73.086 53.389 1.00 5.98 A +ATOM 679 CA PHE A 95 45.951 73.781 53.651 1.00 6.00 A +ATOM 680 C PHE A 95 45.784 75.281 53.417 1.00 6.18 A +ATOM 681 O PHE A 95 46.266 76.101 54.226 1.00 6.81 A +ATOM 682 CB PHE A 95 47.140 73.124 52.962 1.00 6.51 A +ATOM 683 CG PHE A 95 47.524 71.874 53.714 1.00 6.57 A +ATOM 684 CD1 PHE A 95 47.028 70.622 53.373 1.00 7.43 A +ATOM 685 CD2 PHE A 95 48.341 71.976 54.850 1.00 6.79 A +ATOM 686 CE1 PHE A 95 47.329 69.479 54.111 1.00 7.20 A +ATOM 687 CE2 PHE A 95 48.669 70.841 55.584 1.00 7.08 A +ATOM 688 CZ PHE A 95 48.145 69.594 55.238 1.00 7.03 A +ATOM 689 N THR A 96 45.112 75.622 52.319 1.00 6.49 A +ATOM 690 CA THR A 96 44.897 77.053 52.019 1.00 8.11 A +ATOM 691 C THR A 96 44.112 77.732 53.131 1.00 7.33 A +ATOM 692 O THR A 96 44.429 78.891 53.504 1.00 7.70 A +ATOM 693 CB THR A 96 44.186 77.231 50.627 1.00 9.27 A +ATOM 694 OG1 THR A 96 45.085 76.633 49.670 1.00 11.25 A +ATOM 695 CG2 THR A 96 43.881 78.696 50.311 1.00 9.94 A +ATOM 696 N GLU A 97 43.106 77.060 53.665 1.00 7.31 A +ATOM 697 CA GLU A 97 42.266 77.615 54.743 1.00 8.29 A +ATOM 698 C GLU A 97 43.102 77.942 55.957 1.00 7.86 A +ATOM 699 O GLU A 97 42.748 78.850 56.745 1.00 9.08 A +ATOM 700 CB GLU A 97 41.175 76.606 55.168 1.00 8.63 A +ATOM 701 CG GLU A 97 40.094 76.405 54.068 1.00 9.19 A +ATOM 702 CD GLU A 97 39.441 75.045 54.140 1.00 9.70 A +ATOM 703 OE1 GLU A 97 39.587 74.338 55.128 1.00 10.55 A +ATOM 704 OE2 GLU A 97 38.781 74.714 53.131 1.00 11.38 A +ATOM 705 N HIS A 98 44.220 77.252 56.159 1.00 7.67 A +ATOM 706 CA HIS A 98 45.097 77.458 57.305 1.00 7.40 A +ATOM 707 C HIS A 98 46.321 78.282 56.958 1.00 7.94 A +ATOM 708 O HIS A 98 47.288 78.280 57.751 1.00 8.19 A +ATOM 709 CB HIS A 98 45.506 76.069 57.908 1.00 7.48 A +ATOM 710 CG HIS A 98 44.303 75.377 58.471 1.00 7.83 A +ATOM 711 ND1 HIS A 98 43.472 74.517 57.790 1.00 7.93 A +ATOM 712 CD2 HIS A 98 43.815 75.452 59.750 1.00 8.60 A +ATOM 713 CE1 HIS A 98 42.522 74.117 58.614 1.00 8.30 A +ATOM 714 NE2 HIS A 98 42.697 74.649 59.801 1.00 9.30 A +ATOM 715 N ASN A 99 46.291 78.931 55.806 1.00 8.01 A +ATOM 716 CA ASN A 99 47.423 79.752 55.341 1.00 8.93 A +ATOM 717 C ASN A 99 48.728 78.974 55.499 1.00 7.82 A +ATOM 718 O ASN A 99 49.777 79.517 55.928 1.00 8.81 A +ATOM 719 CB ASN A 99 47.463 81.061 56.144 1.00 10.58 A +ATOM 720 CG ASN A 99 48.447 82.056 55.546 1.00 11.86 A +ATOM 721 OD1 ASN A 99 48.653 82.042 54.320 1.00 13.08 A +ATOM 722 ND2 ASN A 99 49.031 82.877 56.417 1.00 13.49 A +ATOM 723 N ALA A 100 48.690 77.711 55.106 1.00 7.10 A +ATOM 724 CA ALA A 100 49.808 76.792 55.270 1.00 7.43 A +ATOM 725 C ALA A 100 50.563 76.441 54.005 1.00 8.24 A +ATOM 726 O ALA A 100 49.904 76.191 52.988 1.00 9.53 A +ATOM 727 CB ALA A 100 49.262 75.483 55.884 1.00 7.38 A +ATOM 728 N THR A 101 51.880 76.411 54.110 1.00 7.83 A +ATOM 729 CA THR A 101 52.694 75.927 52.985 1.00 8.26 A +ATOM 730 C THR A 101 52.331 74.436 52.883 1.00 7.07 A +ATOM 731 O THR A 101 52.184 73.774 53.936 1.00 7.16 A +ATOM 732 CB THR A 101 54.229 76.107 53.292 1.00 9.39 A +ATOM 733 OG1 THR A 101 54.419 77.548 53.397 1.00 10.96 A +ATOM 734 CG2 THR A 101 55.144 75.476 52.244 1.00 10.68 A +ATOM 735 N PHE A 102 52.245 73.911 51.687 1.00 6.83 A +ATOM 736 CA PHE A 102 51.894 72.488 51.556 1.00 6.82 A +ATOM 737 C PHE A 102 53.025 71.584 52.049 1.00 6.10 A +ATOM 738 O PHE A 102 54.203 71.847 51.781 1.00 6.28 A +ATOM 739 CB PHE A 102 51.600 72.146 50.095 1.00 7.29 A +ATOM 740 CG PHE A 102 50.546 72.979 49.431 1.00 7.87 A +ATOM 741 CD1 PHE A 102 50.799 73.681 48.256 1.00 8.98 A +ATOM 742 CD2 PHE A 102 49.264 73.053 49.997 1.00 7.94 A +ATOM 743 CE1 PHE A 102 49.822 74.451 47.641 1.00 10.13 A +ATOM 744 CE2 PHE A 102 48.256 73.816 49.401 1.00 8.74 A +ATOM 745 CZ PHE A 102 48.548 74.523 48.219 1.00 9.67 A +ATOM 746 N PRO A 103 52.655 70.515 52.750 1.00 6.23 A +ATOM 747 CA PRO A 103 53.723 69.588 53.188 1.00 6.02 A +ATOM 748 C PRO A 103 54.299 68.798 52.008 1.00 4.53 A +ATOM 749 O PRO A 103 53.729 68.719 50.898 1.00 4.36 A +ATOM 750 CB PRO A 103 52.895 68.557 54.011 1.00 7.30 A +ATOM 751 CG PRO A 103 51.613 69.236 54.398 1.00 7.26 A +ATOM 752 CD PRO A 103 51.314 70.155 53.207 1.00 6.81 A +ATOM 753 N ALA A 104 55.432 68.152 52.268 1.00 4.08 A +ATOM 754 CA ALA A 104 55.928 67.093 51.379 1.00 3.99 A +ATOM 755 C ALA A 104 54.866 65.961 51.514 1.00 3.68 A +ATOM 756 O ALA A 104 54.135 65.862 52.531 1.00 4.10 A +ATOM 757 CB ALA A 104 57.278 66.624 51.799 1.00 4.60 A +ATOM 758 N ARG A 105 54.754 65.116 50.488 1.00 4.14 A +ATOM 759 CA ARG A 105 53.701 64.091 50.483 1.00 4.07 A +ATOM 760 C ARG A 105 54.037 62.865 49.676 1.00 3.75 A +ATOM 761 O ARG A 105 54.784 62.974 48.671 1.00 3.67 A +ATOM 762 CB ARG A 105 52.439 64.776 49.844 1.00 5.04 A +ATOM 763 CG ARG A 105 51.168 63.932 49.901 1.00 6.68 A +ATOM 764 CD ARG A 105 49.920 64.669 49.471 1.00 7.36 A +ATOM 765 NE ARG A 105 49.942 64.950 48.059 1.00 9.16 A +ATOM 766 CZ ARG A 105 48.872 65.406 47.372 1.00 9.60 A +ATOM 767 NH1 ARG A 105 48.897 65.570 46.061 1.00 10.15 A +ATOM 768 NH2 ARG A 105 47.767 65.757 48.029 1.00 9.57 A +ATOM 769 N SER A 106 53.519 61.735 50.143 1.00 3.97 A +ATOM 770 CA SER A 106 53.565 60.496 49.356 1.00 4.51 A +ATOM 771 C SER A 106 52.082 60.072 49.212 1.00 4.12 A +ATOM 772 O SER A 106 51.289 60.266 50.144 1.00 4.73 A +ATOM 773 CB SER A 106 54.353 59.374 49.959 1.00 5.49 A +ATOM 774 OG SER A 106 55.710 59.796 49.957 1.00 6.48 A +HETATM 775 N CSP A 107 51.758 59.505 48.054 1.00 4.52 A +HETATM 776 CA CSP A 107 50.378 59.129 47.760 1.00 5.72 A +HETATM 777 CB CSP A 107 49.700 60.089 46.804 0.67 8.42 A +HETATM 779 SG CSP A 107 49.776 61.809 47.227 0.67 12.80 A +HETATM 780 P CSP A 107 51.167 62.354 45.759 0.67 14.01 A +HETATM 781 O1P CSP A 107 52.330 61.495 45.839 0.67 15.06 A +HETATM 782 O2P CSP A 107 50.515 62.084 44.369 0.67 15.90 A +HETATM 783 O3P CSP A 107 51.332 63.867 45.931 0.67 14.77 A +HETATM 784 C CSP A 107 50.355 57.779 47.046 1.00 4.97 A +HETATM 785 O CSP A 107 51.024 57.644 45.986 1.00 4.62 A +ATOM 787 N VAL A 108 49.572 56.859 47.551 1.00 4.59 A +ATOM 788 CA VAL A 108 49.485 55.529 46.918 1.00 4.55 A +ATOM 789 C VAL A 108 48.074 55.005 47.075 1.00 4.55 A +ATOM 790 O VAL A 108 47.373 55.353 48.046 1.00 4.69 A +ATOM 791 CB VAL A 108 50.491 54.549 47.594 1.00 4.96 A +ATOM 792 CG1 VAL A 108 51.949 54.998 47.484 1.00 5.33 A +ATOM 793 CG2 VAL A 108 50.132 54.200 49.027 1.00 6.15 A +ATOM 794 N GLU A 109 47.680 54.097 46.183 1.00 4.88 A +ATOM 795 CA GLU A 109 46.413 53.393 46.293 1.00 4.49 A +ATOM 796 C GLU A 109 46.709 52.038 46.954 1.00 4.13 A +ATOM 797 O GLU A 109 47.528 51.280 46.405 1.00 5.16 A +ATOM 798 CB GLU A 109 45.767 53.124 44.938 1.00 5.33 A +ATOM 799 CG GLU A 109 44.371 52.523 45.089 1.00 5.37 A +ATOM 800 CD GLU A 109 43.764 52.168 43.746 1.00 6.00 A +ATOM 801 OE1 GLU A 109 43.382 51.012 43.552 1.00 7.16 A +ATOM 802 OE2 GLU A 109 43.683 53.105 42.917 1.00 5.73 A +ATOM 803 N VAL A 110 46.081 51.785 48.087 1.00 4.12 A +ATOM 804 CA VAL A 110 46.266 50.496 48.778 1.00 5.16 A +ATOM 805 C VAL A 110 45.106 49.561 48.429 1.00 4.97 A +ATOM 806 O VAL A 110 44.159 49.994 47.748 1.00 5.83 A +ATOM 807 CB VAL A 110 46.324 50.727 50.295 1.00 5.61 A +ATOM 808 CG1 VAL A 110 47.521 51.594 50.678 1.00 6.03 A +ATOM 809 CG2 VAL A 110 45.036 51.320 50.844 1.00 5.94 A +ATOM 810 N ALA A 111 45.198 48.309 48.840 1.00 5.19 A +ATOM 811 CA ALA A 111 44.126 47.352 48.558 1.00 5.46 A +ATOM 812 C ALA A 111 42.900 47.562 49.429 1.00 5.34 A +ATOM 813 O ALA A 111 41.750 47.334 48.964 1.00 6.46 A +ATOM 814 CB ALA A 111 44.653 45.917 48.746 1.00 5.06 A +ATOM 815 N ARG A 112 43.091 47.959 50.685 1.00 5.42 A +ATOM 816 CA ARG A 112 41.972 48.127 51.619 1.00 5.97 A +ATOM 817 C ARG A 112 42.478 48.900 52.817 1.00 5.15 A +ATOM 818 O ARG A 112 43.687 48.874 53.130 1.00 5.33 A +ATOM 819 CB ARG A 112 41.486 46.742 52.068 1.00 5.86 A +ATOM 820 CG ARG A 112 40.113 46.714 52.715 1.00 7.01 A +ATOM 821 CD ARG A 112 39.755 45.315 53.123 1.00 7.87 A +ATOM 822 NE ARG A 112 38.438 45.315 53.754 1.00 9.03 A +ATOM 823 CZ ARG A 112 37.936 44.312 54.495 1.00 9.58 A +ATOM 824 NH1 ARG A 112 36.706 44.464 55.015 1.00 10.53 A +ATOM 825 NH2 ARG A 112 38.619 43.181 54.677 1.00 10.02 A +ATOM 826 N LEU A 113 41.571 49.596 53.475 1.00 5.16 A +ATOM 827 CA LEU A 113 41.860 50.392 54.662 1.00 5.23 A +ATOM 828 C LEU A 113 40.958 49.961 55.800 1.00 5.70 A +ATOM 829 O LEU A 113 39.890 49.350 55.580 1.00 6.10 A +ATOM 830 CB LEU A 113 41.632 51.873 54.335 1.00 5.50 A +ATOM 831 CG LEU A 113 42.649 52.474 53.370 1.00 5.34 A +ATOM 832 CD1 LEU A 113 42.176 53.859 52.921 1.00 5.70 A +ATOM 833 CD2 LEU A 113 44.032 52.557 54.010 1.00 4.99 A +ATOM 834 N PRO A 114 41.361 50.268 57.024 1.00 6.67 A +ATOM 835 CA PRO A 114 40.539 49.934 58.195 1.00 7.38 A +ATOM 836 C PRO A 114 39.124 50.475 57.984 1.00 7.04 A +ATOM 837 O PRO A 114 38.861 51.586 57.489 1.00 7.08 A +ATOM 838 CB PRO A 114 41.239 50.649 59.357 1.00 7.55 A +ATOM 839 CG PRO A 114 42.679 50.756 58.922 1.00 7.89 A +ATOM 840 CD PRO A 114 42.617 50.956 57.405 1.00 7.17 A +ATOM 841 N LYS A 115 38.152 49.650 58.370 1.00 7.96 A +ATOM 842 CA LYS A 115 36.717 49.953 58.299 1.00 9.22 A +ATOM 843 C LYS A 115 36.276 50.209 56.876 1.00 9.21 A +ATOM 844 O LYS A 115 35.203 50.835 56.725 1.00 9.21 A +ATOM 845 CB LYS A 115 36.379 51.173 59.162 1.00 10.55 A +ATOM 846 CG LYS A 115 36.740 50.934 60.632 1.00 12.98 A +ATOM 847 CD LYS A 115 36.179 52.106 61.449 1.00 15.15 A +ATOM 848 CE LYS A 115 36.188 51.791 62.932 1.00 16.92 A +ATOM 849 NZ LYS A 115 34.907 52.176 63.588 1.00 18.34 A +ATOM 850 N ASP A 116 37.020 49.783 55.882 1.00 8.41 A +ATOM 851 CA ASP A 116 36.653 50.010 54.481 1.00 8.14 A +ATOM 852 C ASP A 116 36.537 51.491 54.137 1.00 7.11 A +ATOM 853 O ASP A 116 35.783 51.846 53.192 1.00 8.04 A +ATOM 854 CB ASP A 116 35.408 49.198 54.075 1.00 9.13 A +ATOM 855 CG ASP A 116 35.783 47.712 53.984 1.00 10.16 A +ATOM 856 OD1 ASP A 116 35.295 46.977 54.853 1.00 11.23 A +ATOM 857 OD2 ASP A 116 36.542 47.365 53.069 1.00 10.06 A +ATOM 858 N VAL A 117 37.303 52.340 54.811 1.00 6.39 A +ATOM 859 CA VAL A 117 37.277 53.781 54.470 1.00 5.93 A +ATOM 860 C VAL A 117 37.988 53.972 53.123 1.00 5.45 A +ATOM 861 O VAL A 117 38.671 53.077 52.615 1.00 5.92 A +ATOM 862 CB VAL A 117 37.850 54.629 55.611 1.00 5.41 A +ATOM 863 CG1 VAL A 117 37.045 54.552 56.910 1.00 6.56 A +ATOM 864 CG2 VAL A 117 39.339 54.353 55.801 1.00 4.77 A +ATOM 865 N LYS A 118 37.861 55.159 52.599 1.00 5.60 A +ATOM 866 CA LYS A 118 38.448 55.494 51.309 1.00 5.78 A +ATOM 867 C LYS A 118 39.794 56.190 51.421 1.00 5.20 A +ATOM 868 O LYS A 118 40.449 56.351 50.398 1.00 4.89 A +ATOM 869 CB LYS A 118 37.481 56.401 50.545 1.00 6.48 A +ATOM 870 CG LYS A 118 36.142 55.766 50.197 1.00 8.03 A +ATOM 871 CD LYS A 118 35.093 56.681 49.587 1.00 10.35 A +ATOM 872 CE LYS A 118 33.779 55.939 49.354 1.00 12.02 A +ATOM 873 NZ LYS A 118 32.708 56.770 48.768 1.00 13.89 A +ATOM 874 N ILE A 119 40.201 56.595 52.620 1.00 4.72 A +ATOM 875 CA ILE A 119 41.442 57.347 52.805 1.00 4.45 A +ATOM 876 C ILE A 119 41.948 57.236 54.233 1.00 4.59 A +ATOM 877 O ILE A 119 41.151 57.090 55.158 1.00 4.61 A +ATOM 878 CB ILE A 119 41.166 58.835 52.378 1.00 4.91 A +ATOM 879 CG1 ILE A 119 42.496 59.638 52.307 1.00 4.94 A +ATOM 880 CG2 ILE A 119 40.145 59.557 53.294 1.00 5.42 A +ATOM 881 CD1 ILE A 119 42.276 60.967 51.552 1.00 5.66 A +ATOM 882 N GLU A 120 43.266 57.294 54.361 1.00 4.02 A +ATOM 883 CA GLU A 120 43.938 57.295 55.668 1.00 3.81 A +ATOM 884 C GLU A 120 45.119 58.249 55.491 1.00 3.77 A +ATOM 885 O GLU A 120 45.874 58.112 54.507 1.00 4.01 A +ATOM 886 CB GLU A 120 44.417 55.919 56.069 1.00 4.09 A +ATOM 887 CG GLU A 120 45.120 55.856 57.420 1.00 4.28 A +ATOM 888 CD GLU A 120 45.637 54.500 57.808 1.00 4.49 A +ATOM 889 OE1 GLU A 120 46.641 54.356 58.514 1.00 6.49 A +ATOM 890 OE2 GLU A 120 44.960 53.518 57.364 1.00 5.06 A +ATOM 891 N ILE A 121 45.302 59.173 56.418 1.00 3.35 A +ATOM 892 CA ILE A 121 46.382 60.161 56.304 1.00 3.57 A +ATOM 893 C ILE A 121 47.173 60.255 57.596 1.00 3.38 A +ATOM 894 O ILE A 121 46.614 60.488 58.665 1.00 3.55 A +ATOM 895 CB ILE A 121 45.799 61.584 56.009 1.00 4.18 A +ATOM 896 CG1 ILE A 121 44.888 61.562 54.777 1.00 5.00 A +ATOM 897 CG2 ILE A 121 46.938 62.619 55.858 1.00 5.16 A +ATOM 898 CD1 ILE A 121 44.198 62.912 54.470 1.00 5.62 A +ATOM 899 N GLU A 122 48.487 60.086 57.456 1.00 3.62 A +ATOM 900 CA GLU A 122 49.396 60.249 58.594 1.00 3.82 A +ATOM 901 C GLU A 122 50.201 61.524 58.342 1.00 3.47 A +ATOM 902 O GLU A 122 50.402 61.924 57.176 1.00 3.81 A +ATOM 903 CB GLU A 122 50.309 59.073 58.847 1.00 6.01 A +ATOM 904 CG GLU A 122 51.237 58.774 57.680 1.00 7.17 A +ATOM 905 CD GLU A 122 52.243 57.696 57.886 1.00 8.33 A +ATOM 906 OE1 GLU A 122 53.244 57.674 57.155 1.00 10.86 A +ATOM 907 OE2 GLU A 122 52.050 56.839 58.772 1.00 7.19 A +ATOM 908 N ALA A 123 50.651 62.151 59.418 1.00 4.17 A +ATOM 909 CA ALA A 123 51.377 63.409 59.272 1.00 4.16 A +ATOM 910 C ALA A 123 52.493 63.570 60.271 1.00 3.85 A +ATOM 911 O ALA A 123 52.469 62.978 61.371 1.00 4.05 A +ATOM 912 CB ALA A 123 50.429 64.603 59.479 1.00 5.43 A +ATOM 913 N ILE A 124 53.494 64.325 59.869 1.00 3.64 A +ATOM 914 CA ILE A 124 54.631 64.724 60.674 1.00 4.00 A +ATOM 915 C ILE A 124 54.613 66.259 60.714 1.00 3.37 A +ATOM 916 O ILE A 124 54.497 66.855 59.620 1.00 3.97 A +ATOM 917 CB ILE A 124 56.000 64.242 60.087 1.00 5.41 A +ATOM 918 CG1 ILE A 124 56.068 62.705 60.117 1.00 6.98 A +ATOM 919 CG2 ILE A 124 57.183 64.859 60.874 1.00 6.64 A +ATOM 920 CD1 ILE A 124 57.288 62.159 59.337 1.00 8.60 A +ATOM 921 N ALA A 125 54.752 66.842 61.880 1.00 3.70 A +ATOM 922 CA ALA A 125 54.808 68.301 62.068 1.00 4.32 A +ATOM 923 C ALA A 125 56.028 68.635 62.930 1.00 3.88 A +ATOM 924 O ALA A 125 56.523 67.777 63.665 1.00 4.96 A +ATOM 925 CB ALA A 125 53.501 68.783 62.702 1.00 5.11 A +ATOM 926 N VAL A 126 56.521 69.872 62.787 1.00 4.73 A +ATOM 927 CA VAL A 126 57.683 70.287 63.588 1.00 5.32 A +ATOM 928 C VAL A 126 57.397 71.648 64.218 1.00 5.65 A +ATOM 929 O VAL A 126 56.687 72.479 63.670 1.00 6.01 A +ATOM 930 CB VAL A 126 58.997 70.332 62.778 1.00 6.36 A +ATOM 931 CG1 VAL A 126 59.496 68.943 62.402 1.00 7.37 A +ATOM 932 CG2 VAL A 126 58.899 71.258 61.592 1.00 7.21 A +ATOM 933 N ARG A 127 58.004 71.813 65.384 1.00 5.90 A +ATOM 934 CA ARG A 127 57.867 73.105 66.095 1.00 8.86 A +ATOM 935 C ARG A 127 58.748 74.200 65.483 1.00 10.67 A +ATOM 936 O ARG A 127 58.297 75.374 65.521 1.00 12.25 A +ATOM 937 CB ARG A 127 58.270 73.010 67.564 1.00 8.97 A +ATOM 938 CG ARG A 127 57.429 71.998 68.304 1.00 8.83 A +ATOM 939 CD ARG A 127 57.632 72.173 69.812 1.00 9.65 A +ATOM 940 NE ARG A 127 56.885 71.128 70.494 1.00 8.63 A +ATOM 941 CZ ARG A 127 55.591 71.181 70.713 1.00 8.65 A +ATOM 942 NH1 ARG A 127 54.865 72.258 70.467 1.00 8.88 A +ATOM 943 NH2 ARG A 127 54.968 70.066 71.099 1.00 8.68 A +ATOM 944 N ARG A 128 59.905 73.836 65.001 1.00 12.46 A +ATOM 945 CA ARG A 128 60.872 74.766 64.407 1.00 14.89 A +ATOM 946 C ARG A 128 61.127 74.505 62.918 1.00 16.10 A +ATOM 947 O ARG A 128 61.112 73.288 62.583 1.00 17.58 A +ATOM 948 CB ARG A 128 62.222 74.648 65.151 1.00 15.67 A +ATOM 949 OXT ARG A 128 61.959 75.293 62.395 1.00 17.72 A +TER +ATOM 951 N SER B 2 62.109 75.379 59.687 1.00 16.24 B +ATOM 952 CA SER B 2 61.990 74.424 58.545 1.00 15.30 B +ATOM 953 C SER B 2 61.682 75.199 57.256 1.00 13.90 B +ATOM 954 O SER B 2 61.094 76.306 57.298 1.00 15.02 B +ATOM 955 CB SER B 2 60.983 73.331 58.796 1.00 16.11 B +ATOM 956 OG SER B 2 59.642 73.778 58.666 1.00 18.37 B +ATOM 957 N LYS B 3 62.095 74.598 56.142 1.00 12.13 B +ATOM 958 CA LYS B 3 61.881 75.274 54.855 1.00 11.35 B +ATOM 959 C LYS B 3 61.619 74.285 53.732 1.00 8.65 B +ATOM 960 O LYS B 3 61.974 73.102 53.724 1.00 7.83 B +ATOM 961 CB LYS B 3 63.089 76.165 54.508 1.00 13.69 B +ATOM 962 CG LYS B 3 64.314 75.337 54.208 1.00 15.79 B +ATOM 963 CD LYS B 3 65.631 76.074 54.056 1.00 17.79 B +ATOM 964 CE LYS B 3 66.208 76.498 55.391 1.00 18.86 B +ATOM 965 NZ LYS B 3 67.628 76.966 55.266 1.00 20.35 B +ATOM 966 N THR B 4 60.953 74.837 52.734 1.00 7.14 B +ATOM 967 CA THR B 4 60.662 74.068 51.526 1.00 6.44 B +ATOM 968 C THR B 4 61.943 73.856 50.711 1.00 5.57 B +ATOM 969 O THR B 4 62.800 74.785 50.616 1.00 6.47 B +ATOM 970 CB THR B 4 59.713 74.950 50.619 1.00 7.10 B +ATOM 971 OG1 THR B 4 58.447 75.034 51.320 1.00 8.40 B +ATOM 972 CG2 THR B 4 59.526 74.383 49.209 1.00 7.78 B +ATOM 973 N ILE B 5 62.056 72.684 50.115 1.00 4.90 B +ATOM 974 CA ILE B 5 63.114 72.395 49.139 1.00 5.03 B +ATOM 975 C ILE B 5 62.401 72.500 47.762 1.00 5.26 B +ATOM 976 O ILE B 5 61.375 71.875 47.535 1.00 5.95 B +ATOM 977 CB ILE B 5 63.748 70.997 49.304 1.00 5.22 B +ATOM 978 CG1 ILE B 5 64.326 70.810 50.722 1.00 5.41 B +ATOM 979 CG2 ILE B 5 64.802 70.734 48.204 1.00 6.47 B +ATOM 980 CD1 ILE B 5 64.678 69.334 51.050 1.00 4.98 B +ATOM 981 N ALA B 6 62.990 73.340 46.901 1.00 5.80 B +ATOM 982 CA ALA B 6 62.428 73.548 45.548 1.00 7.32 B +ATOM 983 C ALA B 6 63.599 73.578 44.573 1.00 7.57 B +ATOM 984 O ALA B 6 64.516 74.414 44.680 1.00 10.07 B +ATOM 985 CB ALA B 6 61.583 74.808 45.481 1.00 8.24 B +ATOM 986 N THR B 7 63.612 72.613 43.666 1.00 6.19 B +ATOM 987 CA THR B 7 64.681 72.481 42.676 1.00 6.55 B +ATOM 988 C THR B 7 64.145 72.188 41.286 1.00 5.76 B +ATOM 989 O THR B 7 63.171 71.468 41.146 1.00 6.20 B +ATOM 990 CB THR B 7 65.663 71.330 43.117 1.00 7.01 B +ATOM 991 OG1 THR B 7 66.622 71.214 42.032 1.00 7.16 B +ATOM 992 CG2 THR B 7 65.012 69.980 43.363 1.00 7.30 B +ATOM 993 N GLU B 8 64.754 72.807 40.282 1.00 6.37 B +ATOM 994 CA GLU B 8 64.376 72.568 38.895 1.00 6.48 B +ATOM 995 C GLU B 8 64.803 71.162 38.497 1.00 6.14 B +ATOM 996 O GLU B 8 64.341 70.650 37.460 1.00 6.07 B +ATOM 997 CB GLU B 8 65.033 73.559 37.922 1.00 7.91 B +ATOM 998 CG GLU B 8 66.540 73.490 37.722 1.00 9.70 B +ATOM 999 CD GLU B 8 67.395 74.051 38.814 1.00 11.36 B +ATOM 1000 OE1 GLU B 8 66.979 74.261 39.958 1.00 12.18 B +ATOM 1001 OE2 GLU B 8 68.603 74.276 38.489 1.00 13.35 B +ATOM 1002 N ASN B 9 65.675 70.529 39.286 1.00 6.75 B +ATOM 1003 CA ASN B 9 66.220 69.204 38.967 1.00 7.05 B +ATOM 1004 C ASN B 9 65.308 68.025 39.238 1.00 7.06 B +ATOM 1005 O ASN B 9 65.680 66.872 38.959 1.00 6.95 B +ATOM 1006 CB ASN B 9 67.590 69.019 39.590 1.00 7.91 B +ATOM 1007 CG ASN B 9 68.573 70.034 39.030 1.00 9.05 B +ATOM 1008 OD1 ASN B 9 68.514 70.332 37.816 1.00 10.43 B +ATOM 1009 ND2 ASN B 9 69.410 70.545 39.902 1.00 9.59 B +ATOM 1010 N ALA B 10 64.140 68.250 39.839 1.00 5.82 B +ATOM 1011 CA ALA B 10 63.131 67.198 40.069 1.00 5.77 B +ATOM 1012 C ALA B 10 61.835 67.795 39.464 1.00 6.13 B +ATOM 1013 O ALA B 10 61.744 69.012 39.310 1.00 5.80 B +ATOM 1014 CB ALA B 10 62.935 66.850 41.527 1.00 6.12 B +ATOM 1015 N PRO B 11 60.887 66.939 39.127 1.00 6.62 B +ATOM 1016 CA PRO B 11 59.626 67.427 38.556 1.00 6.86 B +ATOM 1017 C PRO B 11 58.991 68.470 39.432 1.00 6.78 B +ATOM 1018 O PRO B 11 58.925 68.299 40.681 1.00 6.19 B +ATOM 1019 CB PRO B 11 58.750 66.191 38.483 1.00 7.77 B +ATOM 1020 CG PRO B 11 59.680 65.012 38.512 1.00 8.11 B +ATOM 1021 CD PRO B 11 60.918 65.475 39.270 1.00 7.42 B +ATOM 1022 N ALA B 12 58.469 69.527 38.830 1.00 8.21 B +ATOM 1023 CA ALA B 12 57.836 70.624 39.572 1.00 9.55 B +ATOM 1024 C ALA B 12 56.629 70.099 40.348 1.00 10.63 B +ATOM 1025 O ALA B 12 55.909 69.197 39.905 1.00 9.79 B +ATOM 1026 CB ALA B 12 57.344 71.687 38.589 1.00 10.50 B +ATOM 1027 N ALA B 13 56.468 70.685 41.520 1.00 11.95 B +ATOM 1028 CA ALA B 13 55.363 70.356 42.435 1.00 14.35 B +ATOM 1029 C ALA B 13 54.159 71.201 42.006 1.00 15.86 B +ATOM 1030 O ALA B 13 54.077 72.361 42.446 1.00 17.22 B +ATOM 1031 CB ALA B 13 55.728 70.640 43.882 1.00 14.52 B +ATOM 1032 N ILE B 14 53.335 70.571 41.192 1.00 16.89 B +ATOM 1033 CA ILE B 14 52.121 71.268 40.701 1.00 18.21 B +ATOM 1034 C ILE B 14 50.983 71.151 41.712 1.00 18.11 B +ATOM 1035 O ILE B 14 50.420 72.218 42.096 1.00 19.37 B +ATOM 1036 CB ILE B 14 51.808 70.805 39.249 1.00 19.06 B +ATOM 1037 CG1 ILE B 14 53.063 71.045 38.352 1.00 19.75 B +ATOM 1038 CG2 ILE B 14 50.571 71.498 38.616 1.00 19.75 B +ATOM 1039 CD1 ILE B 14 52.904 70.339 36.972 1.00 20.29 B +ATOM 1040 N GLY B 15 50.671 69.955 42.164 1.00 17.28 B +ATOM 1041 CA GLY B 15 49.589 69.783 43.173 1.00 15.10 B +ATOM 1042 C GLY B 15 49.929 70.474 44.499 1.00 13.16 B +ATOM 1043 O GLY B 15 50.901 71.233 44.655 1.00 14.07 B +ATOM 1044 N PRO B 16 49.082 70.180 45.491 1.00 11.29 B +ATOM 1045 CA PRO B 16 49.214 70.743 46.834 1.00 9.14 B +ATOM 1046 C PRO B 16 50.263 70.025 47.663 1.00 8.00 B +ATOM 1047 O PRO B 16 49.940 69.393 48.680 1.00 6.68 B +ATOM 1048 CB PRO B 16 47.790 70.627 47.384 1.00 9.25 B +ATOM 1049 CG PRO B 16 47.323 69.299 46.821 1.00 9.12 B +ATOM 1050 CD PRO B 16 47.874 69.312 45.393 1.00 10.61 B +ATOM 1051 N TYR B 17 51.512 70.158 47.238 1.00 6.92 B +ATOM 1052 CA TYR B 17 52.643 69.552 47.969 1.00 6.14 B +ATOM 1053 C TYR B 17 53.900 70.301 47.559 1.00 5.54 B +ATOM 1054 O TYR B 17 53.863 71.069 46.568 1.00 7.15 B +ATOM 1055 CB TYR B 17 52.770 68.038 47.653 1.00 6.78 B +ATOM 1056 CG TYR B 17 53.035 67.760 46.184 1.00 7.73 B +ATOM 1057 CD1 TYR B 17 54.354 67.570 45.725 1.00 8.18 B +ATOM 1058 CD2 TYR B 17 52.031 67.736 45.220 1.00 8.87 B +ATOM 1059 CE1 TYR B 17 54.645 67.316 44.386 1.00 9.51 B +ATOM 1060 CE2 TYR B 17 52.309 67.498 43.868 1.00 10.50 B +ATOM 1061 CZ TYR B 17 53.612 67.302 43.463 1.00 10.45 B +ATOM 1062 OH TYR B 17 53.906 67.069 42.136 1.00 12.81 B +ATOM 1063 N VAL B 18 54.974 70.101 48.285 1.00 5.53 B +ATOM 1064 CA VAL B 18 56.302 70.616 47.936 1.00 5.01 B +ATOM 1065 C VAL B 18 57.143 69.366 47.657 1.00 5.01 B +ATOM 1066 O VAL B 18 56.823 68.264 48.112 1.00 5.04 B +ATOM 1067 CB VAL B 18 56.929 71.510 48.995 1.00 5.59 B +ATOM 1068 CG1 VAL B 18 56.116 72.797 49.086 1.00 6.33 B +ATOM 1069 CG2 VAL B 18 57.091 70.825 50.342 1.00 6.00 B +ATOM 1070 N GLN B 19 58.244 69.553 46.945 1.00 4.48 B +ATOM 1071 CA GLN B 19 59.142 68.446 46.600 1.00 4.00 B +ATOM 1072 C GLN B 19 59.775 67.805 47.834 1.00 3.80 B +ATOM 1073 O GLN B 19 60.035 66.598 47.857 1.00 3.75 B +ATOM 1074 CB GLN B 19 60.267 68.895 45.663 1.00 5.03 B +ATOM 1075 CG GLN B 19 59.743 69.363 44.310 1.00 5.44 B +ATOM 1076 CD GLN B 19 60.837 70.048 43.542 1.00 5.87 B +ATOM 1077 OE1 GLN B 19 61.623 70.789 44.130 1.00 7.44 B +ATOM 1078 NE2 GLN B 19 60.896 69.850 42.220 1.00 6.86 B +ATOM 1079 N GLY B 20 60.101 68.629 48.826 1.00 4.08 B +ATOM 1080 CA GLY B 20 60.731 68.083 50.054 1.00 3.84 B +ATOM 1081 C GLY B 20 60.795 69.194 51.077 1.00 3.63 B +ATOM 1082 O GLY B 20 60.515 70.366 50.763 1.00 3.92 B +ATOM 1083 N VAL B 21 61.175 68.820 52.293 1.00 3.33 B +ATOM 1084 CA VAL B 21 61.313 69.766 53.390 1.00 3.95 B +ATOM 1085 C VAL B 21 62.676 69.576 54.047 1.00 3.79 B +ATOM 1086 O VAL B 21 63.146 68.449 54.224 1.00 4.94 B +ATOM 1087 CB VAL B 21 60.160 69.624 54.401 1.00 3.78 B +ATOM 1088 CG1 VAL B 21 58.864 70.091 53.754 1.00 4.83 B +ATOM 1089 CG2 VAL B 21 60.047 68.190 54.888 1.00 4.51 B +ATOM 1090 N ASP B 22 63.260 70.702 54.402 1.00 4.14 B +ATOM 1091 CA ASP B 22 64.566 70.749 55.097 1.00 4.70 B +ATOM 1092 C ASP B 22 64.213 71.148 56.528 1.00 4.45 B +ATOM 1093 O ASP B 22 63.839 72.315 56.763 1.00 5.58 B +ATOM 1094 CB ASP B 22 65.504 71.720 54.398 1.00 6.22 B +ATOM 1095 CG ASP B 22 66.810 71.968 55.106 1.00 7.08 B +ATOM 1096 OD1 ASP B 22 67.693 72.601 54.461 1.00 8.97 B +ATOM 1097 OD2 ASP B 22 66.976 71.563 56.249 1.00 7.76 B +ATOM 1098 N LEU B 23 64.305 70.241 57.471 1.00 4.71 B +ATOM 1099 CA LEU B 23 63.966 70.471 58.871 1.00 5.58 B +ATOM 1100 C LEU B 23 65.149 70.823 59.745 1.00 6.38 B +ATOM 1101 O LEU B 23 64.983 70.882 60.979 1.00 8.55 B +ATOM 1102 CB LEU B 23 63.270 69.193 59.403 1.00 5.54 B +ATOM 1103 CG LEU B 23 62.154 68.674 58.507 1.00 6.24 B +ATOM 1104 CD1 LEU B 23 61.512 67.451 59.178 1.00 6.77 B +ATOM 1105 CD2 LEU B 23 61.054 69.707 58.259 1.00 6.93 B +ATOM 1106 N GLY B 24 66.286 71.039 59.166 1.00 6.72 B +ATOM 1107 CA GLY B 24 67.523 71.338 59.920 1.00 7.67 B +ATOM 1108 C GLY B 24 68.400 70.084 59.707 1.00 7.60 B +ATOM 1109 O GLY B 24 68.942 69.915 58.600 1.00 8.31 B +ATOM 1110 N ASN B 25 68.474 69.248 60.704 1.00 7.01 B +ATOM 1111 CA ASN B 25 69.301 68.036 60.524 1.00 7.87 B +ATOM 1112 C ASN B 25 68.622 67.049 59.570 1.00 7.17 B +ATOM 1113 O ASN B 25 69.317 66.371 58.790 1.00 7.79 B +ATOM 1114 CB ASN B 25 69.507 67.343 61.872 1.00 9.22 B +ATOM 1115 CG ASN B 25 70.393 66.113 61.713 1.00 10.32 B +ATOM 1116 OD1 ASN B 25 71.506 66.200 61.175 1.00 12.32 B +ATOM 1117 ND2 ASN B 25 69.869 64.967 62.167 1.00 11.31 B +ATOM 1118 N MET B 26 67.320 66.912 59.596 1.00 6.21 B +ATOM 1119 CA MET B 26 66.599 65.949 58.766 1.00 5.60 B +ATOM 1120 C MET B 26 65.937 66.583 57.556 1.00 5.14 B +ATOM 1121 O MET B 26 65.301 67.653 57.663 1.00 5.60 B +ATOM 1122 CB MET B 26 65.517 65.295 59.657 1.00 6.37 B +ATOM 1123 CG MET B 26 64.822 64.201 58.892 1.00 7.10 B +ATOM 1124 SD MET B 26 63.718 63.237 59.952 1.00 8.83 B +ATOM 1125 CE MET B 26 64.935 62.195 60.817 1.00 9.98 B +ATOM 1126 N ILE B 27 66.080 65.904 56.435 1.00 4.19 B +ATOM 1127 CA ILE B 27 65.439 66.272 55.172 1.00 4.28 B +ATOM 1128 C ILE B 27 64.446 65.142 54.845 1.00 3.82 B +ATOM 1129 O ILE B 27 64.828 63.960 54.992 1.00 3.92 B +ATOM 1130 CB ILE B 27 66.521 66.370 54.038 1.00 6.29 B +ATOM 1131 CG1 ILE B 27 67.247 67.744 54.078 1.00 7.15 B +ATOM 1132 CG2 ILE B 27 65.945 66.085 52.630 1.00 7.40 B +ATOM 1133 CD1 ILE B 27 67.892 68.089 55.432 1.00 7.34 B +ATOM 1134 N ILE B 28 63.256 65.496 54.416 1.00 3.50 B +ATOM 1135 CA ILE B 28 62.289 64.494 54.000 1.00 3.86 B +ATOM 1136 C ILE B 28 61.811 64.841 52.595 1.00 3.50 B +ATOM 1137 O ILE B 28 61.387 66.009 52.349 1.00 4.39 B +ATOM 1138 CB ILE B 28 61.051 64.397 54.955 1.00 4.84 B +ATOM 1139 CG1 ILE B 28 61.518 64.271 56.417 1.00 5.31 B +ATOM 1140 CG2 ILE B 28 60.136 63.234 54.508 1.00 5.87 B +ATOM 1141 CD1 ILE B 28 60.336 64.133 57.405 1.00 5.89 B +ATOM 1142 N THR B 29 61.836 63.885 51.698 1.00 3.96 B +ATOM 1143 CA THR B 29 61.295 64.117 50.363 1.00 4.14 B +ATOM 1144 C THR B 29 59.858 63.625 50.241 1.00 3.59 B +ATOM 1145 O THR B 29 59.398 62.751 50.957 1.00 4.36 B +ATOM 1146 CB THR B 29 62.148 63.402 49.229 1.00 4.08 B +ATOM 1147 OG1 THR B 29 61.797 62.003 49.151 1.00 3.82 B +ATOM 1148 CG2 THR B 29 63.662 63.547 49.413 1.00 4.97 B +ATOM 1149 N SER B 30 59.184 64.195 49.245 1.00 3.82 B +ATOM 1150 CA SER B 30 57.896 63.673 48.819 1.00 3.64 B +ATOM 1151 C SER B 30 58.225 62.342 48.083 1.00 3.76 B +ATOM 1152 O SER B 30 59.377 62.094 47.678 1.00 4.49 B +ATOM 1153 CB SER B 30 57.269 64.615 47.782 1.00 3.92 B +ATOM 1154 OG SER B 30 56.635 65.679 48.466 1.00 4.47 B +ATOM 1155 N GLY B 31 57.202 61.521 47.915 1.00 3.83 B +ATOM 1156 CA GLY B 31 57.299 60.254 47.176 1.00 4.29 B +ATOM 1157 C GLY B 31 57.583 60.617 45.727 1.00 4.32 B +ATOM 1158 O GLY B 31 56.714 61.268 45.108 1.00 6.10 B +ATOM 1159 N GLN B 32 58.708 60.248 45.164 1.00 3.41 B +ATOM 1160 CA GLN B 32 59.085 60.581 43.789 1.00 3.93 B +ATOM 1161 C GLN B 32 58.647 59.469 42.841 1.00 3.99 B +ATOM 1162 O GLN B 32 58.943 58.292 43.019 1.00 4.71 B +ATOM 1163 CB GLN B 32 60.603 60.781 43.678 1.00 4.22 B +ATOM 1164 CG GLN B 32 61.116 61.955 44.494 1.00 3.95 B +ATOM 1165 CD GLN B 32 60.387 63.233 44.181 1.00 4.74 B +ATOM 1166 OE1 GLN B 32 60.399 63.674 43.025 1.00 5.56 B +ATOM 1167 NE2 GLN B 32 59.688 63.775 45.179 1.00 4.99 B +ATOM 1168 N ILE B 33 58.014 59.924 41.772 1.00 5.20 B +ATOM 1169 CA ILE B 33 57.594 59.037 40.684 1.00 5.52 B +ATOM 1170 C ILE B 33 58.558 59.277 39.527 1.00 5.61 B +ATOM 1171 O ILE B 33 59.271 60.308 39.471 1.00 5.33 B +ATOM 1172 CB ILE B 33 56.109 59.247 40.335 1.00 6.50 B +ATOM 1173 CG1 ILE B 33 55.811 60.720 39.958 1.00 7.36 B +ATOM 1174 CG2 ILE B 33 55.181 58.775 41.489 1.00 7.63 B +ATOM 1175 CD1 ILE B 33 54.422 60.854 39.290 1.00 8.30 B +ATOM 1176 N PRO B 34 58.600 58.333 38.606 1.00 5.57 B +ATOM 1177 CA PRO B 34 59.576 58.367 37.522 1.00 5.47 B +ATOM 1178 C PRO B 34 59.282 59.321 36.371 1.00 5.79 B +ATOM 1179 O PRO B 34 59.360 58.907 35.192 1.00 7.27 B +ATOM 1180 CB PRO B 34 59.664 56.914 37.030 1.00 5.88 B +ATOM 1181 CG PRO B 34 58.276 56.396 37.325 1.00 6.23 B +ATOM 1182 CD PRO B 34 57.937 57.019 38.678 1.00 5.26 B +ATOM 1183 N VAL B 35 58.985 60.555 36.721 1.00 5.68 B +ATOM 1184 CA VAL B 35 58.775 61.601 35.706 1.00 6.40 B +ATOM 1185 C VAL B 35 60.117 62.295 35.492 1.00 5.88 B +ATOM 1186 O VAL B 35 60.824 62.677 36.425 1.00 5.93 B +ATOM 1187 CB VAL B 35 57.731 62.615 36.200 1.00 7.54 B +ATOM 1188 CG1 VAL B 35 57.671 63.850 35.300 1.00 7.74 B +ATOM 1189 CG2 VAL B 35 56.376 61.976 36.356 1.00 7.73 B +ATOM 1190 N ASN B 36 60.449 62.453 34.209 1.00 6.56 B +ATOM 1191 CA ASN B 36 61.711 63.134 33.832 1.00 7.61 B +ATOM 1192 C ASN B 36 61.509 64.632 34.009 1.00 7.47 B +ATOM 1193 O ASN B 36 60.575 65.195 33.398 1.00 8.51 B +ATOM 1194 CB ASN B 36 62.016 62.735 32.397 1.00 9.42 B +ATOM 1195 CG ASN B 36 63.262 63.346 31.815 1.00 11.61 B +ATOM 1196 OD1 ASN B 36 63.471 64.567 31.911 1.00 12.84 B +ATOM 1197 ND2 ASN B 36 64.047 62.500 31.143 1.00 12.39 B +ATOM 1198 N PRO B 37 62.330 65.329 34.757 1.00 7.10 B +ATOM 1199 CA PRO B 37 62.151 66.766 34.975 1.00 8.07 B +ATOM 1200 C PRO B 37 62.412 67.622 33.759 1.00 8.69 B +ATOM 1201 O PRO B 37 62.001 68.790 33.731 1.00 9.39 B +ATOM 1202 CB PRO B 37 63.114 67.097 36.114 1.00 8.93 B +ATOM 1203 CG PRO B 37 64.190 66.064 35.942 1.00 9.33 B +ATOM 1204 CD PRO B 37 63.459 64.793 35.519 1.00 8.45 B +ATOM 1205 N LYS B 38 63.140 67.088 32.797 1.00 9.24 B +ATOM 1206 CA LYS B 38 63.446 67.841 31.560 1.00 11.17 B +ATOM 1207 C LYS B 38 62.270 67.772 30.604 1.00 11.35 B +ATOM 1208 O LYS B 38 61.908 68.821 30.007 1.00 12.18 B +ATOM 1209 CB LYS B 38 64.682 67.259 30.905 1.00 12.66 B +ATOM 1210 CG LYS B 38 65.260 67.972 29.693 1.00 13.74 B +ATOM 1211 CD LYS B 38 66.600 67.360 29.220 1.00 14.42 B +ATOM 1212 CE LYS B 38 67.638 67.528 30.156 1.00 17.20 B +ATOM 1213 NZ LYS B 38 67.909 68.973 30.401 1.00 18.80 B +ATOM 1214 N THR B 39 61.667 66.605 30.410 1.00 11.29 B +ATOM 1215 CA THR B 39 60.585 66.426 29.447 1.00 11.38 B +ATOM 1216 C THR B 39 59.192 66.161 29.945 1.00 11.67 B +ATOM 1217 O THR B 39 58.231 66.283 29.146 1.00 12.12 B +ATOM 1218 CB THR B 39 60.967 65.202 28.498 1.00 11.46 B +ATOM 1219 OG1 THR B 39 60.899 64.024 29.377 1.00 11.47 B +ATOM 1220 CG2 THR B 39 62.342 65.321 27.870 1.00 12.27 B +ATOM 1221 N GLY B 40 59.069 65.724 31.191 1.00 11.14 B +ATOM 1222 CA GLY B 40 57.763 65.397 31.757 1.00 11.25 B +ATOM 1223 C GLY B 40 57.343 63.969 31.414 1.00 11.36 B +ATOM 1224 O GLY B 40 56.264 63.543 31.858 1.00 12.70 B +ATOM 1225 N GLU B 41 58.149 63.248 30.667 1.00 11.11 B +ATOM 1226 CA GLU B 41 57.815 61.871 30.278 1.00 11.71 B +ATOM 1227 C GLU B 41 58.245 60.833 31.296 1.00 10.19 B +ATOM 1228 O GLU B 41 59.139 61.111 32.099 1.00 10.11 B +ATOM 1229 CB GLU B 41 58.517 61.534 28.947 1.00 13.86 B +ATOM 1230 CG GLU B 41 57.967 62.414 27.808 1.00 16.75 B +ATOM 1231 CD GLU B 41 58.606 62.196 26.469 1.00 18.82 B +ATOM 1232 OE1 GLU B 41 59.711 61.693 26.338 1.00 19.76 B +ATOM 1233 OE2 GLU B 41 57.848 62.618 25.559 1.00 20.70 B +ATOM 1234 N VAL B 42 57.633 59.670 31.202 1.00 9.39 B +ATOM 1235 CA VAL B 42 57.933 58.529 32.092 1.00 8.66 B +ATOM 1236 C VAL B 42 58.479 57.415 31.207 1.00 8.84 B +ATOM 1237 O VAL B 42 57.758 57.073 30.227 1.00 8.91 B +ATOM 1238 CB VAL B 42 56.643 58.081 32.799 1.00 8.81 B +ATOM 1239 CG1 VAL B 42 56.885 56.777 33.559 1.00 8.55 B +ATOM 1240 CG2 VAL B 42 56.120 59.169 33.725 1.00 9.11 B +ATOM 1241 N PRO B 43 59.617 56.877 31.514 1.00 8.44 B +ATOM 1242 CA PRO B 43 60.210 55.791 30.715 1.00 9.28 B +ATOM 1243 C PRO B 43 59.367 54.546 30.918 1.00 9.79 B +ATOM 1244 O PRO B 43 58.768 54.342 32.000 1.00 9.85 B +ATOM 1245 CB PRO B 43 61.650 55.701 31.207 1.00 9.38 B +ATOM 1246 CG PRO B 43 61.567 56.141 32.652 1.00 9.11 B +ATOM 1247 CD PRO B 43 60.480 57.216 32.661 1.00 8.87 B +ATOM 1248 N ALA B 44 59.303 53.711 29.882 1.00 11.00 B +ATOM 1249 CA ALA B 44 58.508 52.480 29.932 1.00 11.90 B +ATOM 1250 C ALA B 44 59.042 51.404 30.874 1.00 12.03 B +ATOM 1251 O ALA B 44 58.329 50.802 31.691 1.00 13.47 B +ATOM 1252 CB ALA B 44 58.433 51.963 28.484 1.00 12.50 B +ATOM 1253 N ASP B 45 60.303 51.148 30.762 1.00 11.52 B +ATOM 1254 CA ASP B 45 61.135 50.149 31.428 1.00 11.81 B +ATOM 1255 C ASP B 45 61.109 50.292 32.946 1.00 10.80 B +ATOM 1256 O ASP B 45 61.365 51.424 33.415 1.00 9.73 B +ATOM 1257 CB ASP B 45 62.522 50.311 30.749 1.00 12.76 B +ATOM 1258 CG ASP B 45 63.505 49.304 31.268 1.00 14.25 B +ATOM 1259 OD1 ASP B 45 64.292 49.667 32.157 1.00 13.77 B +ATOM 1260 OD2 ASP B 45 63.527 48.132 30.805 1.00 15.41 B +ATOM 1261 N VAL B 46 60.863 49.235 33.695 1.00 10.67 B +ATOM 1262 CA VAL B 46 60.837 49.368 35.167 1.00 9.52 B +ATOM 1263 C VAL B 46 62.188 49.754 35.756 1.00 7.84 B +ATOM 1264 O VAL B 46 62.245 50.509 36.743 1.00 7.66 B +ATOM 1265 CB VAL B 46 60.208 48.136 35.839 1.00 10.26 B +ATOM 1266 CG1 VAL B 46 61.046 46.877 35.681 1.00 10.79 B +ATOM 1267 CG2 VAL B 46 59.868 48.431 37.284 1.00 10.65 B +ATOM 1268 N ALA B 47 63.265 49.237 35.185 1.00 7.55 B +ATOM 1269 CA ALA B 47 64.600 49.612 35.697 1.00 7.95 B +ATOM 1270 C ALA B 47 64.795 51.114 35.497 1.00 7.45 B +ATOM 1271 O ALA B 47 65.283 51.831 36.408 1.00 7.40 B +ATOM 1272 CB ALA B 47 65.692 48.813 35.003 1.00 8.33 B +ATOM 1273 N ALA B 48 64.432 51.602 34.327 1.00 6.86 B +ATOM 1274 CA ALA B 48 64.567 53.034 34.040 1.00 6.14 B +ATOM 1275 C ALA B 48 63.666 53.826 34.976 1.00 5.74 B +ATOM 1276 O ALA B 48 64.063 54.919 35.401 1.00 5.87 B +ATOM 1277 CB ALA B 48 64.257 53.277 32.576 1.00 6.39 B +ATOM 1278 N GLN B 49 62.494 53.331 35.270 1.00 5.59 B +ATOM 1279 CA GLN B 49 61.597 54.043 36.209 1.00 5.03 B +ATOM 1280 C GLN B 49 62.247 54.116 37.590 1.00 4.68 B +ATOM 1281 O GLN B 49 62.234 55.172 38.233 1.00 5.23 B +ATOM 1282 CB GLN B 49 60.225 53.385 36.255 1.00 5.71 B +ATOM 1283 CG GLN B 49 59.395 53.671 34.994 1.00 6.17 B +ATOM 1284 CD GLN B 49 57.921 53.381 35.202 1.00 5.93 B +ATOM 1285 OE1 GLN B 49 57.420 53.335 36.340 1.00 5.99 B +ATOM 1286 NE2 GLN B 49 57.175 53.220 34.110 1.00 6.38 B +ATOM 1287 N ALA B 50 62.786 52.982 38.029 1.00 4.71 B +ATOM 1288 CA ALA B 50 63.431 53.010 39.364 1.00 4.54 B +ATOM 1289 C ALA B 50 64.554 54.046 39.396 1.00 4.94 B +ATOM 1290 O ALA B 50 64.694 54.833 40.349 1.00 4.87 B +ATOM 1291 CB ALA B 50 63.973 51.649 39.764 1.00 5.66 B +ATOM 1292 N ARG B 51 65.338 54.078 38.327 1.00 5.38 B +ATOM 1293 CA ARG B 51 66.439 55.051 38.260 1.00 5.49 B +ATOM 1294 C ARG B 51 65.950 56.478 38.200 1.00 5.04 B +ATOM 1295 O ARG B 51 66.565 57.349 38.845 1.00 6.12 B +ATOM 1296 CB ARG B 51 67.419 54.730 37.136 1.00 6.73 B +ATOM 1297 CG ARG B 51 68.640 55.631 37.074 1.00 7.56 B +ATOM 1298 CD ARG B 51 69.722 55.064 36.205 1.00 8.32 B +ATOM 1299 NE ARG B 51 70.418 53.902 36.735 1.00 8.95 B +ATOM 1300 CZ ARG B 51 71.442 53.925 37.601 1.00 9.18 B +ATOM 1301 NH1 ARG B 51 71.924 55.070 38.084 1.00 8.39 B +ATOM 1302 NH2 ARG B 51 71.993 52.772 37.999 1.00 10.81 B +ATOM 1303 N GLN B 52 64.896 56.762 37.460 1.00 4.75 B +ATOM 1304 CA GLN B 52 64.365 58.134 37.375 1.00 4.61 B +ATOM 1305 C GLN B 52 63.848 58.546 38.755 1.00 4.34 B +ATOM 1306 O GLN B 52 64.060 59.715 39.161 1.00 4.87 B +ATOM 1307 CB GLN B 52 63.303 58.235 36.296 1.00 5.74 B +ATOM 1308 CG GLN B 52 62.806 59.657 36.148 1.00 5.80 B +ATOM 1309 CD GLN B 52 63.854 60.622 35.679 1.00 6.30 B +ATOM 1310 OE1 GLN B 52 64.133 60.690 34.471 1.00 7.97 B +ATOM 1311 NE2 GLN B 52 64.428 61.386 36.576 1.00 7.04 B +ATOM 1312 N SER B 53 63.125 57.667 39.438 1.00 4.36 B +ATOM 1313 CA SER B 53 62.658 58.016 40.796 1.00 4.64 B +ATOM 1314 C SER B 53 63.831 58.319 41.730 1.00 4.34 B +ATOM 1315 O SER B 53 63.783 59.298 42.486 1.00 4.42 B +ATOM 1316 CB SER B 53 61.801 56.895 41.346 1.00 5.03 B +ATOM 1317 OG SER B 53 60.480 56.920 40.874 1.00 7.71 B +ATOM 1318 N LEU B 54 64.858 57.494 41.672 1.00 4.12 B +ATOM 1319 CA LEU B 54 66.053 57.715 42.501 1.00 4.70 B +ATOM 1320 C LEU B 54 66.747 59.020 42.130 1.00 3.93 B +ATOM 1321 O LEU B 54 67.222 59.740 43.026 1.00 4.71 B +ATOM 1322 CB LEU B 54 66.961 56.508 42.407 1.00 5.03 B +ATOM 1323 CG LEU B 54 66.430 55.288 43.166 1.00 5.82 B +ATOM 1324 CD1 LEU B 54 67.223 54.045 42.760 1.00 5.88 B +ATOM 1325 CD2 LEU B 54 66.492 55.463 44.673 1.00 6.70 B +ATOM 1326 N ASP B 55 66.819 59.334 40.853 1.00 4.46 B +ATOM 1327 CA ASP B 55 67.461 60.595 40.440 1.00 4.76 B +ATOM 1328 C ASP B 55 66.648 61.777 40.976 1.00 5.09 B +ATOM 1329 O ASP B 55 67.240 62.801 41.316 1.00 4.83 B +ATOM 1330 CB ASP B 55 67.603 60.620 38.926 1.00 6.75 B +ATOM 1331 CG ASP B 55 68.831 59.894 38.396 1.00 8.66 B +ATOM 1332 OD1 ASP B 55 68.842 59.457 37.229 1.00 10.67 B +ATOM 1333 OD2 ASP B 55 69.804 59.813 39.156 1.00 10.74 B +ATOM 1334 N ASN B 56 65.338 61.607 40.966 1.00 4.45 B +ATOM 1335 CA ASN B 56 64.473 62.713 41.477 1.00 3.71 B +ATOM 1336 C ASN B 56 64.745 62.874 42.971 1.00 3.25 B +ATOM 1337 O ASN B 56 64.821 64.018 43.473 1.00 4.24 B +ATOM 1338 CB ASN B 56 62.994 62.455 41.182 1.00 4.47 B +ATOM 1339 CG ASN B 56 62.707 62.655 39.696 1.00 4.53 B +ATOM 1340 OD1 ASN B 56 63.521 63.249 38.956 1.00 5.62 B +ATOM 1341 ND2 ASN B 56 61.580 62.124 39.213 1.00 4.94 B +ATOM 1342 N VAL B 57 64.803 61.766 43.710 1.00 4.41 B +ATOM 1343 CA VAL B 57 65.125 61.842 45.156 1.00 4.09 B +ATOM 1344 C VAL B 57 66.462 62.535 45.322 1.00 3.73 B +ATOM 1345 O VAL B 57 66.644 63.454 46.150 1.00 4.05 B +ATOM 1346 CB VAL B 57 65.167 60.449 45.777 1.00 4.49 B +ATOM 1347 CG1 VAL B 57 65.858 60.478 47.143 1.00 5.66 B +ATOM 1348 CG2 VAL B 57 63.791 59.829 45.886 1.00 5.00 B +ATOM 1349 N LYS B 58 67.461 62.121 44.563 1.00 3.78 B +ATOM 1350 CA LYS B 58 68.814 62.701 44.626 1.00 4.51 B +ATOM 1351 C LYS B 58 68.786 64.200 44.385 1.00 4.64 B +ATOM 1352 O LYS B 58 69.453 64.970 45.078 1.00 4.91 B +ATOM 1353 CB LYS B 58 69.685 62.023 43.566 1.00 5.87 B +ATOM 1354 CG LYS B 58 71.037 62.715 43.368 1.00 6.61 B +ATOM 1355 CD LYS B 58 71.911 61.914 42.422 1.00 8.95 B +ATOM 1356 CE LYS B 58 73.036 62.736 41.827 1.00 9.79 B +ATOM 1357 NZ LYS B 58 73.903 61.926 40.944 1.00 10.97 B +ATOM 1358 N ALA B 59 68.027 64.648 43.393 1.00 4.57 B +ATOM 1359 CA ALA B 59 67.955 66.089 43.097 1.00 4.83 B +ATOM 1360 C ALA B 59 67.483 66.884 44.313 1.00 4.63 B +ATOM 1361 O ALA B 59 67.996 67.993 44.584 1.00 4.41 B +ATOM 1362 CB ALA B 59 67.000 66.337 41.941 1.00 5.64 B +ATOM 1363 N ILE B 60 66.485 66.365 45.015 1.00 4.27 B +ATOM 1364 CA ILE B 60 65.916 67.056 46.183 1.00 4.66 B +ATOM 1365 C ILE B 60 66.898 67.056 47.337 1.00 3.81 B +ATOM 1366 O ILE B 60 67.079 68.071 48.023 1.00 4.20 B +ATOM 1367 CB ILE B 60 64.546 66.403 46.509 1.00 4.36 B +ATOM 1368 CG1 ILE B 60 63.588 66.623 45.317 1.00 4.56 B +ATOM 1369 CG2 ILE B 60 63.966 66.941 47.835 1.00 4.23 B +ATOM 1370 CD1 ILE B 60 62.373 65.655 45.375 1.00 5.34 B +ATOM 1371 N VAL B 61 67.504 65.896 47.603 1.00 3.65 B +ATOM 1372 CA VAL B 61 68.511 65.787 48.677 1.00 4.56 B +ATOM 1373 C VAL B 61 69.698 66.702 48.400 1.00 4.22 B +ATOM 1374 O VAL B 61 70.160 67.411 49.299 1.00 4.43 B +ATOM 1375 CB VAL B 61 68.907 64.309 48.830 1.00 4.74 B +ATOM 1376 CG1 VAL B 61 70.122 64.101 49.722 1.00 5.69 B +ATOM 1377 CG2 VAL B 61 67.725 63.493 49.318 1.00 5.47 B +ATOM 1378 N GLU B 62 70.151 66.723 47.153 1.00 4.43 B +ATOM 1379 CA GLU B 62 71.288 67.592 46.812 1.00 4.95 B +ATOM 1380 C GLU B 62 70.885 69.052 46.887 1.00 5.30 B +ATOM 1381 O GLU B 62 71.723 69.907 47.256 1.00 5.38 B +ATOM 1382 CB GLU B 62 71.893 67.274 45.453 1.00 5.58 B +ATOM 1383 CG GLU B 62 72.586 65.906 45.458 1.00 7.08 B +ATOM 1384 CD GLU B 62 73.352 65.533 44.237 1.00 8.46 B +ATOM 1385 OE1 GLU B 62 74.252 64.697 44.288 1.00 10.06 B +ATOM 1386 OE2 GLU B 62 73.067 66.109 43.157 1.00 10.50 B +ATOM 1387 N ALA B 63 69.650 69.401 46.584 1.00 5.02 B +ATOM 1388 CA ALA B 63 69.190 70.802 46.655 1.00 4.80 B +ATOM 1389 C ALA B 63 69.229 71.281 48.101 1.00 4.67 B +ATOM 1390 O ALA B 63 69.284 72.498 48.351 1.00 5.23 B +ATOM 1391 CB ALA B 63 67.832 70.900 46.025 1.00 4.87 B +ATOM 1392 N ALA B 64 69.195 70.374 49.063 1.00 4.95 B +ATOM 1393 CA ALA B 64 69.277 70.725 50.469 1.00 5.12 B +ATOM 1394 C ALA B 64 70.720 70.686 50.966 1.00 5.56 B +ATOM 1395 O ALA B 64 70.916 70.844 52.193 1.00 6.36 B +ATOM 1396 CB ALA B 64 68.378 69.816 51.305 1.00 6.01 B +ATOM 1397 N GLY B 65 71.682 70.458 50.111 1.00 5.32 B +ATOM 1398 CA GLY B 65 73.092 70.438 50.514 1.00 5.69 B +ATOM 1399 C GLY B 65 73.563 69.073 50.980 1.00 5.00 B +ATOM 1400 O GLY B 65 74.662 69.029 51.580 1.00 6.60 B +ATOM 1401 N LEU B 66 72.813 68.006 50.731 1.00 4.89 B +ATOM 1402 CA LEU B 66 73.201 66.660 51.180 1.00 5.10 B +ATOM 1403 C LEU B 66 73.579 65.820 49.989 1.00 5.52 B +ATOM 1404 O LEU B 66 73.428 66.215 48.832 1.00 6.12 B +ATOM 1405 CB LEU B 66 72.059 66.064 52.009 1.00 5.47 B +ATOM 1406 CG LEU B 66 71.886 66.729 53.366 1.00 7.05 B +ATOM 1407 CD1 LEU B 66 70.805 65.995 54.150 1.00 7.79 B +ATOM 1408 CD2 LEU B 66 73.209 66.813 54.124 1.00 8.50 B +ATOM 1409 N LYS B 67 74.007 64.601 50.268 1.00 5.84 B +ATOM 1410 CA LYS B 67 74.408 63.637 49.228 1.00 6.22 B +ATOM 1411 C LYS B 67 73.532 62.402 49.343 1.00 5.40 B +ATOM 1412 O LYS B 67 72.892 62.130 50.377 1.00 5.50 B +ATOM 1413 CB LYS B 67 75.855 63.194 49.489 1.00 8.08 B +ATOM 1414 CG LYS B 67 76.860 64.348 49.479 1.00 10.38 B +ATOM 1415 CD LYS B 67 78.259 63.839 49.838 1.00 13.10 B +ATOM 1416 CE LYS B 67 79.272 64.978 49.778 1.00 14.74 B +ATOM 1417 NZ LYS B 67 80.648 64.415 49.892 1.00 16.76 B +ATOM 1418 N VAL B 68 73.571 61.611 48.260 1.00 5.45 B +ATOM 1419 CA VAL B 68 72.874 60.318 48.274 1.00 5.05 B +ATOM 1420 C VAL B 68 73.341 59.513 49.501 1.00 5.56 B +ATOM 1421 O VAL B 68 72.512 58.804 50.091 1.00 5.83 B +ATOM 1422 CB VAL B 68 73.124 59.566 46.958 1.00 5.97 B +ATOM 1423 CG1 VAL B 68 72.733 58.097 47.047 1.00 6.44 B +ATOM 1424 CG2 VAL B 68 72.484 60.292 45.781 1.00 7.15 B +ATOM 1425 N GLY B 69 74.607 59.620 49.861 1.00 5.71 B +ATOM 1426 CA GLY B 69 75.148 58.890 51.014 1.00 6.22 B +ATOM 1427 C GLY B 69 74.533 59.314 52.347 1.00 5.67 B +ATOM 1428 O GLY B 69 74.754 58.601 53.347 1.00 6.75 B +ATOM 1429 N ASP B 70 73.824 60.435 52.380 1.00 4.83 B +ATOM 1430 CA ASP B 70 73.148 60.912 53.599 1.00 5.11 B +ATOM 1431 C ASP B 70 71.723 60.358 53.725 1.00 4.14 B +ATOM 1432 O ASP B 70 71.075 60.662 54.733 1.00 4.50 B +ATOM 1433 CB ASP B 70 73.177 62.438 53.647 1.00 5.29 B +ATOM 1434 CG ASP B 70 74.595 63.006 53.641 1.00 6.10 B +ATOM 1435 OD1 ASP B 70 74.820 63.965 52.875 1.00 6.91 B +ATOM 1436 OD2 ASP B 70 75.421 62.444 54.367 1.00 6.71 B +ATOM 1437 N ILE B 71 71.273 59.653 52.727 1.00 4.31 B +ATOM 1438 CA ILE B 71 69.910 59.080 52.803 1.00 4.32 B +ATOM 1439 C ILE B 71 69.964 57.903 53.793 1.00 3.98 B +ATOM 1440 O ILE B 71 70.796 57.004 53.583 1.00 5.01 B +ATOM 1441 CB ILE B 71 69.417 58.633 51.394 1.00 4.70 B +ATOM 1442 CG1 ILE B 71 69.260 59.861 50.449 1.00 4.36 B +ATOM 1443 CG2 ILE B 71 68.095 57.847 51.552 1.00 4.30 B +ATOM 1444 CD1 ILE B 71 69.090 59.494 48.952 1.00 4.71 B +ATOM 1445 N VAL B 72 69.082 57.918 54.776 1.00 3.47 B +ATOM 1446 CA VAL B 72 69.101 56.889 55.822 1.00 3.99 B +ATOM 1447 C VAL B 72 67.872 56.023 55.826 1.00 3.90 B +ATOM 1448 O VAL B 72 67.929 54.930 56.434 1.00 4.27 B +ATOM 1449 CB VAL B 72 69.355 57.550 57.201 1.00 4.41 B +ATOM 1450 CG1 VAL B 72 70.752 58.134 57.263 1.00 5.07 B +ATOM 1451 CG2 VAL B 72 68.283 58.575 57.520 1.00 5.77 B +ATOM 1452 N LYS B 73 66.779 56.414 55.155 1.00 3.52 B +ATOM 1453 CA LYS B 73 65.579 55.571 55.125 1.00 4.16 B +ATOM 1454 C LYS B 73 64.797 55.868 53.841 1.00 4.31 B +ATOM 1455 O LYS B 73 64.631 57.077 53.541 1.00 4.84 B +ATOM 1456 CB LYS B 73 64.647 55.893 56.294 1.00 5.02 B +ATOM 1457 CG LYS B 73 63.285 55.194 56.361 1.00 5.28 B +ATOM 1458 CD LYS B 73 63.319 53.682 56.411 1.00 5.37 B +ATOM 1459 CE LYS B 73 61.976 53.030 56.630 1.00 6.08 B +ATOM 1460 NZ LYS B 73 60.916 53.409 55.657 1.00 6.35 B +ATOM 1461 N THR B 74 64.350 54.825 53.193 1.00 3.73 B +ATOM 1462 CA THR B 74 63.456 55.013 52.052 1.00 3.85 B +ATOM 1463 C THR B 74 62.249 54.103 52.262 1.00 3.84 B +ATOM 1464 O THR B 74 62.260 53.119 53.017 1.00 3.85 B +ATOM 1465 CB THR B 74 64.155 54.626 50.705 1.00 4.06 B +ATOM 1466 OG1 THR B 74 64.451 53.208 50.782 1.00 4.62 B +ATOM 1467 CG2 THR B 74 65.381 55.461 50.387 1.00 4.69 B +ATOM 1468 N THR B 75 61.192 54.460 51.537 1.00 3.73 B +ATOM 1469 CA THR B 75 60.053 53.559 51.389 1.00 4.09 B +ATOM 1470 C THR B 75 59.881 53.439 49.849 1.00 4.02 B +ATOM 1471 O THR B 75 59.787 54.483 49.180 1.00 4.60 B +ATOM 1472 CB THR B 75 58.716 53.947 52.052 1.00 5.33 B +ATOM 1473 OG1 THR B 75 59.053 53.995 53.481 1.00 6.90 B +ATOM 1474 CG2 THR B 75 57.597 52.938 51.782 1.00 6.26 B +ATOM 1475 N VAL B 76 59.859 52.221 49.388 1.00 3.79 B +ATOM 1476 CA VAL B 76 59.705 51.923 47.970 1.00 4.37 B +ATOM 1477 C VAL B 76 58.362 51.232 47.772 1.00 4.23 B +ATOM 1478 O VAL B 76 58.120 50.109 48.259 1.00 5.09 B +ATOM 1479 CB VAL B 76 60.873 51.017 47.518 1.00 5.09 B +ATOM 1480 CG1 VAL B 76 60.718 50.674 46.034 1.00 6.10 B +ATOM 1481 CG2 VAL B 76 62.256 51.642 47.745 1.00 5.44 B +ATOM 1482 N PHE B 77 57.500 51.943 47.079 1.00 3.73 B +ATOM 1483 CA PHE B 77 56.152 51.434 46.755 1.00 4.03 B +ATOM 1484 C PHE B 77 56.221 50.948 45.307 1.00 3.31 B +ATOM 1485 O PHE B 77 56.607 51.785 44.458 1.00 5.04 B +ATOM 1486 CB PHE B 77 55.114 52.535 46.861 1.00 3.99 B +ATOM 1487 CG PHE B 77 55.025 53.226 48.187 1.00 3.46 B +ATOM 1488 CD1 PHE B 77 55.589 54.494 48.378 1.00 4.75 B +ATOM 1489 CD2 PHE B 77 54.338 52.632 49.243 1.00 4.57 B +ATOM 1490 CE1 PHE B 77 55.436 55.186 49.580 1.00 5.64 B +ATOM 1491 CE2 PHE B 77 54.208 53.314 50.457 1.00 5.55 B +ATOM 1492 CZ PHE B 77 54.721 54.585 50.626 1.00 5.75 B +ATOM 1493 N VAL B 78 55.872 49.713 45.018 1.00 3.70 B +ATOM 1494 CA VAL B 78 55.909 49.221 43.641 1.00 4.71 B +ATOM 1495 C VAL B 78 54.528 48.751 43.220 1.00 4.55 B +ATOM 1496 O VAL B 78 53.710 48.352 44.038 1.00 4.79 B +ATOM 1497 CB VAL B 78 56.948 48.100 43.447 1.00 5.00 B +ATOM 1498 CG1 VAL B 78 58.363 48.575 43.745 1.00 6.84 B +ATOM 1499 CG2 VAL B 78 56.648 46.861 44.287 1.00 5.75 B +ATOM 1500 N LYS B 79 54.334 48.753 41.906 1.00 5.21 B +ATOM 1501 CA LYS B 79 53.107 48.222 41.315 1.00 5.74 B +ATOM 1502 C LYS B 79 53.200 46.696 41.199 1.00 6.17 B +ATOM 1503 O LYS B 79 52.134 46.034 41.240 1.00 6.76 B +ATOM 1504 CB LYS B 79 52.842 48.840 39.956 1.00 6.81 B +ATOM 1505 CG LYS B 79 51.634 48.264 39.231 1.00 8.82 B +ATOM 1506 CD LYS B 79 50.323 48.396 39.989 1.00 10.71 B +ATOM 1507 CE LYS B 79 49.209 47.516 39.447 1.00 11.66 B +ATOM 1508 NZ LYS B 79 49.470 46.072 39.707 1.00 13.37 B +ATOM 1509 N ASP B 80 54.376 46.123 41.078 1.00 6.31 B +ATOM 1510 CA ASP B 80 54.487 44.661 40.898 1.00 6.74 B +ATOM 1511 C ASP B 80 55.764 44.088 41.474 1.00 6.52 B +ATOM 1512 O ASP B 80 56.841 44.340 40.896 1.00 7.52 B +ATOM 1513 CB ASP B 80 54.361 44.370 39.382 1.00 7.41 B +ATOM 1514 CG ASP B 80 54.297 42.895 39.052 1.00 8.15 B +ATOM 1515 OD1 ASP B 80 54.054 42.544 37.864 1.00 10.21 B +ATOM 1516 OD2 ASP B 80 54.466 42.034 39.923 1.00 8.03 B +ATOM 1517 N LEU B 81 55.668 43.364 42.574 1.00 6.91 B +ATOM 1518 CA LEU B 81 56.846 42.760 43.190 1.00 8.19 B +ATOM 1519 C LEU B 81 57.501 41.754 42.250 1.00 8.43 B +ATOM 1520 O LEU B 81 58.657 41.386 42.540 1.00 9.36 B +ATOM 1521 CB LEU B 81 56.573 42.188 44.569 1.00 8.43 B +ATOM 1522 CG LEU B 81 56.623 43.238 45.680 1.00 8.40 B +ATOM 1523 CD1 LEU B 81 56.024 42.606 46.935 1.00 9.27 B +ATOM 1524 CD2 LEU B 81 58.050 43.682 45.909 1.00 9.04 B +ATOM 1525 N ASN B 82 56.839 41.326 41.191 1.00 8.67 B +ATOM 1526 CA ASN B 82 57.540 40.394 40.271 1.00 9.87 B +ATOM 1527 C ASN B 82 58.691 41.113 39.557 1.00 10.44 B +ATOM 1528 O ASN B 82 59.592 40.434 39.033 1.00 11.63 B +ATOM 1529 CB ASN B 82 56.608 39.715 39.283 1.00 10.51 B +ATOM 1530 CG ASN B 82 55.772 38.642 39.992 1.00 10.87 B +ATOM 1531 OD1 ASN B 82 56.248 38.003 40.917 1.00 11.41 B +ATOM 1532 ND2 ASN B 82 54.538 38.505 39.530 1.00 11.83 B +ATOM 1533 N ASP B 83 58.688 42.430 39.542 1.00 10.73 B +ATOM 1534 CA ASP B 83 59.787 43.195 38.901 1.00 11.58 B +ATOM 1535 C ASP B 83 60.809 43.606 39.956 1.00 11.57 B +ATOM 1536 O ASP B 83 61.760 44.366 39.650 1.00 11.86 B +ATOM 1537 CB ASP B 83 59.225 44.409 38.174 1.00 12.86 B +ATOM 1538 CG ASP B 83 58.600 44.116 36.833 1.00 13.31 B +ATOM 1539 OD1 ASP B 83 57.683 44.833 36.447 1.00 14.31 B +ATOM 1540 OD2 ASP B 83 59.090 43.183 36.124 1.00 15.40 B +ATOM 1541 N PHE B 84 60.688 43.112 41.173 1.00 11.64 B +ATOM 1542 CA PHE B 84 61.630 43.566 42.211 1.00 12.27 B +ATOM 1543 C PHE B 84 63.088 43.200 42.034 1.00 11.14 B +ATOM 1544 O PHE B 84 63.933 43.995 42.522 1.00 10.67 B +ATOM 1545 CB PHE B 84 61.082 43.296 43.608 1.00 13.85 B +ATOM 1546 CG PHE B 84 61.435 44.457 44.516 1.00 15.36 B +ATOM 1547 CD1 PHE B 84 62.419 44.313 45.490 1.00 16.41 B +ATOM 1548 CD2 PHE B 84 60.771 45.675 44.347 1.00 15.95 B +ATOM 1549 CE1 PHE B 84 62.724 45.396 46.316 1.00 17.08 B +ATOM 1550 CE2 PHE B 84 61.074 46.757 45.182 1.00 16.89 B +ATOM 1551 CZ PHE B 84 62.051 46.612 46.170 1.00 16.95 B +ATOM 1552 N ALA B 85 63.448 42.102 41.392 1.00 10.77 B +ATOM 1553 CA ALA B 85 64.879 41.794 41.220 1.00 10.60 B +ATOM 1554 C ALA B 85 65.535 42.914 40.407 1.00 9.89 B +ATOM 1555 O ALA B 85 66.653 43.346 40.689 1.00 9.55 B +ATOM 1556 CB ALA B 85 65.072 40.425 40.575 1.00 11.44 B +ATOM 1557 N THR B 86 64.784 43.359 39.403 1.00 10.27 B +ATOM 1558 CA THR B 86 65.263 44.420 38.507 1.00 10.82 B +ATOM 1559 C THR B 86 65.418 45.740 39.247 1.00 9.25 B +ATOM 1560 O THR B 86 66.418 46.473 39.123 1.00 8.54 B +ATOM 1561 CB THR B 86 64.317 44.584 37.245 1.00 12.16 B +ATOM 1562 OG1 THR B 86 64.271 43.272 36.607 1.00 13.99 B +ATOM 1563 CG2 THR B 86 64.815 45.690 36.315 1.00 12.79 B +ATOM 1564 N VAL B 87 64.392 46.057 40.011 1.00 8.71 B +ATOM 1565 CA VAL B 87 64.395 47.289 40.822 1.00 8.40 B +ATOM 1566 C VAL B 87 65.555 47.232 41.809 1.00 7.98 B +ATOM 1567 O VAL B 87 66.265 48.236 41.965 1.00 8.35 B +ATOM 1568 CB VAL B 87 63.043 47.470 41.540 1.00 8.84 B +ATOM 1569 CG1 VAL B 87 63.167 48.539 42.621 1.00 9.19 B +ATOM 1570 CG2 VAL B 87 61.950 47.778 40.533 1.00 9.80 B +ATOM 1571 N ASN B 88 65.711 46.109 42.472 1.00 7.83 B +ATOM 1572 CA ASN B 88 66.775 45.933 43.463 1.00 9.07 B +ATOM 1573 C ASN B 88 68.144 46.146 42.851 1.00 8.46 B +ATOM 1574 O ASN B 88 69.026 46.768 43.450 1.00 7.86 B +ATOM 1575 CB ASN B 88 66.740 44.572 44.145 1.00 10.40 B +ATOM 1576 CG ASN B 88 66.169 44.610 45.540 1.00 11.76 B +ATOM 1577 OD1 ASN B 88 66.239 45.662 46.210 1.00 12.61 B +ATOM 1578 ND2 ASN B 88 65.615 43.454 45.921 1.00 13.35 B +ATOM 1579 N ALA B 89 68.340 45.587 41.664 1.00 7.67 B +ATOM 1580 CA ALA B 89 69.637 45.742 40.975 1.00 7.58 B +ATOM 1581 C ALA B 89 69.934 47.212 40.678 1.00 6.88 B +ATOM 1582 O ALA B 89 71.066 47.682 40.867 1.00 7.11 B +ATOM 1583 CB ALA B 89 69.635 44.884 39.713 1.00 8.02 B +ATOM 1584 N THR B 90 68.916 47.898 40.173 1.00 7.04 B +ATOM 1585 CA THR B 90 69.089 49.326 39.858 1.00 7.07 B +ATOM 1586 C THR B 90 69.328 50.133 41.132 1.00 6.37 B +ATOM 1587 O THR B 90 70.183 51.031 41.163 1.00 6.22 B +ATOM 1588 CB THR B 90 67.823 49.853 39.083 1.00 7.91 B +ATOM 1589 OG1 THR B 90 67.848 49.254 37.752 1.00 10.49 B +ATOM 1590 CG2 THR B 90 67.792 51.378 39.020 1.00 9.07 B +ATOM 1591 N TYR B 91 68.549 49.837 42.164 1.00 6.16 B +ATOM 1592 CA TYR B 91 68.653 50.539 43.451 1.00 5.79 B +ATOM 1593 C TYR B 91 70.048 50.341 44.026 1.00 5.81 B +ATOM 1594 O TYR B 91 70.724 51.278 44.488 1.00 6.66 B +ATOM 1595 CB TYR B 91 67.546 50.008 44.344 1.00 5.88 B +ATOM 1596 CG TYR B 91 67.369 50.645 45.698 1.00 5.59 B +ATOM 1597 CD1 TYR B 91 66.295 51.497 45.958 1.00 5.96 B +ATOM 1598 CD2 TYR B 91 68.267 50.394 46.730 1.00 6.04 B +ATOM 1599 CE1 TYR B 91 66.067 52.070 47.210 1.00 5.47 B +ATOM 1600 CE2 TYR B 91 68.093 50.940 47.994 1.00 6.05 B +ATOM 1601 CZ TYR B 91 66.985 51.768 48.210 1.00 5.90 B +ATOM 1602 OH TYR B 91 66.804 52.315 49.467 1.00 5.93 B +ATOM 1603 N GLU B 92 70.502 49.095 44.002 1.00 6.05 B +ATOM 1604 CA GLU B 92 71.841 48.771 44.514 1.00 6.75 B +ATOM 1605 C GLU B 92 72.917 49.548 43.765 1.00 6.71 B +ATOM 1606 O GLU B 92 73.846 50.151 44.350 1.00 7.08 B +ATOM 1607 CB GLU B 92 72.138 47.269 44.437 1.00 8.59 B +ATOM 1608 CG GLU B 92 73.518 46.875 44.989 1.00 11.80 B +ATOM 1609 CD GLU B 92 73.634 45.500 45.544 1.00 15.28 B +ATOM 1610 OE1 GLU B 92 74.486 45.106 46.349 1.00 18.01 B +ATOM 1611 OE2 GLU B 92 72.757 44.704 45.182 1.00 17.25 B +ATOM 1612 N ALA B 93 72.824 49.534 42.434 1.00 6.56 B +ATOM 1613 CA ALA B 93 73.786 50.239 41.573 1.00 7.09 B +ATOM 1614 C ALA B 93 73.817 51.726 41.900 1.00 6.90 B +ATOM 1615 O ALA B 93 74.895 52.313 42.030 1.00 7.00 B +ATOM 1616 CB ALA B 93 73.460 50.036 40.092 1.00 7.57 B +ATOM 1617 N PHE B 94 72.618 52.302 42.042 1.00 6.67 B +ATOM 1618 CA PHE B 94 72.516 53.752 42.332 1.00 6.61 B +ATOM 1619 C PHE B 94 73.288 54.131 43.597 1.00 5.97 B +ATOM 1620 O PHE B 94 74.054 55.105 43.607 1.00 6.59 B +ATOM 1621 CB PHE B 94 71.034 54.101 42.401 1.00 7.02 B +ATOM 1622 CG PHE B 94 70.771 55.555 42.599 1.00 7.23 B +ATOM 1623 CD1 PHE B 94 70.713 56.358 41.464 1.00 8.12 B +ATOM 1624 CD2 PHE B 94 70.605 56.098 43.862 1.00 8.71 B +ATOM 1625 CE1 PHE B 94 70.478 57.717 41.545 1.00 9.74 B +ATOM 1626 CE2 PHE B 94 70.367 57.485 43.979 1.00 9.96 B +ATOM 1627 CZ PHE B 94 70.332 58.243 42.813 1.00 9.82 B +ATOM 1628 N PHE B 95 73.086 53.389 44.675 1.00 5.98 B +ATOM 1629 CA PHE B 95 73.781 53.651 45.951 1.00 6.00 B +ATOM 1630 C PHE B 95 75.281 53.417 45.784 1.00 6.18 B +ATOM 1631 O PHE B 95 76.101 54.226 46.266 1.00 6.81 B +ATOM 1632 CB PHE B 95 73.124 52.962 47.140 1.00 6.51 B +ATOM 1633 CG PHE B 95 71.874 53.714 47.524 1.00 6.57 B +ATOM 1634 CD1 PHE B 95 70.622 53.373 47.028 1.00 7.43 B +ATOM 1635 CD2 PHE B 95 71.976 54.850 48.341 1.00 6.79 B +ATOM 1636 CE1 PHE B 95 69.479 54.111 47.329 1.00 7.20 B +ATOM 1637 CE2 PHE B 95 70.841 55.584 48.669 1.00 7.08 B +ATOM 1638 CZ PHE B 95 69.594 55.238 48.145 1.00 7.03 B +ATOM 1639 N THR B 96 75.622 52.319 45.112 1.00 6.49 B +ATOM 1640 CA THR B 96 77.053 52.019 44.897 1.00 8.11 B +ATOM 1641 C THR B 96 77.732 53.131 44.112 1.00 7.33 B +ATOM 1642 O THR B 96 78.891 53.504 44.429 1.00 7.70 B +ATOM 1643 CB THR B 96 77.231 50.627 44.186 1.00 9.27 B +ATOM 1644 OG1 THR B 96 76.633 49.670 45.085 1.00 11.25 B +ATOM 1645 CG2 THR B 96 78.696 50.311 43.881 1.00 9.94 B +ATOM 1646 N GLU B 97 77.060 53.665 43.106 1.00 7.31 B +ATOM 1647 CA GLU B 97 77.615 54.743 42.266 1.00 8.29 B +ATOM 1648 C GLU B 97 77.942 55.957 43.102 1.00 7.86 B +ATOM 1649 O GLU B 97 78.850 56.745 42.748 1.00 9.08 B +ATOM 1650 CB GLU B 97 76.606 55.168 41.175 1.00 8.63 B +ATOM 1651 CG GLU B 97 76.405 54.068 40.094 1.00 9.19 B +ATOM 1652 CD GLU B 97 75.045 54.140 39.441 1.00 9.70 B +ATOM 1653 OE1 GLU B 97 74.338 55.128 39.587 1.00 10.55 B +ATOM 1654 OE2 GLU B 97 74.714 53.131 38.781 1.00 11.38 B +ATOM 1655 N HIS B 98 77.252 56.159 44.220 1.00 7.67 B +ATOM 1656 CA HIS B 98 77.458 57.305 45.097 1.00 7.40 B +ATOM 1657 C HIS B 98 78.282 56.958 46.321 1.00 7.94 B +ATOM 1658 O HIS B 98 78.280 57.751 47.288 1.00 8.19 B +ATOM 1659 CB HIS B 98 76.069 57.908 45.506 1.00 7.48 B +ATOM 1660 CG HIS B 98 75.377 58.471 44.303 1.00 7.83 B +ATOM 1661 ND1 HIS B 98 74.517 57.790 43.472 1.00 7.93 B +ATOM 1662 CD2 HIS B 98 75.452 59.750 43.815 1.00 8.60 B +ATOM 1663 CE1 HIS B 98 74.117 58.614 42.522 1.00 8.30 B +ATOM 1664 NE2 HIS B 98 74.649 59.801 42.697 1.00 9.30 B +ATOM 1665 N ASN B 99 78.931 55.806 46.291 1.00 8.01 B +ATOM 1666 CA ASN B 99 79.752 55.341 47.423 1.00 8.93 B +ATOM 1667 C ASN B 99 78.974 55.499 48.728 1.00 7.82 B +ATOM 1668 O ASN B 99 79.517 55.928 49.777 1.00 8.81 B +ATOM 1669 CB ASN B 99 81.061 56.144 47.463 1.00 10.58 B +ATOM 1670 CG ASN B 99 82.056 55.546 48.447 1.00 11.86 B +ATOM 1671 OD1 ASN B 99 82.042 54.320 48.653 1.00 13.08 B +ATOM 1672 ND2 ASN B 99 82.877 56.417 49.031 1.00 13.49 B +ATOM 1673 N ALA B 100 77.711 55.106 48.690 1.00 7.10 B +ATOM 1674 CA ALA B 100 76.792 55.270 49.808 1.00 7.43 B +ATOM 1675 C ALA B 100 76.441 54.005 50.563 1.00 8.24 B +ATOM 1676 O ALA B 100 76.191 52.988 49.904 1.00 9.53 B +ATOM 1677 CB ALA B 100 75.483 55.884 49.262 1.00 7.38 B +ATOM 1678 N THR B 101 76.411 54.110 51.880 1.00 7.83 B +ATOM 1679 CA THR B 101 75.927 52.985 52.694 1.00 8.26 B +ATOM 1680 C THR B 101 74.436 52.883 52.331 1.00 7.07 B +ATOM 1681 O THR B 101 73.774 53.936 52.184 1.00 7.16 B +ATOM 1682 CB THR B 101 76.107 53.292 54.229 1.00 9.39 B +ATOM 1683 OG1 THR B 101 77.548 53.397 54.419 1.00 10.96 B +ATOM 1684 CG2 THR B 101 75.476 52.244 55.144 1.00 10.68 B +ATOM 1685 N PHE B 102 73.911 51.687 52.245 1.00 6.83 B +ATOM 1686 CA PHE B 102 72.488 51.556 51.894 1.00 6.82 B +ATOM 1687 C PHE B 102 71.584 52.049 53.025 1.00 6.10 B +ATOM 1688 O PHE B 102 71.847 51.781 54.203 1.00 6.28 B +ATOM 1689 CB PHE B 102 72.146 50.095 51.600 1.00 7.29 B +ATOM 1690 CG PHE B 102 72.979 49.431 50.546 1.00 7.87 B +ATOM 1691 CD1 PHE B 102 73.681 48.256 50.799 1.00 8.98 B +ATOM 1692 CD2 PHE B 102 73.053 49.997 49.264 1.00 7.94 B +ATOM 1693 CE1 PHE B 102 74.451 47.641 49.822 1.00 10.13 B +ATOM 1694 CE2 PHE B 102 73.816 49.401 48.256 1.00 8.74 B +ATOM 1695 CZ PHE B 102 74.523 48.219 48.548 1.00 9.67 B +ATOM 1696 N PRO B 103 70.515 52.750 52.655 1.00 6.23 B +ATOM 1697 CA PRO B 103 69.588 53.188 53.723 1.00 6.02 B +ATOM 1698 C PRO B 103 68.798 52.008 54.299 1.00 4.53 B +ATOM 1699 O PRO B 103 68.719 50.898 53.729 1.00 4.36 B +ATOM 1700 CB PRO B 103 68.557 54.011 52.895 1.00 7.30 B +ATOM 1701 CG PRO B 103 69.236 54.398 51.613 1.00 7.26 B +ATOM 1702 CD PRO B 103 70.155 53.207 51.314 1.00 6.81 B +ATOM 1703 N ALA B 104 68.152 52.268 55.432 1.00 4.08 B +ATOM 1704 CA ALA B 104 67.093 51.379 55.928 1.00 3.99 B +ATOM 1705 C ALA B 104 65.961 51.514 54.866 1.00 3.68 B +ATOM 1706 O ALA B 104 65.862 52.531 54.135 1.00 4.10 B +ATOM 1707 CB ALA B 104 66.624 51.799 57.278 1.00 4.60 B +ATOM 1708 N ARG B 105 65.116 50.488 54.754 1.00 4.14 B +ATOM 1709 CA ARG B 105 64.091 50.483 53.701 1.00 4.07 B +ATOM 1710 C ARG B 105 62.865 49.676 54.037 1.00 3.75 B +ATOM 1711 O ARG B 105 62.974 48.671 54.784 1.00 3.67 B +ATOM 1712 CB ARG B 105 64.776 49.844 52.439 1.00 5.04 B +ATOM 1713 CG ARG B 105 63.932 49.901 51.168 1.00 6.68 B +ATOM 1714 CD ARG B 105 64.669 49.471 49.920 1.00 7.36 B +ATOM 1715 NE ARG B 105 64.950 48.059 49.942 1.00 9.16 B +ATOM 1716 CZ ARG B 105 65.406 47.372 48.872 1.00 9.60 B +ATOM 1717 NH1 ARG B 105 65.570 46.061 48.897 1.00 10.15 B +ATOM 1718 NH2 ARG B 105 65.757 48.029 47.767 1.00 9.57 B +ATOM 1719 N SER B 106 61.735 50.143 53.519 1.00 3.97 B +ATOM 1720 CA SER B 106 60.496 49.356 53.565 1.00 4.51 B +ATOM 1721 C SER B 106 60.072 49.212 52.082 1.00 4.12 B +ATOM 1722 O SER B 106 60.266 50.144 51.289 1.00 4.73 B +ATOM 1723 CB SER B 106 59.374 49.959 54.353 1.00 5.49 B +ATOM 1724 OG SER B 106 59.796 49.957 55.710 1.00 6.48 B +HETATM 1725 N CSP B 107 59.505 48.054 51.758 1.00 4.52 B +HETATM 1726 CA CSP B 107 59.129 47.760 50.378 1.00 5.72 B +HETATM 1727 CB CSP B 107 60.089 46.804 49.700 0.67 8.42 B +HETATM 1729 SG CSP B 107 61.809 47.227 49.776 0.67 12.80 B +HETATM 1730 P CSP B 107 62.354 45.759 51.167 0.67 14.01 B +HETATM 1731 O1P CSP B 107 61.495 45.839 52.330 0.67 15.06 B +HETATM 1732 O2P CSP B 107 62.084 44.369 50.515 0.67 15.90 B +HETATM 1733 O3P CSP B 107 63.867 45.931 51.332 0.67 14.77 B +HETATM 1734 C CSP B 107 57.779 47.046 50.355 1.00 4.97 B +HETATM 1735 O CSP B 107 57.644 45.986 51.024 1.00 4.62 B +ATOM 1737 N VAL B 108 56.859 47.551 49.572 1.00 4.59 B +ATOM 1738 CA VAL B 108 55.529 46.918 49.485 1.00 4.55 B +ATOM 1739 C VAL B 108 55.005 47.075 48.074 1.00 4.55 B +ATOM 1740 O VAL B 108 55.353 48.046 47.373 1.00 4.69 B +ATOM 1741 CB VAL B 108 54.549 47.594 50.491 1.00 4.96 B +ATOM 1742 CG1 VAL B 108 54.998 47.484 51.949 1.00 5.33 B +ATOM 1743 CG2 VAL B 108 54.200 49.027 50.132 1.00 6.15 B +ATOM 1744 N GLU B 109 54.097 46.183 47.680 1.00 4.88 B +ATOM 1745 CA GLU B 109 53.393 46.293 46.413 1.00 4.49 B +ATOM 1746 C GLU B 109 52.038 46.954 46.709 1.00 4.13 B +ATOM 1747 O GLU B 109 51.280 46.405 47.528 1.00 5.16 B +ATOM 1748 CB GLU B 109 53.124 44.938 45.767 1.00 5.33 B +ATOM 1749 CG GLU B 109 52.523 45.089 44.371 1.00 5.37 B +ATOM 1750 CD GLU B 109 52.168 43.746 43.764 1.00 6.00 B +ATOM 1751 OE1 GLU B 109 51.012 43.552 43.382 1.00 7.16 B +ATOM 1752 OE2 GLU B 109 53.105 42.917 43.683 1.00 5.73 B +ATOM 1753 N VAL B 110 51.785 48.087 46.081 1.00 4.12 B +ATOM 1754 CA VAL B 110 50.496 48.778 46.266 1.00 5.16 B +ATOM 1755 C VAL B 110 49.561 48.429 45.106 1.00 4.97 B +ATOM 1756 O VAL B 110 49.994 47.748 44.159 1.00 5.83 B +ATOM 1757 CB VAL B 110 50.727 50.295 46.324 1.00 5.61 B +ATOM 1758 CG1 VAL B 110 51.594 50.678 47.521 1.00 6.03 B +ATOM 1759 CG2 VAL B 110 51.320 50.844 45.036 1.00 5.94 B +ATOM 1760 N ALA B 111 48.309 48.840 45.198 1.00 5.19 B +ATOM 1761 CA ALA B 111 47.352 48.558 44.126 1.00 5.46 B +ATOM 1762 C ALA B 111 47.562 49.429 42.900 1.00 5.34 B +ATOM 1763 O ALA B 111 47.334 48.964 41.750 1.00 6.46 B +ATOM 1764 CB ALA B 111 45.917 48.746 44.653 1.00 5.06 B +ATOM 1765 N ARG B 112 47.959 50.685 43.091 1.00 5.42 B +ATOM 1766 CA ARG B 112 48.127 51.619 41.972 1.00 5.97 B +ATOM 1767 C ARG B 112 48.900 52.817 42.478 1.00 5.15 B +ATOM 1768 O ARG B 112 48.874 53.130 43.687 1.00 5.33 B +ATOM 1769 CB ARG B 112 46.742 52.068 41.486 1.00 5.86 B +ATOM 1770 CG ARG B 112 46.714 52.715 40.113 1.00 7.01 B +ATOM 1771 CD ARG B 112 45.315 53.123 39.755 1.00 7.87 B +ATOM 1772 NE ARG B 112 45.315 53.754 38.438 1.00 9.03 B +ATOM 1773 CZ ARG B 112 44.312 54.495 37.936 1.00 9.58 B +ATOM 1774 NH1 ARG B 112 44.464 55.015 36.706 1.00 10.53 B +ATOM 1775 NH2 ARG B 112 43.181 54.677 38.619 1.00 10.02 B +ATOM 1776 N LEU B 113 49.596 53.475 41.571 1.00 5.16 B +ATOM 1777 CA LEU B 113 50.392 54.662 41.860 1.00 5.23 B +ATOM 1778 C LEU B 113 49.961 55.800 40.958 1.00 5.70 B +ATOM 1779 O LEU B 113 49.350 55.580 39.890 1.00 6.10 B +ATOM 1780 CB LEU B 113 51.873 54.335 41.632 1.00 5.50 B +ATOM 1781 CG LEU B 113 52.474 53.370 42.649 1.00 5.34 B +ATOM 1782 CD1 LEU B 113 53.859 52.921 42.176 1.00 5.70 B +ATOM 1783 CD2 LEU B 113 52.557 54.010 44.032 1.00 4.99 B +ATOM 1784 N PRO B 114 50.268 57.024 41.361 1.00 6.67 B +ATOM 1785 CA PRO B 114 49.934 58.195 40.539 1.00 7.38 B +ATOM 1786 C PRO B 114 50.475 57.984 39.124 1.00 7.04 B +ATOM 1787 O PRO B 114 51.586 57.489 38.861 1.00 7.08 B +ATOM 1788 CB PRO B 114 50.649 59.357 41.239 1.00 7.55 B +ATOM 1789 CG PRO B 114 50.756 58.922 42.679 1.00 7.89 B +ATOM 1790 CD PRO B 114 50.956 57.405 42.617 1.00 7.17 B +ATOM 1791 N LYS B 115 49.650 58.370 38.152 1.00 7.96 B +ATOM 1792 CA LYS B 115 49.953 58.299 36.717 1.00 9.22 B +ATOM 1793 C LYS B 115 50.209 56.876 36.276 1.00 9.21 B +ATOM 1794 O LYS B 115 50.835 56.725 35.203 1.00 9.21 B +ATOM 1795 CB LYS B 115 51.173 59.162 36.379 1.00 10.55 B +ATOM 1796 CG LYS B 115 50.934 60.632 36.740 1.00 12.98 B +ATOM 1797 CD LYS B 115 52.106 61.449 36.179 1.00 15.15 B +ATOM 1798 CE LYS B 115 51.791 62.932 36.188 1.00 16.92 B +ATOM 1799 NZ LYS B 115 52.176 63.588 34.907 1.00 18.34 B +ATOM 1800 N ASP B 116 49.783 55.882 37.020 1.00 8.41 B +ATOM 1801 CA ASP B 116 50.010 54.481 36.653 1.00 8.14 B +ATOM 1802 C ASP B 116 51.491 54.137 36.537 1.00 7.11 B +ATOM 1803 O ASP B 116 51.846 53.192 35.783 1.00 8.04 B +ATOM 1804 CB ASP B 116 49.198 54.075 35.408 1.00 9.13 B +ATOM 1805 CG ASP B 116 47.712 53.984 35.783 1.00 10.16 B +ATOM 1806 OD1 ASP B 116 46.977 54.853 35.295 1.00 11.23 B +ATOM 1807 OD2 ASP B 116 47.365 53.069 36.542 1.00 10.06 B +ATOM 1808 N VAL B 117 52.340 54.811 37.303 1.00 6.39 B +ATOM 1809 CA VAL B 117 53.781 54.470 37.277 1.00 5.93 B +ATOM 1810 C VAL B 117 53.972 53.123 37.988 1.00 5.45 B +ATOM 1811 O VAL B 117 53.077 52.615 38.671 1.00 5.92 B +ATOM 1812 CB VAL B 117 54.629 55.611 37.850 1.00 5.41 B +ATOM 1813 CG1 VAL B 117 54.552 56.910 37.045 1.00 6.56 B +ATOM 1814 CG2 VAL B 117 54.353 55.801 39.339 1.00 4.77 B +ATOM 1815 N LYS B 118 55.159 52.599 37.861 1.00 5.60 B +ATOM 1816 CA LYS B 118 55.494 51.309 38.448 1.00 5.78 B +ATOM 1817 C LYS B 118 56.190 51.421 39.794 1.00 5.20 B +ATOM 1818 O LYS B 118 56.351 50.398 40.449 1.00 4.89 B +ATOM 1819 CB LYS B 118 56.401 50.545 37.481 1.00 6.48 B +ATOM 1820 CG LYS B 118 55.766 50.197 36.142 1.00 8.03 B +ATOM 1821 CD LYS B 118 56.681 49.587 35.093 1.00 10.35 B +ATOM 1822 CE LYS B 118 55.939 49.354 33.779 1.00 12.02 B +ATOM 1823 NZ LYS B 118 56.770 48.768 32.708 1.00 13.89 B +ATOM 1824 N ILE B 119 56.595 52.620 40.201 1.00 4.72 B +ATOM 1825 CA ILE B 119 57.347 52.805 41.442 1.00 4.45 B +ATOM 1826 C ILE B 119 57.236 54.233 41.948 1.00 4.59 B +ATOM 1827 O ILE B 119 57.090 55.158 41.151 1.00 4.61 B +ATOM 1828 CB ILE B 119 58.835 52.378 41.166 1.00 4.91 B +ATOM 1829 CG1 ILE B 119 59.638 52.307 42.496 1.00 4.94 B +ATOM 1830 CG2 ILE B 119 59.557 53.294 40.145 1.00 5.42 B +ATOM 1831 CD1 ILE B 119 60.967 51.552 42.276 1.00 5.66 B +ATOM 1832 N GLU B 120 57.294 54.361 43.266 1.00 4.02 B +ATOM 1833 CA GLU B 120 57.295 55.668 43.938 1.00 3.81 B +ATOM 1834 C GLU B 120 58.249 55.491 45.119 1.00 3.77 B +ATOM 1835 O GLU B 120 58.112 54.507 45.874 1.00 4.01 B +ATOM 1836 CB GLU B 120 55.919 56.069 44.417 1.00 4.09 B +ATOM 1837 CG GLU B 120 55.856 57.420 45.120 1.00 4.28 B +ATOM 1838 CD GLU B 120 54.500 57.808 45.637 1.00 4.49 B +ATOM 1839 OE1 GLU B 120 54.356 58.514 46.641 1.00 6.49 B +ATOM 1840 OE2 GLU B 120 53.518 57.364 44.960 1.00 5.06 B +ATOM 1841 N ILE B 121 59.173 56.418 45.302 1.00 3.35 B +ATOM 1842 CA ILE B 121 60.161 56.304 46.382 1.00 3.57 B +ATOM 1843 C ILE B 121 60.255 57.596 47.173 1.00 3.38 B +ATOM 1844 O ILE B 121 60.488 58.665 46.614 1.00 3.55 B +ATOM 1845 CB ILE B 121 61.584 56.009 45.799 1.00 4.18 B +ATOM 1846 CG1 ILE B 121 61.562 54.777 44.888 1.00 5.00 B +ATOM 1847 CG2 ILE B 121 62.619 55.858 46.938 1.00 5.16 B +ATOM 1848 CD1 ILE B 121 62.912 54.470 44.198 1.00 5.62 B +ATOM 1849 N GLU B 122 60.086 57.456 48.487 1.00 3.62 B +ATOM 1850 CA GLU B 122 60.249 58.594 49.396 1.00 3.82 B +ATOM 1851 C GLU B 122 61.524 58.342 50.201 1.00 3.47 B +ATOM 1852 O GLU B 122 61.924 57.176 50.402 1.00 3.81 B +ATOM 1853 CB GLU B 122 59.073 58.847 50.309 1.00 6.01 B +ATOM 1854 CG GLU B 122 58.774 57.680 51.237 1.00 7.17 B +ATOM 1855 CD GLU B 122 57.696 57.886 52.243 1.00 8.33 B +ATOM 1856 OE1 GLU B 122 57.674 57.155 53.244 1.00 10.86 B +ATOM 1857 OE2 GLU B 122 56.839 58.772 52.050 1.00 7.19 B +ATOM 1858 N ALA B 123 62.151 59.418 50.651 1.00 4.17 B +ATOM 1859 CA ALA B 123 63.409 59.272 51.377 1.00 4.16 B +ATOM 1860 C ALA B 123 63.570 60.271 52.493 1.00 3.85 B +ATOM 1861 O ALA B 123 62.978 61.371 52.469 1.00 4.05 B +ATOM 1862 CB ALA B 123 64.603 59.479 50.429 1.00 5.43 B +ATOM 1863 N ILE B 124 64.325 59.869 53.494 1.00 3.64 B +ATOM 1864 CA ILE B 124 64.724 60.674 54.631 1.00 4.00 B +ATOM 1865 C ILE B 124 66.259 60.714 54.613 1.00 3.37 B +ATOM 1866 O ILE B 124 66.855 59.620 54.497 1.00 3.97 B +ATOM 1867 CB ILE B 124 64.242 60.087 56.000 1.00 5.41 B +ATOM 1868 CG1 ILE B 124 62.705 60.117 56.068 1.00 6.98 B +ATOM 1869 CG2 ILE B 124 64.859 60.874 57.183 1.00 6.64 B +ATOM 1870 CD1 ILE B 124 62.159 59.337 57.288 1.00 8.60 B +ATOM 1871 N ALA B 125 66.842 61.880 54.752 1.00 3.70 B +ATOM 1872 CA ALA B 125 68.301 62.068 54.808 1.00 4.32 B +ATOM 1873 C ALA B 125 68.635 62.930 56.028 1.00 3.88 B +ATOM 1874 O ALA B 125 67.777 63.665 56.523 1.00 4.96 B +ATOM 1875 CB ALA B 125 68.783 62.702 53.501 1.00 5.11 B +ATOM 1876 N VAL B 126 69.872 62.787 56.521 1.00 4.73 B +ATOM 1877 CA VAL B 126 70.287 63.588 57.683 1.00 5.32 B +ATOM 1878 C VAL B 126 71.648 64.218 57.397 1.00 5.65 B +ATOM 1879 O VAL B 126 72.479 63.670 56.687 1.00 6.01 B +ATOM 1880 CB VAL B 126 70.332 62.778 58.997 1.00 6.36 B +ATOM 1881 CG1 VAL B 126 68.943 62.402 59.496 1.00 7.37 B +ATOM 1882 CG2 VAL B 126 71.258 61.592 58.899 1.00 7.21 B +ATOM 1883 N ARG B 127 71.813 65.384 58.004 1.00 5.90 B +ATOM 1884 CA ARG B 127 73.105 66.095 57.867 1.00 8.86 B +ATOM 1885 C ARG B 127 74.200 65.483 58.748 1.00 10.67 B +ATOM 1886 O ARG B 127 75.374 65.521 58.297 1.00 12.25 B +ATOM 1887 CB ARG B 127 73.010 67.564 58.270 1.00 8.97 B +ATOM 1888 CG ARG B 127 71.998 68.304 57.429 1.00 8.83 B +ATOM 1889 CD ARG B 127 72.173 69.812 57.632 1.00 9.65 B +ATOM 1890 NE ARG B 127 71.128 70.494 56.885 1.00 8.63 B +ATOM 1891 CZ ARG B 127 71.181 70.713 55.591 1.00 8.65 B +ATOM 1892 NH1 ARG B 127 72.258 70.467 54.865 1.00 8.88 B +ATOM 1893 NH2 ARG B 127 70.066 71.099 54.968 1.00 8.68 B +ATOM 1894 N ARG B 128 73.836 65.001 59.905 1.00 12.46 B +ATOM 1895 CA ARG B 128 74.766 64.407 60.872 1.00 14.89 B +ATOM 1896 C ARG B 128 74.505 62.918 61.127 1.00 16.10 B +ATOM 1897 O ARG B 128 73.288 62.583 61.112 1.00 17.58 B +ATOM 1898 CB ARG B 128 74.648 65.151 62.222 1.00 15.67 B +ATOM 1899 OXT ARG B 128 75.293 62.395 61.959 1.00 17.72 B +TER +ATOM 1901 N SER C 2 75.379 59.687 62.109 1.00 16.24 C +ATOM 1902 CA SER C 2 74.424 58.545 61.990 1.00 15.30 C +ATOM 1903 C SER C 2 75.199 57.256 61.682 1.00 13.90 C +ATOM 1904 O SER C 2 76.306 57.298 61.094 1.00 15.02 C +ATOM 1905 CB SER C 2 73.331 58.796 60.983 1.00 16.11 C +ATOM 1906 OG SER C 2 73.778 58.666 59.642 1.00 18.37 C +ATOM 1907 N LYS C 3 74.598 56.142 62.095 1.00 12.13 C +ATOM 1908 CA LYS C 3 75.274 54.855 61.881 1.00 11.35 C +ATOM 1909 C LYS C 3 74.285 53.732 61.619 1.00 8.65 C +ATOM 1910 O LYS C 3 73.102 53.724 61.974 1.00 7.83 C +ATOM 1911 CB LYS C 3 76.165 54.508 63.089 1.00 13.69 C +ATOM 1912 CG LYS C 3 75.337 54.208 64.314 1.00 15.79 C +ATOM 1913 CD LYS C 3 76.074 54.056 65.631 1.00 17.79 C +ATOM 1914 CE LYS C 3 76.498 55.391 66.208 1.00 18.86 C +ATOM 1915 NZ LYS C 3 76.966 55.266 67.628 1.00 20.35 C +ATOM 1916 N THR C 4 74.837 52.734 60.953 1.00 7.14 C +ATOM 1917 CA THR C 4 74.068 51.526 60.662 1.00 6.44 C +ATOM 1918 C THR C 4 73.856 50.711 61.943 1.00 5.57 C +ATOM 1919 O THR C 4 74.785 50.616 62.800 1.00 6.47 C +ATOM 1920 CB THR C 4 74.950 50.619 59.713 1.00 7.10 C +ATOM 1921 OG1 THR C 4 75.034 51.320 58.447 1.00 8.40 C +ATOM 1922 CG2 THR C 4 74.383 49.209 59.526 1.00 7.78 C +ATOM 1923 N ILE C 5 72.684 50.115 62.056 1.00 4.90 C +ATOM 1924 CA ILE C 5 72.395 49.139 63.114 1.00 5.03 C +ATOM 1925 C ILE C 5 72.500 47.762 62.401 1.00 5.26 C +ATOM 1926 O ILE C 5 71.875 47.535 61.375 1.00 5.95 C +ATOM 1927 CB ILE C 5 70.997 49.304 63.748 1.00 5.22 C +ATOM 1928 CG1 ILE C 5 70.810 50.722 64.326 1.00 5.41 C +ATOM 1929 CG2 ILE C 5 70.734 48.204 64.802 1.00 6.47 C +ATOM 1930 CD1 ILE C 5 69.334 51.050 64.678 1.00 4.98 C +ATOM 1931 N ALA C 6 73.340 46.901 62.990 1.00 5.80 C +ATOM 1932 CA ALA C 6 73.548 45.548 62.428 1.00 7.32 C +ATOM 1933 C ALA C 6 73.578 44.573 63.599 1.00 7.57 C +ATOM 1934 O ALA C 6 74.414 44.680 64.516 1.00 10.07 C +ATOM 1935 CB ALA C 6 74.808 45.481 61.583 1.00 8.24 C +ATOM 1936 N THR C 7 72.613 43.666 63.612 1.00 6.19 C +ATOM 1937 CA THR C 7 72.481 42.676 64.681 1.00 6.55 C +ATOM 1938 C THR C 7 72.188 41.286 64.145 1.00 5.76 C +ATOM 1939 O THR C 7 71.468 41.146 63.171 1.00 6.20 C +ATOM 1940 CB THR C 7 71.330 43.117 65.663 1.00 7.01 C +ATOM 1941 OG1 THR C 7 71.214 42.032 66.622 1.00 7.16 C +ATOM 1942 CG2 THR C 7 69.980 43.363 65.012 1.00 7.30 C +ATOM 1943 N GLU C 8 72.807 40.282 64.754 1.00 6.37 C +ATOM 1944 CA GLU C 8 72.568 38.895 64.376 1.00 6.48 C +ATOM 1945 C GLU C 8 71.162 38.497 64.803 1.00 6.14 C +ATOM 1946 O GLU C 8 70.650 37.460 64.341 1.00 6.07 C +ATOM 1947 CB GLU C 8 73.559 37.922 65.033 1.00 7.91 C +ATOM 1948 CG GLU C 8 73.490 37.722 66.540 1.00 9.70 C +ATOM 1949 CD GLU C 8 74.051 38.814 67.395 1.00 11.36 C +ATOM 1950 OE1 GLU C 8 74.261 39.958 66.979 1.00 12.18 C +ATOM 1951 OE2 GLU C 8 74.276 38.489 68.603 1.00 13.35 C +ATOM 1952 N ASN C 9 70.529 39.286 65.675 1.00 6.75 C +ATOM 1953 CA ASN C 9 69.204 38.967 66.220 1.00 7.05 C +ATOM 1954 C ASN C 9 68.025 39.238 65.308 1.00 7.06 C +ATOM 1955 O ASN C 9 66.872 38.959 65.680 1.00 6.95 C +ATOM 1956 CB ASN C 9 69.019 39.590 67.590 1.00 7.91 C +ATOM 1957 CG ASN C 9 70.034 39.030 68.573 1.00 9.05 C +ATOM 1958 OD1 ASN C 9 70.332 37.816 68.514 1.00 10.43 C +ATOM 1959 ND2 ASN C 9 70.545 39.902 69.410 1.00 9.59 C +ATOM 1960 N ALA C 10 68.250 39.839 64.140 1.00 5.82 C +ATOM 1961 CA ALA C 10 67.198 40.069 63.131 1.00 5.77 C +ATOM 1962 C ALA C 10 67.795 39.464 61.835 1.00 6.13 C +ATOM 1963 O ALA C 10 69.012 39.310 61.744 1.00 5.80 C +ATOM 1964 CB ALA C 10 66.850 41.527 62.935 1.00 6.12 C +ATOM 1965 N PRO C 11 66.939 39.127 60.887 1.00 6.62 C +ATOM 1966 CA PRO C 11 67.427 38.556 59.626 1.00 6.86 C +ATOM 1967 C PRO C 11 68.470 39.432 58.991 1.00 6.78 C +ATOM 1968 O PRO C 11 68.299 40.681 58.925 1.00 6.19 C +ATOM 1969 CB PRO C 11 66.191 38.483 58.750 1.00 7.77 C +ATOM 1970 CG PRO C 11 65.012 38.512 59.680 1.00 8.11 C +ATOM 1971 CD PRO C 11 65.475 39.270 60.918 1.00 7.42 C +ATOM 1972 N ALA C 12 69.527 38.830 58.469 1.00 8.21 C +ATOM 1973 CA ALA C 12 70.624 39.572 57.836 1.00 9.55 C +ATOM 1974 C ALA C 12 70.099 40.348 56.629 1.00 10.63 C +ATOM 1975 O ALA C 12 69.197 39.905 55.909 1.00 9.79 C +ATOM 1976 CB ALA C 12 71.687 38.589 57.344 1.00 10.50 C +ATOM 1977 N ALA C 13 70.685 41.520 56.468 1.00 11.95 C +ATOM 1978 CA ALA C 13 70.356 42.435 55.363 1.00 14.35 C +ATOM 1979 C ALA C 13 71.201 42.006 54.159 1.00 15.86 C +ATOM 1980 O ALA C 13 72.361 42.446 54.077 1.00 17.22 C +ATOM 1981 CB ALA C 13 70.640 43.882 55.728 1.00 14.52 C +ATOM 1982 N ILE C 14 70.571 41.192 53.335 1.00 16.89 C +ATOM 1983 CA ILE C 14 71.268 40.701 52.121 1.00 18.21 C +ATOM 1984 C ILE C 14 71.151 41.712 50.983 1.00 18.11 C +ATOM 1985 O ILE C 14 72.218 42.096 50.420 1.00 19.37 C +ATOM 1986 CB ILE C 14 70.805 39.249 51.808 1.00 19.06 C +ATOM 1987 CG1 ILE C 14 71.045 38.352 53.063 1.00 19.75 C +ATOM 1988 CG2 ILE C 14 71.498 38.616 50.571 1.00 19.75 C +ATOM 1989 CD1 ILE C 14 70.339 36.972 52.904 1.00 20.29 C +ATOM 1990 N GLY C 15 69.955 42.164 50.671 1.00 17.28 C +ATOM 1991 CA GLY C 15 69.783 43.173 49.589 1.00 15.10 C +ATOM 1992 C GLY C 15 70.474 44.499 49.929 1.00 13.16 C +ATOM 1993 O GLY C 15 71.233 44.655 50.901 1.00 14.07 C +ATOM 1994 N PRO C 16 70.180 45.491 49.082 1.00 11.29 C +ATOM 1995 CA PRO C 16 70.743 46.834 49.214 1.00 9.14 C +ATOM 1996 C PRO C 16 70.025 47.663 50.263 1.00 8.00 C +ATOM 1997 O PRO C 16 69.393 48.680 49.940 1.00 6.68 C +ATOM 1998 CB PRO C 16 70.627 47.384 47.790 1.00 9.25 C +ATOM 1999 CG PRO C 16 69.299 46.821 47.323 1.00 9.12 C +ATOM 2000 CD PRO C 16 69.312 45.393 47.874 1.00 10.61 C +ATOM 2001 N TYR C 17 70.158 47.238 51.512 1.00 6.92 C +ATOM 2002 CA TYR C 17 69.552 47.969 52.643 1.00 6.14 C +ATOM 2003 C TYR C 17 70.301 47.559 53.900 1.00 5.54 C +ATOM 2004 O TYR C 17 71.069 46.568 53.863 1.00 7.15 C +ATOM 2005 CB TYR C 17 68.038 47.653 52.770 1.00 6.78 C +ATOM 2006 CG TYR C 17 67.760 46.184 53.035 1.00 7.73 C +ATOM 2007 CD1 TYR C 17 67.570 45.725 54.354 1.00 8.18 C +ATOM 2008 CD2 TYR C 17 67.736 45.220 52.031 1.00 8.87 C +ATOM 2009 CE1 TYR C 17 67.316 44.386 54.645 1.00 9.51 C +ATOM 2010 CE2 TYR C 17 67.498 43.868 52.309 1.00 10.50 C +ATOM 2011 CZ TYR C 17 67.302 43.463 53.612 1.00 10.45 C +ATOM 2012 OH TYR C 17 67.069 42.136 53.906 1.00 12.81 C +ATOM 2013 N VAL C 18 70.101 48.285 54.974 1.00 5.53 C +ATOM 2014 CA VAL C 18 70.616 47.936 56.302 1.00 5.01 C +ATOM 2015 C VAL C 18 69.366 47.657 57.143 1.00 5.01 C +ATOM 2016 O VAL C 18 68.264 48.112 56.823 1.00 5.04 C +ATOM 2017 CB VAL C 18 71.510 48.995 56.929 1.00 5.59 C +ATOM 2018 CG1 VAL C 18 72.797 49.086 56.116 1.00 6.33 C +ATOM 2019 CG2 VAL C 18 70.825 50.342 57.091 1.00 6.00 C +ATOM 2020 N GLN C 19 69.553 46.945 58.244 1.00 4.48 C +ATOM 2021 CA GLN C 19 68.446 46.600 59.142 1.00 4.00 C +ATOM 2022 C GLN C 19 67.805 47.834 59.775 1.00 3.80 C +ATOM 2023 O GLN C 19 66.598 47.857 60.035 1.00 3.75 C +ATOM 2024 CB GLN C 19 68.895 45.663 60.267 1.00 5.03 C +ATOM 2025 CG GLN C 19 69.363 44.310 59.743 1.00 5.44 C +ATOM 2026 CD GLN C 19 70.048 43.542 60.837 1.00 5.87 C +ATOM 2027 OE1 GLN C 19 70.789 44.130 61.623 1.00 7.44 C +ATOM 2028 NE2 GLN C 19 69.850 42.220 60.896 1.00 6.86 C +ATOM 2029 N GLY C 20 68.629 48.826 60.101 1.00 4.08 C +ATOM 2030 CA GLY C 20 68.083 50.054 60.731 1.00 3.84 C +ATOM 2031 C GLY C 20 69.194 51.077 60.795 1.00 3.63 C +ATOM 2032 O GLY C 20 70.366 50.763 60.515 1.00 3.92 C +ATOM 2033 N VAL C 21 68.820 52.293 61.175 1.00 3.33 C +ATOM 2034 CA VAL C 21 69.766 53.390 61.313 1.00 3.95 C +ATOM 2035 C VAL C 21 69.576 54.047 62.676 1.00 3.79 C +ATOM 2036 O VAL C 21 68.449 54.224 63.146 1.00 4.94 C +ATOM 2037 CB VAL C 21 69.624 54.401 60.160 1.00 3.78 C +ATOM 2038 CG1 VAL C 21 70.091 53.754 58.864 1.00 4.83 C +ATOM 2039 CG2 VAL C 21 68.190 54.888 60.047 1.00 4.51 C +ATOM 2040 N ASP C 22 70.702 54.402 63.260 1.00 4.14 C +ATOM 2041 CA ASP C 22 70.749 55.097 64.566 1.00 4.70 C +ATOM 2042 C ASP C 22 71.148 56.528 64.213 1.00 4.45 C +ATOM 2043 O ASP C 22 72.315 56.763 63.839 1.00 5.58 C +ATOM 2044 CB ASP C 22 71.720 54.398 65.504 1.00 6.22 C +ATOM 2045 CG ASP C 22 71.968 55.106 66.810 1.00 7.08 C +ATOM 2046 OD1 ASP C 22 72.601 54.461 67.693 1.00 8.97 C +ATOM 2047 OD2 ASP C 22 71.563 56.249 66.976 1.00 7.76 C +ATOM 2048 N LEU C 23 70.241 57.471 64.305 1.00 4.71 C +ATOM 2049 CA LEU C 23 70.471 58.871 63.966 1.00 5.58 C +ATOM 2050 C LEU C 23 70.823 59.745 65.149 1.00 6.38 C +ATOM 2051 O LEU C 23 70.882 60.979 64.983 1.00 8.55 C +ATOM 2052 CB LEU C 23 69.193 59.403 63.270 1.00 5.54 C +ATOM 2053 CG LEU C 23 68.674 58.507 62.154 1.00 6.24 C +ATOM 2054 CD1 LEU C 23 67.451 59.178 61.512 1.00 6.77 C +ATOM 2055 CD2 LEU C 23 69.707 58.259 61.054 1.00 6.93 C +ATOM 2056 N GLY C 24 71.039 59.166 66.286 1.00 6.72 C +ATOM 2057 CA GLY C 24 71.338 59.920 67.523 1.00 7.67 C +ATOM 2058 C GLY C 24 70.084 59.707 68.400 1.00 7.60 C +ATOM 2059 O GLY C 24 69.915 58.600 68.942 1.00 8.31 C +ATOM 2060 N ASN C 25 69.248 60.704 68.474 1.00 7.01 C +ATOM 2061 CA ASN C 25 68.036 60.524 69.301 1.00 7.87 C +ATOM 2062 C ASN C 25 67.049 59.570 68.622 1.00 7.17 C +ATOM 2063 O ASN C 25 66.371 58.790 69.317 1.00 7.79 C +ATOM 2064 CB ASN C 25 67.343 61.872 69.507 1.00 9.22 C +ATOM 2065 CG ASN C 25 66.113 61.713 70.393 1.00 10.32 C +ATOM 2066 OD1 ASN C 25 66.200 61.175 71.506 1.00 12.32 C +ATOM 2067 ND2 ASN C 25 64.967 62.167 69.869 1.00 11.31 C +ATOM 2068 N MET C 26 66.912 59.596 67.320 1.00 6.21 C +ATOM 2069 CA MET C 26 65.949 58.766 66.599 1.00 5.60 C +ATOM 2070 C MET C 26 66.583 57.556 65.937 1.00 5.14 C +ATOM 2071 O MET C 26 67.653 57.663 65.301 1.00 5.60 C +ATOM 2072 CB MET C 26 65.295 59.657 65.517 1.00 6.37 C +ATOM 2073 CG MET C 26 64.201 58.892 64.822 1.00 7.10 C +ATOM 2074 SD MET C 26 63.237 59.952 63.718 1.00 8.83 C +ATOM 2075 CE MET C 26 62.195 60.817 64.935 1.00 9.98 C +ATOM 2076 N ILE C 27 65.904 56.435 66.080 1.00 4.19 C +ATOM 2077 CA ILE C 27 66.272 55.172 65.439 1.00 4.28 C +ATOM 2078 C ILE C 27 65.142 54.845 64.446 1.00 3.82 C +ATOM 2079 O ILE C 27 63.960 54.992 64.828 1.00 3.92 C +ATOM 2080 CB ILE C 27 66.370 54.038 66.521 1.00 6.29 C +ATOM 2081 CG1 ILE C 27 67.744 54.078 67.247 1.00 7.15 C +ATOM 2082 CG2 ILE C 27 66.085 52.630 65.945 1.00 7.40 C +ATOM 2083 CD1 ILE C 27 68.089 55.432 67.892 1.00 7.34 C +ATOM 2084 N ILE C 28 65.496 54.416 63.256 1.00 3.50 C +ATOM 2085 CA ILE C 28 64.494 54.000 62.289 1.00 3.86 C +ATOM 2086 C ILE C 28 64.841 52.595 61.811 1.00 3.50 C +ATOM 2087 O ILE C 28 66.009 52.349 61.387 1.00 4.39 C +ATOM 2088 CB ILE C 28 64.397 54.955 61.051 1.00 4.84 C +ATOM 2089 CG1 ILE C 28 64.271 56.417 61.518 1.00 5.31 C +ATOM 2090 CG2 ILE C 28 63.234 54.508 60.136 1.00 5.87 C +ATOM 2091 CD1 ILE C 28 64.133 57.405 60.336 1.00 5.89 C +ATOM 2092 N THR C 29 63.885 51.698 61.836 1.00 3.96 C +ATOM 2093 CA THR C 29 64.117 50.363 61.295 1.00 4.14 C +ATOM 2094 C THR C 29 63.625 50.241 59.858 1.00 3.59 C +ATOM 2095 O THR C 29 62.751 50.957 59.398 1.00 4.36 C +ATOM 2096 CB THR C 29 63.402 49.229 62.148 1.00 4.08 C +ATOM 2097 OG1 THR C 29 62.003 49.151 61.797 1.00 3.82 C +ATOM 2098 CG2 THR C 29 63.547 49.413 63.662 1.00 4.97 C +ATOM 2099 N SER C 30 64.195 49.245 59.184 1.00 3.82 C +ATOM 2100 CA SER C 30 63.673 48.819 57.896 1.00 3.64 C +ATOM 2101 C SER C 30 62.342 48.083 58.225 1.00 3.76 C +ATOM 2102 O SER C 30 62.094 47.678 59.377 1.00 4.49 C +ATOM 2103 CB SER C 30 64.615 47.782 57.269 1.00 3.92 C +ATOM 2104 OG SER C 30 65.679 48.466 56.635 1.00 4.47 C +ATOM 2105 N GLY C 31 61.521 47.915 57.202 1.00 3.83 C +ATOM 2106 CA GLY C 31 60.254 47.176 57.299 1.00 4.29 C +ATOM 2107 C GLY C 31 60.617 45.727 57.583 1.00 4.32 C +ATOM 2108 O GLY C 31 61.268 45.108 56.714 1.00 6.10 C +ATOM 2109 N GLN C 32 60.248 45.164 58.708 1.00 3.41 C +ATOM 2110 CA GLN C 32 60.581 43.789 59.085 1.00 3.93 C +ATOM 2111 C GLN C 32 59.469 42.841 58.647 1.00 3.99 C +ATOM 2112 O GLN C 32 58.292 43.019 58.943 1.00 4.71 C +ATOM 2113 CB GLN C 32 60.781 43.678 60.603 1.00 4.22 C +ATOM 2114 CG GLN C 32 61.955 44.494 61.116 1.00 3.95 C +ATOM 2115 CD GLN C 32 63.233 44.181 60.387 1.00 4.74 C +ATOM 2116 OE1 GLN C 32 63.674 43.025 60.399 1.00 5.56 C +ATOM 2117 NE2 GLN C 32 63.775 45.179 59.688 1.00 4.99 C +ATOM 2118 N ILE C 33 59.924 41.772 58.014 1.00 5.20 C +ATOM 2119 CA ILE C 33 59.037 40.684 57.594 1.00 5.52 C +ATOM 2120 C ILE C 33 59.277 39.527 58.558 1.00 5.61 C +ATOM 2121 O ILE C 33 60.308 39.471 59.271 1.00 5.33 C +ATOM 2122 CB ILE C 33 59.247 40.335 56.109 1.00 6.50 C +ATOM 2123 CG1 ILE C 33 60.720 39.958 55.811 1.00 7.36 C +ATOM 2124 CG2 ILE C 33 58.775 41.489 55.181 1.00 7.63 C +ATOM 2125 CD1 ILE C 33 60.854 39.290 54.422 1.00 8.30 C +ATOM 2126 N PRO C 34 58.333 38.606 58.600 1.00 5.57 C +ATOM 2127 CA PRO C 34 58.367 37.522 59.576 1.00 5.47 C +ATOM 2128 C PRO C 34 59.321 36.371 59.282 1.00 5.79 C +ATOM 2129 O PRO C 34 58.907 35.192 59.360 1.00 7.27 C +ATOM 2130 CB PRO C 34 56.914 37.030 59.664 1.00 5.88 C +ATOM 2131 CG PRO C 34 56.396 37.325 58.276 1.00 6.23 C +ATOM 2132 CD PRO C 34 57.019 38.678 57.937 1.00 5.26 C +ATOM 2133 N VAL C 35 60.555 36.721 58.985 1.00 5.68 C +ATOM 2134 CA VAL C 35 61.601 35.706 58.775 1.00 6.40 C +ATOM 2135 C VAL C 35 62.295 35.492 60.117 1.00 5.88 C +ATOM 2136 O VAL C 35 62.677 36.425 60.824 1.00 5.93 C +ATOM 2137 CB VAL C 35 62.615 36.200 57.731 1.00 7.54 C +ATOM 2138 CG1 VAL C 35 63.850 35.300 57.671 1.00 7.74 C +ATOM 2139 CG2 VAL C 35 61.976 36.356 56.376 1.00 7.73 C +ATOM 2140 N ASN C 36 62.453 34.209 60.449 1.00 6.56 C +ATOM 2141 CA ASN C 36 63.134 33.832 61.711 1.00 7.61 C +ATOM 2142 C ASN C 36 64.632 34.009 61.509 1.00 7.47 C +ATOM 2143 O ASN C 36 65.195 33.398 60.575 1.00 8.51 C +ATOM 2144 CB ASN C 36 62.735 32.397 62.016 1.00 9.42 C +ATOM 2145 CG ASN C 36 63.346 31.815 63.262 1.00 11.61 C +ATOM 2146 OD1 ASN C 36 64.567 31.911 63.471 1.00 12.84 C +ATOM 2147 ND2 ASN C 36 62.500 31.143 64.047 1.00 12.39 C +ATOM 2148 N PRO C 37 65.329 34.757 62.330 1.00 7.10 C +ATOM 2149 CA PRO C 37 66.766 34.975 62.151 1.00 8.07 C +ATOM 2150 C PRO C 37 67.622 33.759 62.412 1.00 8.69 C +ATOM 2151 O PRO C 37 68.790 33.731 62.001 1.00 9.39 C +ATOM 2152 CB PRO C 37 67.097 36.114 63.114 1.00 8.93 C +ATOM 2153 CG PRO C 37 66.064 35.942 64.190 1.00 9.33 C +ATOM 2154 CD PRO C 37 64.793 35.519 63.459 1.00 8.45 C +ATOM 2155 N LYS C 38 67.088 32.797 63.140 1.00 9.24 C +ATOM 2156 CA LYS C 38 67.841 31.560 63.446 1.00 11.17 C +ATOM 2157 C LYS C 38 67.772 30.604 62.270 1.00 11.35 C +ATOM 2158 O LYS C 38 68.821 30.007 61.908 1.00 12.18 C +ATOM 2159 CB LYS C 38 67.259 30.905 64.682 1.00 12.66 C +ATOM 2160 CG LYS C 38 67.972 29.693 65.260 1.00 13.74 C +ATOM 2161 CD LYS C 38 67.360 29.220 66.600 1.00 14.42 C +ATOM 2162 CE LYS C 38 67.528 30.156 67.638 1.00 17.20 C +ATOM 2163 NZ LYS C 38 68.973 30.401 67.909 1.00 18.80 C +ATOM 2164 N THR C 39 66.605 30.410 61.667 1.00 11.29 C +ATOM 2165 CA THR C 39 66.426 29.447 60.585 1.00 11.38 C +ATOM 2166 C THR C 39 66.161 29.945 59.192 1.00 11.67 C +ATOM 2167 O THR C 39 66.283 29.146 58.231 1.00 12.12 C +ATOM 2168 CB THR C 39 65.202 28.498 60.967 1.00 11.46 C +ATOM 2169 OG1 THR C 39 64.024 29.377 60.899 1.00 11.47 C +ATOM 2170 CG2 THR C 39 65.321 27.870 62.342 1.00 12.27 C +ATOM 2171 N GLY C 40 65.724 31.191 59.069 1.00 11.14 C +ATOM 2172 CA GLY C 40 65.397 31.757 57.763 1.00 11.25 C +ATOM 2173 C GLY C 40 63.969 31.414 57.343 1.00 11.36 C +ATOM 2174 O GLY C 40 63.543 31.858 56.264 1.00 12.70 C +ATOM 2175 N GLU C 41 63.248 30.667 58.149 1.00 11.11 C +ATOM 2176 CA GLU C 41 61.871 30.278 57.815 1.00 11.71 C +ATOM 2177 C GLU C 41 60.833 31.296 58.245 1.00 10.19 C +ATOM 2178 O GLU C 41 61.111 32.099 59.139 1.00 10.11 C +ATOM 2179 CB GLU C 41 61.534 28.947 58.517 1.00 13.86 C +ATOM 2180 CG GLU C 41 62.414 27.808 57.967 1.00 16.75 C +ATOM 2181 CD GLU C 41 62.196 26.469 58.606 1.00 18.82 C +ATOM 2182 OE1 GLU C 41 61.693 26.338 59.711 1.00 19.76 C +ATOM 2183 OE2 GLU C 41 62.618 25.559 57.848 1.00 20.70 C +ATOM 2184 N VAL C 42 59.670 31.202 57.633 1.00 9.39 C +ATOM 2185 CA VAL C 42 58.529 32.092 57.933 1.00 8.66 C +ATOM 2186 C VAL C 42 57.415 31.207 58.479 1.00 8.84 C +ATOM 2187 O VAL C 42 57.073 30.227 57.758 1.00 8.91 C +ATOM 2188 CB VAL C 42 58.081 32.799 56.643 1.00 8.81 C +ATOM 2189 CG1 VAL C 42 56.777 33.559 56.885 1.00 8.55 C +ATOM 2190 CG2 VAL C 42 59.169 33.725 56.120 1.00 9.11 C +ATOM 2191 N PRO C 43 56.877 31.514 59.617 1.00 8.44 C +ATOM 2192 CA PRO C 43 55.791 30.715 60.210 1.00 9.28 C +ATOM 2193 C PRO C 43 54.546 30.918 59.367 1.00 9.79 C +ATOM 2194 O PRO C 43 54.342 32.000 58.768 1.00 9.85 C +ATOM 2195 CB PRO C 43 55.701 31.207 61.650 1.00 9.38 C +ATOM 2196 CG PRO C 43 56.141 32.652 61.567 1.00 9.11 C +ATOM 2197 CD PRO C 43 57.216 32.661 60.480 1.00 8.87 C +ATOM 2198 N ALA C 44 53.711 29.882 59.303 1.00 11.00 C +ATOM 2199 CA ALA C 44 52.480 29.932 58.508 1.00 11.90 C +ATOM 2200 C ALA C 44 51.404 30.874 59.042 1.00 12.03 C +ATOM 2201 O ALA C 44 50.802 31.691 58.329 1.00 13.47 C +ATOM 2202 CB ALA C 44 51.963 28.484 58.433 1.00 12.50 C +ATOM 2203 N ASP C 45 51.148 30.762 60.303 1.00 11.52 C +ATOM 2204 CA ASP C 45 50.149 31.428 61.135 1.00 11.81 C +ATOM 2205 C ASP C 45 50.292 32.946 61.109 1.00 10.80 C +ATOM 2206 O ASP C 45 51.424 33.415 61.365 1.00 9.73 C +ATOM 2207 CB ASP C 45 50.311 30.749 62.522 1.00 12.76 C +ATOM 2208 CG ASP C 45 49.304 31.268 63.505 1.00 14.25 C +ATOM 2209 OD1 ASP C 45 49.667 32.157 64.292 1.00 13.77 C +ATOM 2210 OD2 ASP C 45 48.132 30.805 63.527 1.00 15.41 C +ATOM 2211 N VAL C 46 49.235 33.695 60.863 1.00 10.67 C +ATOM 2212 CA VAL C 46 49.368 35.167 60.837 1.00 9.52 C +ATOM 2213 C VAL C 46 49.754 35.756 62.188 1.00 7.84 C +ATOM 2214 O VAL C 46 50.509 36.743 62.245 1.00 7.66 C +ATOM 2215 CB VAL C 46 48.136 35.839 60.208 1.00 10.26 C +ATOM 2216 CG1 VAL C 46 46.877 35.681 61.046 1.00 10.79 C +ATOM 2217 CG2 VAL C 46 48.431 37.284 59.868 1.00 10.65 C +ATOM 2218 N ALA C 47 49.237 35.185 63.265 1.00 7.55 C +ATOM 2219 CA ALA C 47 49.612 35.697 64.600 1.00 7.95 C +ATOM 2220 C ALA C 47 51.114 35.497 64.795 1.00 7.45 C +ATOM 2221 O ALA C 47 51.831 36.408 65.283 1.00 7.40 C +ATOM 2222 CB ALA C 47 48.813 35.003 65.692 1.00 8.33 C +ATOM 2223 N ALA C 48 51.602 34.327 64.432 1.00 6.86 C +ATOM 2224 CA ALA C 48 53.034 34.040 64.567 1.00 6.14 C +ATOM 2225 C ALA C 48 53.826 34.976 63.666 1.00 5.74 C +ATOM 2226 O ALA C 48 54.919 35.401 64.063 1.00 5.87 C +ATOM 2227 CB ALA C 48 53.277 32.576 64.257 1.00 6.39 C +ATOM 2228 N GLN C 49 53.331 35.270 62.494 1.00 5.59 C +ATOM 2229 CA GLN C 49 54.043 36.209 61.597 1.00 5.03 C +ATOM 2230 C GLN C 49 54.116 37.590 62.247 1.00 4.68 C +ATOM 2231 O GLN C 49 55.172 38.233 62.234 1.00 5.23 C +ATOM 2232 CB GLN C 49 53.385 36.255 60.225 1.00 5.71 C +ATOM 2233 CG GLN C 49 53.671 34.994 59.395 1.00 6.17 C +ATOM 2234 CD GLN C 49 53.381 35.202 57.921 1.00 5.93 C +ATOM 2235 OE1 GLN C 49 53.335 36.340 57.420 1.00 5.99 C +ATOM 2236 NE2 GLN C 49 53.220 34.110 57.175 1.00 6.38 C +ATOM 2237 N ALA C 50 52.982 38.029 62.786 1.00 4.71 C +ATOM 2238 CA ALA C 50 53.010 39.364 63.431 1.00 4.54 C +ATOM 2239 C ALA C 50 54.046 39.396 64.554 1.00 4.94 C +ATOM 2240 O ALA C 50 54.833 40.349 64.694 1.00 4.87 C +ATOM 2241 CB ALA C 50 51.649 39.764 63.973 1.00 5.66 C +ATOM 2242 N ARG C 51 54.078 38.327 65.338 1.00 5.38 C +ATOM 2243 CA ARG C 51 55.051 38.260 66.439 1.00 5.49 C +ATOM 2244 C ARG C 51 56.478 38.200 65.950 1.00 5.04 C +ATOM 2245 O ARG C 51 57.349 38.845 66.565 1.00 6.12 C +ATOM 2246 CB ARG C 51 54.730 37.136 67.419 1.00 6.73 C +ATOM 2247 CG ARG C 51 55.631 37.074 68.640 1.00 7.56 C +ATOM 2248 CD ARG C 51 55.064 36.205 69.722 1.00 8.32 C +ATOM 2249 NE ARG C 51 53.902 36.735 70.418 1.00 8.95 C +ATOM 2250 CZ ARG C 51 53.925 37.601 71.442 1.00 9.18 C +ATOM 2251 NH1 ARG C 51 55.070 38.084 71.924 1.00 8.39 C +ATOM 2252 NH2 ARG C 51 52.772 37.999 71.993 1.00 10.81 C +ATOM 2253 N GLN C 52 56.762 37.460 64.896 1.00 4.75 C +ATOM 2254 CA GLN C 52 58.134 37.375 64.365 1.00 4.61 C +ATOM 2255 C GLN C 52 58.546 38.755 63.848 1.00 4.34 C +ATOM 2256 O GLN C 52 59.715 39.161 64.060 1.00 4.87 C +ATOM 2257 CB GLN C 52 58.235 36.296 63.303 1.00 5.74 C +ATOM 2258 CG GLN C 52 59.657 36.148 62.806 1.00 5.80 C +ATOM 2259 CD GLN C 52 60.622 35.679 63.854 1.00 6.30 C +ATOM 2260 OE1 GLN C 52 60.690 34.471 64.133 1.00 7.97 C +ATOM 2261 NE2 GLN C 52 61.386 36.576 64.428 1.00 7.04 C +ATOM 2262 N SER C 53 57.667 39.438 63.125 1.00 4.36 C +ATOM 2263 CA SER C 53 58.016 40.796 62.658 1.00 4.64 C +ATOM 2264 C SER C 53 58.319 41.730 63.831 1.00 4.34 C +ATOM 2265 O SER C 53 59.298 42.486 63.783 1.00 4.42 C +ATOM 2266 CB SER C 53 56.895 41.346 61.801 1.00 5.03 C +ATOM 2267 OG SER C 53 56.920 40.874 60.480 1.00 7.71 C +ATOM 2268 N LEU C 54 57.494 41.672 64.858 1.00 4.12 C +ATOM 2269 CA LEU C 54 57.715 42.501 66.053 1.00 4.70 C +ATOM 2270 C LEU C 54 59.020 42.130 66.747 1.00 3.93 C +ATOM 2271 O LEU C 54 59.740 43.026 67.222 1.00 4.71 C +ATOM 2272 CB LEU C 54 56.508 42.407 66.961 1.00 5.03 C +ATOM 2273 CG LEU C 54 55.288 43.166 66.430 1.00 5.82 C +ATOM 2274 CD1 LEU C 54 54.045 42.760 67.223 1.00 5.88 C +ATOM 2275 CD2 LEU C 54 55.463 44.673 66.492 1.00 6.70 C +ATOM 2276 N ASP C 55 59.334 40.853 66.819 1.00 4.46 C +ATOM 2277 CA ASP C 55 60.595 40.440 67.461 1.00 4.76 C +ATOM 2278 C ASP C 55 61.777 40.976 66.648 1.00 5.09 C +ATOM 2279 O ASP C 55 62.801 41.316 67.240 1.00 4.83 C +ATOM 2280 CB ASP C 55 60.620 38.926 67.603 1.00 6.75 C +ATOM 2281 CG ASP C 55 59.894 38.396 68.831 1.00 8.66 C +ATOM 2282 OD1 ASP C 55 59.457 37.229 68.842 1.00 10.67 C +ATOM 2283 OD2 ASP C 55 59.813 39.156 69.804 1.00 10.74 C +ATOM 2284 N ASN C 56 61.607 40.966 65.338 1.00 4.45 C +ATOM 2285 CA ASN C 56 62.713 41.477 64.473 1.00 3.71 C +ATOM 2286 C ASN C 56 62.874 42.971 64.745 1.00 3.25 C +ATOM 2287 O ASN C 56 64.018 43.473 64.821 1.00 4.24 C +ATOM 2288 CB ASN C 56 62.455 41.182 62.994 1.00 4.47 C +ATOM 2289 CG ASN C 56 62.655 39.696 62.707 1.00 4.53 C +ATOM 2290 OD1 ASN C 56 63.249 38.956 63.521 1.00 5.62 C +ATOM 2291 ND2 ASN C 56 62.124 39.213 61.580 1.00 4.94 C +ATOM 2292 N VAL C 57 61.766 43.710 64.803 1.00 4.41 C +ATOM 2293 CA VAL C 57 61.842 45.156 65.125 1.00 4.09 C +ATOM 2294 C VAL C 57 62.535 45.322 66.462 1.00 3.73 C +ATOM 2295 O VAL C 57 63.454 46.150 66.644 1.00 4.05 C +ATOM 2296 CB VAL C 57 60.449 45.777 65.167 1.00 4.49 C +ATOM 2297 CG1 VAL C 57 60.478 47.143 65.858 1.00 5.66 C +ATOM 2298 CG2 VAL C 57 59.829 45.886 63.791 1.00 5.00 C +ATOM 2299 N LYS C 58 62.121 44.563 67.461 1.00 3.78 C +ATOM 2300 CA LYS C 58 62.701 44.626 68.814 1.00 4.51 C +ATOM 2301 C LYS C 58 64.200 44.385 68.786 1.00 4.64 C +ATOM 2302 O LYS C 58 64.970 45.078 69.453 1.00 4.91 C +ATOM 2303 CB LYS C 58 62.023 43.566 69.685 1.00 5.87 C +ATOM 2304 CG LYS C 58 62.715 43.368 71.037 1.00 6.61 C +ATOM 2305 CD LYS C 58 61.914 42.422 71.911 1.00 8.95 C +ATOM 2306 CE LYS C 58 62.736 41.827 73.036 1.00 9.79 C +ATOM 2307 NZ LYS C 58 61.926 40.944 73.903 1.00 10.97 C +ATOM 2308 N ALA C 59 64.648 43.393 68.027 1.00 4.57 C +ATOM 2309 CA ALA C 59 66.089 43.097 67.955 1.00 4.83 C +ATOM 2310 C ALA C 59 66.884 44.313 67.483 1.00 4.63 C +ATOM 2311 O ALA C 59 67.993 44.584 67.996 1.00 4.41 C +ATOM 2312 CB ALA C 59 66.337 41.941 67.000 1.00 5.64 C +ATOM 2313 N ILE C 60 66.365 45.015 66.485 1.00 4.27 C +ATOM 2314 CA ILE C 60 67.056 46.183 65.916 1.00 4.66 C +ATOM 2315 C ILE C 60 67.056 47.337 66.898 1.00 3.81 C +ATOM 2316 O ILE C 60 68.071 48.023 67.079 1.00 4.20 C +ATOM 2317 CB ILE C 60 66.403 46.509 64.546 1.00 4.36 C +ATOM 2318 CG1 ILE C 60 66.623 45.317 63.588 1.00 4.56 C +ATOM 2319 CG2 ILE C 60 66.941 47.835 63.966 1.00 4.23 C +ATOM 2320 CD1 ILE C 60 65.655 45.375 62.373 1.00 5.34 C +ATOM 2321 N VAL C 61 65.896 47.603 67.504 1.00 3.65 C +ATOM 2322 CA VAL C 61 65.787 48.677 68.511 1.00 4.56 C +ATOM 2323 C VAL C 61 66.702 48.400 69.698 1.00 4.22 C +ATOM 2324 O VAL C 61 67.411 49.299 70.160 1.00 4.43 C +ATOM 2325 CB VAL C 61 64.309 48.830 68.907 1.00 4.74 C +ATOM 2326 CG1 VAL C 61 64.101 49.722 70.122 1.00 5.69 C +ATOM 2327 CG2 VAL C 61 63.493 49.318 67.725 1.00 5.47 C +ATOM 2328 N GLU C 62 66.723 47.153 70.151 1.00 4.43 C +ATOM 2329 CA GLU C 62 67.592 46.812 71.288 1.00 4.95 C +ATOM 2330 C GLU C 62 69.052 46.887 70.885 1.00 5.30 C +ATOM 2331 O GLU C 62 69.907 47.256 71.723 1.00 5.38 C +ATOM 2332 CB GLU C 62 67.274 45.453 71.893 1.00 5.58 C +ATOM 2333 CG GLU C 62 65.906 45.458 72.586 1.00 7.08 C +ATOM 2334 CD GLU C 62 65.533 44.237 73.352 1.00 8.46 C +ATOM 2335 OE1 GLU C 62 64.697 44.288 74.252 1.00 10.06 C +ATOM 2336 OE2 GLU C 62 66.109 43.157 73.067 1.00 10.50 C +ATOM 2337 N ALA C 63 69.401 46.584 69.650 1.00 5.02 C +ATOM 2338 CA ALA C 63 70.802 46.655 69.190 1.00 4.80 C +ATOM 2339 C ALA C 63 71.281 48.101 69.229 1.00 4.67 C +ATOM 2340 O ALA C 63 72.498 48.351 69.284 1.00 5.23 C +ATOM 2341 CB ALA C 63 70.900 46.025 67.832 1.00 4.87 C +ATOM 2342 N ALA C 64 70.374 49.063 69.195 1.00 4.95 C +ATOM 2343 CA ALA C 64 70.725 50.469 69.277 1.00 5.12 C +ATOM 2344 C ALA C 64 70.686 50.966 70.720 1.00 5.56 C +ATOM 2345 O ALA C 64 70.844 52.193 70.916 1.00 6.36 C +ATOM 2346 CB ALA C 64 69.816 51.305 68.378 1.00 6.01 C +ATOM 2347 N GLY C 65 70.458 50.111 71.682 1.00 5.32 C +ATOM 2348 CA GLY C 65 70.438 50.514 73.092 1.00 5.69 C +ATOM 2349 C GLY C 65 69.073 50.980 73.563 1.00 5.00 C +ATOM 2350 O GLY C 65 69.029 51.580 74.662 1.00 6.60 C +ATOM 2351 N LEU C 66 68.006 50.731 72.813 1.00 4.89 C +ATOM 2352 CA LEU C 66 66.660 51.180 73.201 1.00 5.10 C +ATOM 2353 C LEU C 66 65.820 49.989 73.579 1.00 5.52 C +ATOM 2354 O LEU C 66 66.215 48.832 73.428 1.00 6.12 C +ATOM 2355 CB LEU C 66 66.064 52.009 72.059 1.00 5.47 C +ATOM 2356 CG LEU C 66 66.729 53.366 71.886 1.00 7.05 C +ATOM 2357 CD1 LEU C 66 65.995 54.150 70.805 1.00 7.79 C +ATOM 2358 CD2 LEU C 66 66.813 54.124 73.209 1.00 8.50 C +ATOM 2359 N LYS C 67 64.601 50.268 74.007 1.00 5.84 C +ATOM 2360 CA LYS C 67 63.637 49.228 74.408 1.00 6.22 C +ATOM 2361 C LYS C 67 62.402 49.343 73.532 1.00 5.40 C +ATOM 2362 O LYS C 67 62.130 50.377 72.892 1.00 5.50 C +ATOM 2363 CB LYS C 67 63.194 49.489 75.855 1.00 8.08 C +ATOM 2364 CG LYS C 67 64.348 49.479 76.860 1.00 10.38 C +ATOM 2365 CD LYS C 67 63.839 49.838 78.259 1.00 13.10 C +ATOM 2366 CE LYS C 67 64.978 49.778 79.272 1.00 14.74 C +ATOM 2367 NZ LYS C 67 64.415 49.892 80.648 1.00 16.76 C +ATOM 2368 N VAL C 68 61.611 48.260 73.571 1.00 5.45 C +ATOM 2369 CA VAL C 68 60.318 48.274 72.874 1.00 5.05 C +ATOM 2370 C VAL C 68 59.513 49.501 73.341 1.00 5.56 C +ATOM 2371 O VAL C 68 58.804 50.091 72.512 1.00 5.83 C +ATOM 2372 CB VAL C 68 59.566 46.958 73.124 1.00 5.97 C +ATOM 2373 CG1 VAL C 68 58.097 47.047 72.733 1.00 6.44 C +ATOM 2374 CG2 VAL C 68 60.292 45.781 72.484 1.00 7.15 C +ATOM 2375 N GLY C 69 59.620 49.861 74.607 1.00 5.71 C +ATOM 2376 CA GLY C 69 58.890 51.014 75.148 1.00 6.22 C +ATOM 2377 C GLY C 69 59.314 52.347 74.533 1.00 5.67 C +ATOM 2378 O GLY C 69 58.601 53.347 74.754 1.00 6.75 C +ATOM 2379 N ASP C 70 60.435 52.380 73.824 1.00 4.83 C +ATOM 2380 CA ASP C 70 60.912 53.599 73.148 1.00 5.11 C +ATOM 2381 C ASP C 70 60.358 53.725 71.723 1.00 4.14 C +ATOM 2382 O ASP C 70 60.662 54.733 71.075 1.00 4.50 C +ATOM 2383 CB ASP C 70 62.438 53.647 73.177 1.00 5.29 C +ATOM 2384 CG ASP C 70 63.006 53.641 74.595 1.00 6.10 C +ATOM 2385 OD1 ASP C 70 63.965 52.875 74.820 1.00 6.91 C +ATOM 2386 OD2 ASP C 70 62.444 54.367 75.421 1.00 6.71 C +ATOM 2387 N ILE C 71 59.653 52.727 71.273 1.00 4.31 C +ATOM 2388 CA ILE C 71 59.080 52.803 69.910 1.00 4.32 C +ATOM 2389 C ILE C 71 57.903 53.793 69.964 1.00 3.98 C +ATOM 2390 O ILE C 71 57.004 53.583 70.796 1.00 5.01 C +ATOM 2391 CB ILE C 71 58.633 51.394 69.417 1.00 4.70 C +ATOM 2392 CG1 ILE C 71 59.861 50.449 69.260 1.00 4.36 C +ATOM 2393 CG2 ILE C 71 57.847 51.552 68.095 1.00 4.30 C +ATOM 2394 CD1 ILE C 71 59.494 48.952 69.090 1.00 4.71 C +ATOM 2395 N VAL C 72 57.918 54.776 69.082 1.00 3.47 C +ATOM 2396 CA VAL C 72 56.889 55.822 69.101 1.00 3.99 C +ATOM 2397 C VAL C 72 56.023 55.826 67.872 1.00 3.90 C +ATOM 2398 O VAL C 72 54.930 56.434 67.929 1.00 4.27 C +ATOM 2399 CB VAL C 72 57.550 57.201 69.355 1.00 4.41 C +ATOM 2400 CG1 VAL C 72 58.134 57.263 70.752 1.00 5.07 C +ATOM 2401 CG2 VAL C 72 58.575 57.520 68.283 1.00 5.77 C +ATOM 2402 N LYS C 73 56.414 55.155 66.779 1.00 3.52 C +ATOM 2403 CA LYS C 73 55.571 55.125 65.579 1.00 4.16 C +ATOM 2404 C LYS C 73 55.868 53.841 64.797 1.00 4.31 C +ATOM 2405 O LYS C 73 57.077 53.541 64.631 1.00 4.84 C +ATOM 2406 CB LYS C 73 55.893 56.294 64.647 1.00 5.02 C +ATOM 2407 CG LYS C 73 55.194 56.361 63.285 1.00 5.28 C +ATOM 2408 CD LYS C 73 53.682 56.411 63.319 1.00 5.37 C +ATOM 2409 CE LYS C 73 53.030 56.630 61.976 1.00 6.08 C +ATOM 2410 NZ LYS C 73 53.409 55.657 60.916 1.00 6.35 C +ATOM 2411 N THR C 74 54.825 53.193 64.350 1.00 3.73 C +ATOM 2412 CA THR C 74 55.013 52.052 63.456 1.00 3.85 C +ATOM 2413 C THR C 74 54.103 52.262 62.249 1.00 3.84 C +ATOM 2414 O THR C 74 53.119 53.017 62.260 1.00 3.85 C +ATOM 2415 CB THR C 74 54.626 50.705 64.155 1.00 4.06 C +ATOM 2416 OG1 THR C 74 53.208 50.782 64.451 1.00 4.62 C +ATOM 2417 CG2 THR C 74 55.461 50.387 65.381 1.00 4.69 C +ATOM 2418 N THR C 75 54.460 51.537 61.192 1.00 3.73 C +ATOM 2419 CA THR C 75 53.559 51.389 60.053 1.00 4.09 C +ATOM 2420 C THR C 75 53.439 49.849 59.881 1.00 4.02 C +ATOM 2421 O THR C 75 54.483 49.180 59.787 1.00 4.60 C +ATOM 2422 CB THR C 75 53.947 52.052 58.716 1.00 5.33 C +ATOM 2423 OG1 THR C 75 53.995 53.481 59.053 1.00 6.90 C +ATOM 2424 CG2 THR C 75 52.938 51.782 57.597 1.00 6.26 C +ATOM 2425 N VAL C 76 52.221 49.388 59.859 1.00 3.79 C +ATOM 2426 CA VAL C 76 51.923 47.970 59.705 1.00 4.37 C +ATOM 2427 C VAL C 76 51.232 47.772 58.362 1.00 4.23 C +ATOM 2428 O VAL C 76 50.109 48.259 58.120 1.00 5.09 C +ATOM 2429 CB VAL C 76 51.017 47.518 60.873 1.00 5.09 C +ATOM 2430 CG1 VAL C 76 50.674 46.034 60.718 1.00 6.10 C +ATOM 2431 CG2 VAL C 76 51.642 47.745 62.256 1.00 5.44 C +ATOM 2432 N PHE C 77 51.943 47.079 57.500 1.00 3.73 C +ATOM 2433 CA PHE C 77 51.434 46.755 56.152 1.00 4.03 C +ATOM 2434 C PHE C 77 50.948 45.307 56.221 1.00 3.31 C +ATOM 2435 O PHE C 77 51.785 44.458 56.607 1.00 5.04 C +ATOM 2436 CB PHE C 77 52.535 46.861 55.114 1.00 3.99 C +ATOM 2437 CG PHE C 77 53.226 48.187 55.025 1.00 3.46 C +ATOM 2438 CD1 PHE C 77 54.494 48.378 55.589 1.00 4.75 C +ATOM 2439 CD2 PHE C 77 52.632 49.243 54.338 1.00 4.57 C +ATOM 2440 CE1 PHE C 77 55.186 49.580 55.436 1.00 5.64 C +ATOM 2441 CE2 PHE C 77 53.314 50.457 54.208 1.00 5.55 C +ATOM 2442 CZ PHE C 77 54.585 50.626 54.721 1.00 5.75 C +ATOM 2443 N VAL C 78 49.713 45.018 55.872 1.00 3.70 C +ATOM 2444 CA VAL C 78 49.221 43.641 55.909 1.00 4.71 C +ATOM 2445 C VAL C 78 48.751 43.220 54.528 1.00 4.55 C +ATOM 2446 O VAL C 78 48.352 44.038 53.710 1.00 4.79 C +ATOM 2447 CB VAL C 78 48.100 43.447 56.948 1.00 5.00 C +ATOM 2448 CG1 VAL C 78 48.575 43.745 58.363 1.00 6.84 C +ATOM 2449 CG2 VAL C 78 46.861 44.287 56.648 1.00 5.75 C +ATOM 2450 N LYS C 79 48.753 41.906 54.334 1.00 5.21 C +ATOM 2451 CA LYS C 79 48.222 41.315 53.107 1.00 5.74 C +ATOM 2452 C LYS C 79 46.696 41.199 53.200 1.00 6.17 C +ATOM 2453 O LYS C 79 46.034 41.240 52.134 1.00 6.76 C +ATOM 2454 CB LYS C 79 48.840 39.956 52.842 1.00 6.81 C +ATOM 2455 CG LYS C 79 48.264 39.231 51.634 1.00 8.82 C +ATOM 2456 CD LYS C 79 48.396 39.989 50.323 1.00 10.71 C +ATOM 2457 CE LYS C 79 47.516 39.447 49.209 1.00 11.66 C +ATOM 2458 NZ LYS C 79 46.072 39.707 49.470 1.00 13.37 C +ATOM 2459 N ASP C 80 46.123 41.078 54.376 1.00 6.31 C +ATOM 2460 CA ASP C 80 44.661 40.898 54.487 1.00 6.74 C +ATOM 2461 C ASP C 80 44.088 41.474 55.764 1.00 6.52 C +ATOM 2462 O ASP C 80 44.340 40.896 56.841 1.00 7.52 C +ATOM 2463 CB ASP C 80 44.370 39.382 54.361 1.00 7.41 C +ATOM 2464 CG ASP C 80 42.895 39.052 54.297 1.00 8.15 C +ATOM 2465 OD1 ASP C 80 42.544 37.864 54.054 1.00 10.21 C +ATOM 2466 OD2 ASP C 80 42.034 39.923 54.466 1.00 8.03 C +ATOM 2467 N LEU C 81 43.364 42.574 55.668 1.00 6.91 C +ATOM 2468 CA LEU C 81 42.760 43.190 56.846 1.00 8.19 C +ATOM 2469 C LEU C 81 41.754 42.250 57.501 1.00 8.43 C +ATOM 2470 O LEU C 81 41.386 42.540 58.657 1.00 9.36 C +ATOM 2471 CB LEU C 81 42.188 44.569 56.573 1.00 8.43 C +ATOM 2472 CG LEU C 81 43.238 45.680 56.623 1.00 8.40 C +ATOM 2473 CD1 LEU C 81 42.606 46.935 56.024 1.00 9.27 C +ATOM 2474 CD2 LEU C 81 43.682 45.909 58.050 1.00 9.04 C +ATOM 2475 N ASN C 82 41.326 41.191 56.839 1.00 8.67 C +ATOM 2476 CA ASN C 82 40.394 40.271 57.540 1.00 9.87 C +ATOM 2477 C ASN C 82 41.113 39.557 58.691 1.00 10.44 C +ATOM 2478 O ASN C 82 40.434 39.033 59.592 1.00 11.63 C +ATOM 2479 CB ASN C 82 39.715 39.283 56.608 1.00 10.51 C +ATOM 2480 CG ASN C 82 38.642 39.992 55.772 1.00 10.87 C +ATOM 2481 OD1 ASN C 82 38.003 40.917 56.248 1.00 11.41 C +ATOM 2482 ND2 ASN C 82 38.505 39.530 54.538 1.00 11.83 C +ATOM 2483 N ASP C 83 42.430 39.542 58.688 1.00 10.73 C +ATOM 2484 CA ASP C 83 43.195 38.901 59.787 1.00 11.58 C +ATOM 2485 C ASP C 83 43.606 39.956 60.809 1.00 11.57 C +ATOM 2486 O ASP C 83 44.366 39.650 61.760 1.00 11.86 C +ATOM 2487 CB ASP C 83 44.409 38.174 59.225 1.00 12.86 C +ATOM 2488 CG ASP C 83 44.116 36.833 58.600 1.00 13.31 C +ATOM 2489 OD1 ASP C 83 44.833 36.447 57.683 1.00 14.31 C +ATOM 2490 OD2 ASP C 83 43.183 36.124 59.090 1.00 15.40 C +ATOM 2491 N PHE C 84 43.112 41.173 60.688 1.00 11.64 C +ATOM 2492 CA PHE C 84 43.566 42.211 61.630 1.00 12.27 C +ATOM 2493 C PHE C 84 43.200 42.034 63.088 1.00 11.14 C +ATOM 2494 O PHE C 84 43.995 42.522 63.933 1.00 10.67 C +ATOM 2495 CB PHE C 84 43.296 43.608 61.082 1.00 13.85 C +ATOM 2496 CG PHE C 84 44.457 44.516 61.435 1.00 15.36 C +ATOM 2497 CD1 PHE C 84 44.313 45.490 62.419 1.00 16.41 C +ATOM 2498 CD2 PHE C 84 45.675 44.347 60.771 1.00 15.95 C +ATOM 2499 CE1 PHE C 84 45.396 46.316 62.724 1.00 17.08 C +ATOM 2500 CE2 PHE C 84 46.757 45.182 61.074 1.00 16.89 C +ATOM 2501 CZ PHE C 84 46.612 46.170 62.051 1.00 16.95 C +ATOM 2502 N ALA C 85 42.102 41.392 63.448 1.00 10.77 C +ATOM 2503 CA ALA C 85 41.794 41.220 64.879 1.00 10.60 C +ATOM 2504 C ALA C 85 42.914 40.407 65.535 1.00 9.89 C +ATOM 2505 O ALA C 85 43.346 40.689 66.653 1.00 9.55 C +ATOM 2506 CB ALA C 85 40.425 40.575 65.072 1.00 11.44 C +ATOM 2507 N THR C 86 43.359 39.403 64.784 1.00 10.27 C +ATOM 2508 CA THR C 86 44.420 38.507 65.263 1.00 10.82 C +ATOM 2509 C THR C 86 45.740 39.247 65.418 1.00 9.25 C +ATOM 2510 O THR C 86 46.473 39.123 66.418 1.00 8.54 C +ATOM 2511 CB THR C 86 44.584 37.245 64.317 1.00 12.16 C +ATOM 2512 OG1 THR C 86 43.272 36.607 64.271 1.00 13.99 C +ATOM 2513 CG2 THR C 86 45.690 36.315 64.815 1.00 12.79 C +ATOM 2514 N VAL C 87 46.057 40.011 64.392 1.00 8.71 C +ATOM 2515 CA VAL C 87 47.289 40.822 64.395 1.00 8.40 C +ATOM 2516 C VAL C 87 47.232 41.809 65.555 1.00 7.98 C +ATOM 2517 O VAL C 87 48.236 41.965 66.265 1.00 8.35 C +ATOM 2518 CB VAL C 87 47.470 41.540 63.043 1.00 8.84 C +ATOM 2519 CG1 VAL C 87 48.539 42.621 63.167 1.00 9.19 C +ATOM 2520 CG2 VAL C 87 47.778 40.533 61.950 1.00 9.80 C +ATOM 2521 N ASN C 88 46.109 42.472 65.711 1.00 7.83 C +ATOM 2522 CA ASN C 88 45.933 43.463 66.775 1.00 9.07 C +ATOM 2523 C ASN C 88 46.146 42.851 68.144 1.00 8.46 C +ATOM 2524 O ASN C 88 46.768 43.450 69.026 1.00 7.86 C +ATOM 2525 CB ASN C 88 44.572 44.145 66.740 1.00 10.40 C +ATOM 2526 CG ASN C 88 44.610 45.540 66.169 1.00 11.76 C +ATOM 2527 OD1 ASN C 88 45.662 46.210 66.239 1.00 12.61 C +ATOM 2528 ND2 ASN C 88 43.454 45.921 65.615 1.00 13.35 C +ATOM 2529 N ALA C 89 45.587 41.664 68.340 1.00 7.67 C +ATOM 2530 CA ALA C 89 45.742 40.975 69.637 1.00 7.58 C +ATOM 2531 C ALA C 89 47.212 40.678 69.934 1.00 6.88 C +ATOM 2532 O ALA C 89 47.682 40.867 71.066 1.00 7.11 C +ATOM 2533 CB ALA C 89 44.884 39.713 69.635 1.00 8.02 C +ATOM 2534 N THR C 90 47.898 40.173 68.916 1.00 7.04 C +ATOM 2535 CA THR C 90 49.326 39.858 69.089 1.00 7.07 C +ATOM 2536 C THR C 90 50.133 41.132 69.328 1.00 6.37 C +ATOM 2537 O THR C 90 51.031 41.163 70.183 1.00 6.22 C +ATOM 2538 CB THR C 90 49.853 39.083 67.823 1.00 7.91 C +ATOM 2539 OG1 THR C 90 49.254 37.752 67.848 1.00 10.49 C +ATOM 2540 CG2 THR C 90 51.378 39.020 67.792 1.00 9.07 C +ATOM 2541 N TYR C 91 49.837 42.164 68.549 1.00 6.16 C +ATOM 2542 CA TYR C 91 50.539 43.451 68.653 1.00 5.79 C +ATOM 2543 C TYR C 91 50.341 44.026 70.048 1.00 5.81 C +ATOM 2544 O TYR C 91 51.278 44.488 70.724 1.00 6.66 C +ATOM 2545 CB TYR C 91 50.008 44.344 67.546 1.00 5.88 C +ATOM 2546 CG TYR C 91 50.645 45.698 67.369 1.00 5.59 C +ATOM 2547 CD1 TYR C 91 51.497 45.958 66.295 1.00 5.96 C +ATOM 2548 CD2 TYR C 91 50.394 46.730 68.267 1.00 6.04 C +ATOM 2549 CE1 TYR C 91 52.070 47.210 66.067 1.00 5.47 C +ATOM 2550 CE2 TYR C 91 50.940 47.994 68.093 1.00 6.05 C +ATOM 2551 CZ TYR C 91 51.768 48.210 66.985 1.00 5.90 C +ATOM 2552 OH TYR C 91 52.315 49.467 66.804 1.00 5.93 C +ATOM 2553 N GLU C 92 49.095 44.002 70.502 1.00 6.05 C +ATOM 2554 CA GLU C 92 48.771 44.514 71.841 1.00 6.75 C +ATOM 2555 C GLU C 92 49.548 43.765 72.917 1.00 6.71 C +ATOM 2556 O GLU C 92 50.151 44.350 73.846 1.00 7.08 C +ATOM 2557 CB GLU C 92 47.269 44.437 72.138 1.00 8.59 C +ATOM 2558 CG GLU C 92 46.875 44.989 73.518 1.00 11.80 C +ATOM 2559 CD GLU C 92 45.500 45.544 73.634 1.00 15.28 C +ATOM 2560 OE1 GLU C 92 45.106 46.349 74.486 1.00 18.01 C +ATOM 2561 OE2 GLU C 92 44.704 45.182 72.757 1.00 17.25 C +ATOM 2562 N ALA C 93 49.534 42.434 72.824 1.00 6.56 C +ATOM 2563 CA ALA C 93 50.239 41.573 73.786 1.00 7.09 C +ATOM 2564 C ALA C 93 51.726 41.900 73.817 1.00 6.90 C +ATOM 2565 O ALA C 93 52.313 42.030 74.895 1.00 7.00 C +ATOM 2566 CB ALA C 93 50.036 40.092 73.460 1.00 7.57 C +ATOM 2567 N PHE C 94 52.302 42.042 72.618 1.00 6.67 C +ATOM 2568 CA PHE C 94 53.752 42.332 72.516 1.00 6.61 C +ATOM 2569 C PHE C 94 54.131 43.597 73.288 1.00 5.97 C +ATOM 2570 O PHE C 94 55.105 43.607 74.054 1.00 6.59 C +ATOM 2571 CB PHE C 94 54.101 42.401 71.034 1.00 7.02 C +ATOM 2572 CG PHE C 94 55.555 42.599 70.771 1.00 7.23 C +ATOM 2573 CD1 PHE C 94 56.358 41.464 70.713 1.00 8.12 C +ATOM 2574 CD2 PHE C 94 56.098 43.862 70.605 1.00 8.71 C +ATOM 2575 CE1 PHE C 94 57.717 41.545 70.478 1.00 9.74 C +ATOM 2576 CE2 PHE C 94 57.485 43.979 70.367 1.00 9.96 C +ATOM 2577 CZ PHE C 94 58.243 42.813 70.332 1.00 9.82 C +ATOM 2578 N PHE C 95 53.389 44.675 73.086 1.00 5.98 C +ATOM 2579 CA PHE C 95 53.651 45.951 73.781 1.00 6.00 C +ATOM 2580 C PHE C 95 53.417 45.784 75.281 1.00 6.18 C +ATOM 2581 O PHE C 95 54.226 46.266 76.101 1.00 6.81 C +ATOM 2582 CB PHE C 95 52.962 47.140 73.124 1.00 6.51 C +ATOM 2583 CG PHE C 95 53.714 47.524 71.874 1.00 6.57 C +ATOM 2584 CD1 PHE C 95 53.373 47.028 70.622 1.00 7.43 C +ATOM 2585 CD2 PHE C 95 54.850 48.341 71.976 1.00 6.79 C +ATOM 2586 CE1 PHE C 95 54.111 47.329 69.479 1.00 7.20 C +ATOM 2587 CE2 PHE C 95 55.584 48.669 70.841 1.00 7.08 C +ATOM 2588 CZ PHE C 95 55.238 48.145 69.594 1.00 7.03 C +ATOM 2589 N THR C 96 52.319 45.112 75.622 1.00 6.49 C +ATOM 2590 CA THR C 96 52.019 44.897 77.053 1.00 8.11 C +ATOM 2591 C THR C 96 53.131 44.112 77.732 1.00 7.33 C +ATOM 2592 O THR C 96 53.504 44.429 78.891 1.00 7.70 C +ATOM 2593 CB THR C 96 50.627 44.186 77.231 1.00 9.27 C +ATOM 2594 OG1 THR C 96 49.670 45.085 76.633 1.00 11.25 C +ATOM 2595 CG2 THR C 96 50.311 43.881 78.696 1.00 9.94 C +ATOM 2596 N GLU C 97 53.665 43.106 77.060 1.00 7.31 C +ATOM 2597 CA GLU C 97 54.743 42.266 77.615 1.00 8.29 C +ATOM 2598 C GLU C 97 55.957 43.102 77.942 1.00 7.86 C +ATOM 2599 O GLU C 97 56.745 42.748 78.850 1.00 9.08 C +ATOM 2600 CB GLU C 97 55.168 41.175 76.606 1.00 8.63 C +ATOM 2601 CG GLU C 97 54.068 40.094 76.405 1.00 9.19 C +ATOM 2602 CD GLU C 97 54.140 39.441 75.045 1.00 9.70 C +ATOM 2603 OE1 GLU C 97 55.128 39.587 74.338 1.00 10.55 C +ATOM 2604 OE2 GLU C 97 53.131 38.781 74.714 1.00 11.38 C +ATOM 2605 N HIS C 98 56.159 44.220 77.252 1.00 7.67 C +ATOM 2606 CA HIS C 98 57.305 45.097 77.458 1.00 7.40 C +ATOM 2607 C HIS C 98 56.958 46.321 78.282 1.00 7.94 C +ATOM 2608 O HIS C 98 57.751 47.288 78.280 1.00 8.19 C +ATOM 2609 CB HIS C 98 57.908 45.506 76.069 1.00 7.48 C +ATOM 2610 CG HIS C 98 58.471 44.303 75.377 1.00 7.83 C +ATOM 2611 ND1 HIS C 98 57.790 43.472 74.517 1.00 7.93 C +ATOM 2612 CD2 HIS C 98 59.750 43.815 75.452 1.00 8.60 C +ATOM 2613 CE1 HIS C 98 58.614 42.522 74.117 1.00 8.30 C +ATOM 2614 NE2 HIS C 98 59.801 42.697 74.649 1.00 9.30 C +ATOM 2615 N ASN C 99 55.806 46.291 78.931 1.00 8.01 C +ATOM 2616 CA ASN C 99 55.341 47.423 79.752 1.00 8.93 C +ATOM 2617 C ASN C 99 55.499 48.728 78.974 1.00 7.82 C +ATOM 2618 O ASN C 99 55.928 49.777 79.517 1.00 8.81 C +ATOM 2619 CB ASN C 99 56.144 47.463 81.061 1.00 10.58 C +ATOM 2620 CG ASN C 99 55.546 48.447 82.056 1.00 11.86 C +ATOM 2621 OD1 ASN C 99 54.320 48.653 82.042 1.00 13.08 C +ATOM 2622 ND2 ASN C 99 56.417 49.031 82.877 1.00 13.49 C +ATOM 2623 N ALA C 100 55.106 48.690 77.711 1.00 7.10 C +ATOM 2624 CA ALA C 100 55.270 49.808 76.792 1.00 7.43 C +ATOM 2625 C ALA C 100 54.005 50.563 76.441 1.00 8.24 C +ATOM 2626 O ALA C 100 52.988 49.904 76.191 1.00 9.53 C +ATOM 2627 CB ALA C 100 55.884 49.262 75.483 1.00 7.38 C +ATOM 2628 N THR C 101 54.110 51.880 76.411 1.00 7.83 C +ATOM 2629 CA THR C 101 52.985 52.694 75.927 1.00 8.26 C +ATOM 2630 C THR C 101 52.883 52.331 74.436 1.00 7.07 C +ATOM 2631 O THR C 101 53.936 52.184 73.774 1.00 7.16 C +ATOM 2632 CB THR C 101 53.292 54.229 76.107 1.00 9.39 C +ATOM 2633 OG1 THR C 101 53.397 54.419 77.548 1.00 10.96 C +ATOM 2634 CG2 THR C 101 52.244 55.144 75.476 1.00 10.68 C +ATOM 2635 N PHE C 102 51.687 52.245 73.911 1.00 6.83 C +ATOM 2636 CA PHE C 102 51.556 51.894 72.488 1.00 6.82 C +ATOM 2637 C PHE C 102 52.049 53.025 71.584 1.00 6.10 C +ATOM 2638 O PHE C 102 51.781 54.203 71.847 1.00 6.28 C +ATOM 2639 CB PHE C 102 50.095 51.600 72.146 1.00 7.29 C +ATOM 2640 CG PHE C 102 49.431 50.546 72.979 1.00 7.87 C +ATOM 2641 CD1 PHE C 102 48.256 50.799 73.681 1.00 8.98 C +ATOM 2642 CD2 PHE C 102 49.997 49.264 73.053 1.00 7.94 C +ATOM 2643 CE1 PHE C 102 47.641 49.822 74.451 1.00 10.13 C +ATOM 2644 CE2 PHE C 102 49.401 48.256 73.816 1.00 8.74 C +ATOM 2645 CZ PHE C 102 48.219 48.548 74.523 1.00 9.67 C +ATOM 2646 N PRO C 103 52.750 52.655 70.515 1.00 6.23 C +ATOM 2647 CA PRO C 103 53.188 53.723 69.588 1.00 6.02 C +ATOM 2648 C PRO C 103 52.008 54.299 68.798 1.00 4.53 C +ATOM 2649 O PRO C 103 50.898 53.729 68.719 1.00 4.36 C +ATOM 2650 CB PRO C 103 54.011 52.895 68.557 1.00 7.30 C +ATOM 2651 CG PRO C 103 54.398 51.613 69.236 1.00 7.26 C +ATOM 2652 CD PRO C 103 53.207 51.314 70.155 1.00 6.81 C +ATOM 2653 N ALA C 104 52.268 55.432 68.152 1.00 4.08 C +ATOM 2654 CA ALA C 104 51.379 55.928 67.093 1.00 3.99 C +ATOM 2655 C ALA C 104 51.514 54.866 65.961 1.00 3.68 C +ATOM 2656 O ALA C 104 52.531 54.135 65.862 1.00 4.10 C +ATOM 2657 CB ALA C 104 51.799 57.278 66.624 1.00 4.60 C +ATOM 2658 N ARG C 105 50.488 54.754 65.116 1.00 4.14 C +ATOM 2659 CA ARG C 105 50.483 53.701 64.091 1.00 4.07 C +ATOM 2660 C ARG C 105 49.676 54.037 62.865 1.00 3.75 C +ATOM 2661 O ARG C 105 48.671 54.784 62.974 1.00 3.67 C +ATOM 2662 CB ARG C 105 49.844 52.439 64.776 1.00 5.04 C +ATOM 2663 CG ARG C 105 49.901 51.168 63.932 1.00 6.68 C +ATOM 2664 CD ARG C 105 49.471 49.920 64.669 1.00 7.36 C +ATOM 2665 NE ARG C 105 48.059 49.942 64.950 1.00 9.16 C +ATOM 2666 CZ ARG C 105 47.372 48.872 65.406 1.00 9.60 C +ATOM 2667 NH1 ARG C 105 46.061 48.897 65.570 1.00 10.15 C +ATOM 2668 NH2 ARG C 105 48.029 47.767 65.757 1.00 9.57 C +ATOM 2669 N SER C 106 50.143 53.519 61.735 1.00 3.97 C +ATOM 2670 CA SER C 106 49.356 53.565 60.496 1.00 4.51 C +ATOM 2671 C SER C 106 49.212 52.082 60.072 1.00 4.12 C +ATOM 2672 O SER C 106 50.144 51.289 60.266 1.00 4.73 C +ATOM 2673 CB SER C 106 49.959 54.353 59.374 1.00 5.49 C +ATOM 2674 OG SER C 106 49.957 55.710 59.796 1.00 6.48 C +HETATM 2675 N CSP C 107 48.054 51.758 59.505 1.00 4.52 C +HETATM 2676 CA CSP C 107 47.760 50.378 59.129 1.00 5.72 C +HETATM 2677 CB CSP C 107 46.804 49.700 60.089 0.67 8.42 C +HETATM 2679 SG CSP C 107 47.227 49.776 61.809 0.67 12.80 C +HETATM 2680 P CSP C 107 45.759 51.167 62.354 0.67 14.01 C +HETATM 2681 O1P CSP C 107 45.839 52.330 61.495 0.67 15.06 C +HETATM 2682 O2P CSP C 107 44.369 50.515 62.084 0.67 15.90 C +HETATM 2683 O3P CSP C 107 45.931 51.332 63.867 0.67 14.77 C +HETATM 2684 C CSP C 107 47.046 50.355 57.779 1.00 4.97 C +HETATM 2685 O CSP C 107 45.986 51.024 57.644 1.00 4.62 C +ATOM 2687 N VAL C 108 47.551 49.572 56.859 1.00 4.59 C +ATOM 2688 CA VAL C 108 46.918 49.485 55.529 1.00 4.55 C +ATOM 2689 C VAL C 108 47.075 48.074 55.005 1.00 4.55 C +ATOM 2690 O VAL C 108 48.046 47.373 55.353 1.00 4.69 C +ATOM 2691 CB VAL C 108 47.594 50.491 54.549 1.00 4.96 C +ATOM 2692 CG1 VAL C 108 47.484 51.949 54.998 1.00 5.33 C +ATOM 2693 CG2 VAL C 108 49.027 50.132 54.200 1.00 6.15 C +ATOM 2694 N GLU C 109 46.183 47.680 54.097 1.00 4.88 C +ATOM 2695 CA GLU C 109 46.293 46.413 53.393 1.00 4.49 C +ATOM 2696 C GLU C 109 46.954 46.709 52.038 1.00 4.13 C +ATOM 2697 O GLU C 109 46.405 47.528 51.280 1.00 5.16 C +ATOM 2698 CB GLU C 109 44.938 45.767 53.124 1.00 5.33 C +ATOM 2699 CG GLU C 109 45.089 44.371 52.523 1.00 5.37 C +ATOM 2700 CD GLU C 109 43.746 43.764 52.168 1.00 6.00 C +ATOM 2701 OE1 GLU C 109 43.552 43.382 51.012 1.00 7.16 C +ATOM 2702 OE2 GLU C 109 42.917 43.683 53.105 1.00 5.73 C +ATOM 2703 N VAL C 110 48.087 46.081 51.785 1.00 4.12 C +ATOM 2704 CA VAL C 110 48.778 46.266 50.496 1.00 5.16 C +ATOM 2705 C VAL C 110 48.429 45.106 49.561 1.00 4.97 C +ATOM 2706 O VAL C 110 47.748 44.159 49.994 1.00 5.83 C +ATOM 2707 CB VAL C 110 50.295 46.324 50.727 1.00 5.61 C +ATOM 2708 CG1 VAL C 110 50.678 47.521 51.594 1.00 6.03 C +ATOM 2709 CG2 VAL C 110 50.844 45.036 51.320 1.00 5.94 C +ATOM 2710 N ALA C 111 48.840 45.198 48.309 1.00 5.19 C +ATOM 2711 CA ALA C 111 48.558 44.126 47.352 1.00 5.46 C +ATOM 2712 C ALA C 111 49.429 42.900 47.562 1.00 5.34 C +ATOM 2713 O ALA C 111 48.964 41.750 47.334 1.00 6.46 C +ATOM 2714 CB ALA C 111 48.746 44.653 45.917 1.00 5.06 C +ATOM 2715 N ARG C 112 50.685 43.091 47.959 1.00 5.42 C +ATOM 2716 CA ARG C 112 51.619 41.972 48.127 1.00 5.97 C +ATOM 2717 C ARG C 112 52.817 42.478 48.900 1.00 5.15 C +ATOM 2718 O ARG C 112 53.130 43.687 48.874 1.00 5.33 C +ATOM 2719 CB ARG C 112 52.068 41.486 46.742 1.00 5.86 C +ATOM 2720 CG ARG C 112 52.715 40.113 46.714 1.00 7.01 C +ATOM 2721 CD ARG C 112 53.123 39.755 45.315 1.00 7.87 C +ATOM 2722 NE ARG C 112 53.754 38.438 45.315 1.00 9.03 C +ATOM 2723 CZ ARG C 112 54.495 37.936 44.312 1.00 9.58 C +ATOM 2724 NH1 ARG C 112 55.015 36.706 44.464 1.00 10.53 C +ATOM 2725 NH2 ARG C 112 54.677 38.619 43.181 1.00 10.02 C +ATOM 2726 N LEU C 113 53.475 41.571 49.596 1.00 5.16 C +ATOM 2727 CA LEU C 113 54.662 41.860 50.392 1.00 5.23 C +ATOM 2728 C LEU C 113 55.800 40.958 49.961 1.00 5.70 C +ATOM 2729 O LEU C 113 55.580 39.890 49.350 1.00 6.10 C +ATOM 2730 CB LEU C 113 54.335 41.632 51.873 1.00 5.50 C +ATOM 2731 CG LEU C 113 53.370 42.649 52.474 1.00 5.34 C +ATOM 2732 CD1 LEU C 113 52.921 42.176 53.859 1.00 5.70 C +ATOM 2733 CD2 LEU C 113 54.010 44.032 52.557 1.00 4.99 C +ATOM 2734 N PRO C 114 57.024 41.361 50.268 1.00 6.67 C +ATOM 2735 CA PRO C 114 58.195 40.539 49.934 1.00 7.38 C +ATOM 2736 C PRO C 114 57.984 39.124 50.475 1.00 7.04 C +ATOM 2737 O PRO C 114 57.489 38.861 51.586 1.00 7.08 C +ATOM 2738 CB PRO C 114 59.357 41.239 50.649 1.00 7.55 C +ATOM 2739 CG PRO C 114 58.922 42.679 50.756 1.00 7.89 C +ATOM 2740 CD PRO C 114 57.405 42.617 50.956 1.00 7.17 C +ATOM 2741 N LYS C 115 58.370 38.152 49.650 1.00 7.96 C +ATOM 2742 CA LYS C 115 58.299 36.717 49.953 1.00 9.22 C +ATOM 2743 C LYS C 115 56.876 36.276 50.209 1.00 9.21 C +ATOM 2744 O LYS C 115 56.725 35.203 50.835 1.00 9.21 C +ATOM 2745 CB LYS C 115 59.162 36.379 51.173 1.00 10.55 C +ATOM 2746 CG LYS C 115 60.632 36.740 50.934 1.00 12.98 C +ATOM 2747 CD LYS C 115 61.449 36.179 52.106 1.00 15.15 C +ATOM 2748 CE LYS C 115 62.932 36.188 51.791 1.00 16.92 C +ATOM 2749 NZ LYS C 115 63.588 34.907 52.176 1.00 18.34 C +ATOM 2750 N ASP C 116 55.882 37.020 49.783 1.00 8.41 C +ATOM 2751 CA ASP C 116 54.481 36.653 50.010 1.00 8.14 C +ATOM 2752 C ASP C 116 54.137 36.537 51.491 1.00 7.11 C +ATOM 2753 O ASP C 116 53.192 35.783 51.846 1.00 8.04 C +ATOM 2754 CB ASP C 116 54.075 35.408 49.198 1.00 9.13 C +ATOM 2755 CG ASP C 116 53.984 35.783 47.712 1.00 10.16 C +ATOM 2756 OD1 ASP C 116 54.853 35.295 46.977 1.00 11.23 C +ATOM 2757 OD2 ASP C 116 53.069 36.542 47.365 1.00 10.06 C +ATOM 2758 N VAL C 117 54.811 37.303 52.340 1.00 6.39 C +ATOM 2759 CA VAL C 117 54.470 37.277 53.781 1.00 5.93 C +ATOM 2760 C VAL C 117 53.123 37.988 53.972 1.00 5.45 C +ATOM 2761 O VAL C 117 52.615 38.671 53.077 1.00 5.92 C +ATOM 2762 CB VAL C 117 55.611 37.850 54.629 1.00 5.41 C +ATOM 2763 CG1 VAL C 117 56.910 37.045 54.552 1.00 6.56 C +ATOM 2764 CG2 VAL C 117 55.801 39.339 54.353 1.00 4.77 C +ATOM 2765 N LYS C 118 52.599 37.861 55.159 1.00 5.60 C +ATOM 2766 CA LYS C 118 51.309 38.448 55.494 1.00 5.78 C +ATOM 2767 C LYS C 118 51.421 39.794 56.190 1.00 5.20 C +ATOM 2768 O LYS C 118 50.398 40.449 56.351 1.00 4.89 C +ATOM 2769 CB LYS C 118 50.545 37.481 56.401 1.00 6.48 C +ATOM 2770 CG LYS C 118 50.197 36.142 55.766 1.00 8.03 C +ATOM 2771 CD LYS C 118 49.587 35.093 56.681 1.00 10.35 C +ATOM 2772 CE LYS C 118 49.354 33.779 55.939 1.00 12.02 C +ATOM 2773 NZ LYS C 118 48.768 32.708 56.770 1.00 13.89 C +ATOM 2774 N ILE C 119 52.620 40.201 56.595 1.00 4.72 C +ATOM 2775 CA ILE C 119 52.805 41.442 57.347 1.00 4.45 C +ATOM 2776 C ILE C 119 54.233 41.948 57.236 1.00 4.59 C +ATOM 2777 O ILE C 119 55.158 41.151 57.090 1.00 4.61 C +ATOM 2778 CB ILE C 119 52.378 41.166 58.835 1.00 4.91 C +ATOM 2779 CG1 ILE C 119 52.307 42.496 59.638 1.00 4.94 C +ATOM 2780 CG2 ILE C 119 53.294 40.145 59.557 1.00 5.42 C +ATOM 2781 CD1 ILE C 119 51.552 42.276 60.967 1.00 5.66 C +ATOM 2782 N GLU C 120 54.361 43.266 57.294 1.00 4.02 C +ATOM 2783 CA GLU C 120 55.668 43.938 57.295 1.00 3.81 C +ATOM 2784 C GLU C 120 55.491 45.119 58.249 1.00 3.77 C +ATOM 2785 O GLU C 120 54.507 45.874 58.112 1.00 4.01 C +ATOM 2786 CB GLU C 120 56.069 44.417 55.919 1.00 4.09 C +ATOM 2787 CG GLU C 120 57.420 45.120 55.856 1.00 4.28 C +ATOM 2788 CD GLU C 120 57.808 45.637 54.500 1.00 4.49 C +ATOM 2789 OE1 GLU C 120 58.514 46.641 54.356 1.00 6.49 C +ATOM 2790 OE2 GLU C 120 57.364 44.960 53.518 1.00 5.06 C +ATOM 2791 N ILE C 121 56.418 45.302 59.173 1.00 3.35 C +ATOM 2792 CA ILE C 121 56.304 46.382 60.161 1.00 3.57 C +ATOM 2793 C ILE C 121 57.596 47.173 60.255 1.00 3.38 C +ATOM 2794 O ILE C 121 58.665 46.614 60.488 1.00 3.55 C +ATOM 2795 CB ILE C 121 56.009 45.799 61.584 1.00 4.18 C +ATOM 2796 CG1 ILE C 121 54.777 44.888 61.562 1.00 5.00 C +ATOM 2797 CG2 ILE C 121 55.858 46.938 62.619 1.00 5.16 C +ATOM 2798 CD1 ILE C 121 54.470 44.198 62.912 1.00 5.62 C +ATOM 2799 N GLU C 122 57.456 48.487 60.086 1.00 3.62 C +ATOM 2800 CA GLU C 122 58.594 49.396 60.249 1.00 3.82 C +ATOM 2801 C GLU C 122 58.342 50.201 61.524 1.00 3.47 C +ATOM 2802 O GLU C 122 57.176 50.402 61.924 1.00 3.81 C +ATOM 2803 CB GLU C 122 58.847 50.309 59.073 1.00 6.01 C +ATOM 2804 CG GLU C 122 57.680 51.237 58.774 1.00 7.17 C +ATOM 2805 CD GLU C 122 57.886 52.243 57.696 1.00 8.33 C +ATOM 2806 OE1 GLU C 122 57.155 53.244 57.674 1.00 10.86 C +ATOM 2807 OE2 GLU C 122 58.772 52.050 56.839 1.00 7.19 C +ATOM 2808 N ALA C 123 59.418 50.651 62.151 1.00 4.17 C +ATOM 2809 CA ALA C 123 59.272 51.377 63.409 1.00 4.16 C +ATOM 2810 C ALA C 123 60.271 52.493 63.570 1.00 3.85 C +ATOM 2811 O ALA C 123 61.371 52.469 62.978 1.00 4.05 C +ATOM 2812 CB ALA C 123 59.479 50.429 64.603 1.00 5.43 C +ATOM 2813 N ILE C 124 59.869 53.494 64.325 1.00 3.64 C +ATOM 2814 CA ILE C 124 60.674 54.631 64.724 1.00 4.00 C +ATOM 2815 C ILE C 124 60.714 54.613 66.259 1.00 3.37 C +ATOM 2816 O ILE C 124 59.620 54.497 66.855 1.00 3.97 C +ATOM 2817 CB ILE C 124 60.087 56.000 64.242 1.00 5.41 C +ATOM 2818 CG1 ILE C 124 60.117 56.068 62.705 1.00 6.98 C +ATOM 2819 CG2 ILE C 124 60.874 57.183 64.859 1.00 6.64 C +ATOM 2820 CD1 ILE C 124 59.337 57.288 62.159 1.00 8.60 C +ATOM 2821 N ALA C 125 61.880 54.752 66.842 1.00 3.70 C +ATOM 2822 CA ALA C 125 62.068 54.808 68.301 1.00 4.32 C +ATOM 2823 C ALA C 125 62.930 56.028 68.635 1.00 3.88 C +ATOM 2824 O ALA C 125 63.665 56.523 67.777 1.00 4.96 C +ATOM 2825 CB ALA C 125 62.702 53.501 68.783 1.00 5.11 C +ATOM 2826 N VAL C 126 62.787 56.521 69.872 1.00 4.73 C +ATOM 2827 CA VAL C 126 63.588 57.683 70.287 1.00 5.32 C +ATOM 2828 C VAL C 126 64.218 57.397 71.648 1.00 5.65 C +ATOM 2829 O VAL C 126 63.670 56.687 72.479 1.00 6.01 C +ATOM 2830 CB VAL C 126 62.778 58.997 70.332 1.00 6.36 C +ATOM 2831 CG1 VAL C 126 62.402 59.496 68.943 1.00 7.37 C +ATOM 2832 CG2 VAL C 126 61.592 58.899 71.258 1.00 7.21 C +ATOM 2833 N ARG C 127 65.384 58.004 71.813 1.00 5.90 C +ATOM 2834 CA ARG C 127 66.095 57.867 73.105 1.00 8.86 C +ATOM 2835 C ARG C 127 65.483 58.748 74.200 1.00 10.67 C +ATOM 2836 O ARG C 127 65.521 58.297 75.374 1.00 12.25 C +ATOM 2837 CB ARG C 127 67.564 58.270 73.010 1.00 8.97 C +ATOM 2838 CG ARG C 127 68.304 57.429 71.998 1.00 8.83 C +ATOM 2839 CD ARG C 127 69.812 57.632 72.173 1.00 9.65 C +ATOM 2840 NE ARG C 127 70.494 56.885 71.128 1.00 8.63 C +ATOM 2841 CZ ARG C 127 70.713 55.591 71.181 1.00 8.65 C +ATOM 2842 NH1 ARG C 127 70.467 54.865 72.258 1.00 8.88 C +ATOM 2843 NH2 ARG C 127 71.099 54.968 70.066 1.00 8.68 C +ATOM 2844 N ARG C 128 65.001 59.905 73.836 1.00 12.46 C +ATOM 2845 CA ARG C 128 64.407 60.872 74.766 1.00 14.89 C +ATOM 2846 C ARG C 128 62.918 61.127 74.505 1.00 16.10 C +ATOM 2847 O ARG C 128 62.583 61.112 73.288 1.00 17.58 C +ATOM 2848 CB ARG C 128 65.151 62.222 74.648 1.00 15.67 C +ATOM 2849 OXT ARG C 128 62.395 61.959 75.293 1.00 17.72 C +END diff --git a/examples/thirdparty/prodigy/data/prot-lig.pdb b/examples/thirdparty/prodigy/data/prot-lig.pdb new file mode 100644 index 000000000..ca55a6bf3 --- /dev/null +++ b/examples/thirdparty/prodigy/data/prot-lig.pdb @@ -0,0 +1,2984 @@ +ATOM 1 N VAL A 83 -0.603 65.642 77.183 1.00 23.27 +ATOM 2 CA VAL A 83 -0.883 67.005 76.630 1.00 24.70 +ATOM 3 C VAL A 83 -1.221 68.015 77.732 1.00 24.24 +ATOM 4 O VAL A 83 -1.851 67.665 78.731 1.00 23.78 +ATOM 5 CB VAL A 83 -2.050 66.965 75.617 1.00 25.58 +ATOM 6 CG1 VAL A 83 -2.332 68.365 75.094 1.00 27.08 +ATOM 7 CG2 VAL A 83 -1.694 66.047 74.443 1.00 26.86 +ATOM 8 N LYS A 84 -0.803 69.266 77.541 1.00 23.15 +ATOM 9 CA LYS A 84 -1.047 70.312 78.526 1.00 23.28 +ATOM 10 C LYS A 84 -2.520 70.643 78.728 1.00 22.34 +ATOM 11 O LYS A 84 -3.329 70.575 77.803 1.00 21.41 +ATOM 12 CB LYS A 84 -0.293 71.609 78.170 1.00 25.35 +ATOM 13 CG LYS A 84 1.234 71.495 78.128 1.00 27.98 +ATOM 14 CD LYS A 84 1.687 70.672 76.908 1.00 32.17 +ATOM 15 CE LYS A 84 3.218 70.699 76.721 1.00 35.02 +ATOM 16 NZ LYS A 84 3.669 69.985 75.468 1.00 32.46 +ATOM 17 N LEU A 85 -2.836 70.998 79.971 1.00 21.36 +ATOM 18 CA LEU A 85 -4.174 71.377 80.412 1.00 21.17 +ATOM 19 C LEU A 85 -4.571 72.749 79.852 1.00 21.63 +ATOM 20 O LEU A 85 -4.184 73.775 80.412 1.00 21.68 +ATOM 21 CB LEU A 85 -4.180 71.472 81.940 1.00 19.23 +ATOM 22 CG LEU A 85 -4.907 70.504 82.871 1.00 18.81 +ATOM 23 CD1 LEU A 85 -4.718 69.052 82.431 1.00 17.36 +ATOM 24 CD2 LEU A 85 -4.375 70.727 84.283 1.00 15.43 +ATOM 25 N ALA A 86 -5.324 72.783 78.758 1.00 22.41 +ATOM 26 CA ALA A 86 -5.764 74.068 78.209 1.00 23.07 +ATOM 27 C ALA A 86 -6.644 74.681 79.283 1.00 24.49 +ATOM 28 O ALA A 86 -7.432 73.968 79.940 1.00 26.72 +ATOM 29 CB ALA A 86 -6.582 73.860 76.947 1.00 21.36 +ATOM 30 N GLY A 87 -6.521 75.983 79.490 1.00 23.88 +ATOM 31 CA GLY A 87 -7.356 76.603 80.502 1.00 23.40 +ATOM 32 C GLY A 87 -8.233 77.644 79.853 1.00 23.10 +ATOM 33 O GLY A 87 -8.455 78.701 80.430 1.00 24.54 +ATOM 34 N ASN A 88 -8.734 77.345 78.658 1.00 22.81 +ATOM 35 CA ASN A 88 -9.557 78.291 77.901 1.00 23.45 +ATOM 36 C ASN A 88 -11.049 78.272 78.232 1.00 22.82 +ATOM 37 O ASN A 88 -11.773 79.227 77.934 1.00 22.04 +ATOM 38 CB ASN A 88 -9.371 78.065 76.388 1.00 23.46 +ATOM 39 CG ASN A 88 -9.739 76.650 75.945 1.00 25.27 +ATOM 40 OD1 ASN A 88 -9.875 76.376 74.744 1.00 26.52 +ATOM 41 ND2 ASN A 88 -9.889 75.744 76.907 1.00 24.57 +ATOM 42 N SER A 89 -11.496 77.184 78.850 1.00 22.01 +ATOM 43 CA SER A 89 -12.890 77.003 79.222 1.00 20.48 +ATOM 44 C SER A 89 -13.275 77.864 80.437 1.00 20.16 +ATOM 45 O SER A 89 -12.389 78.389 81.123 1.00 18.19 +ATOM 46 CB SER A 89 -13.118 75.525 79.503 1.00 20.37 +ATOM 47 OG SER A 89 -14.284 75.325 80.256 1.00 24.18 +ATOM 48 N SER A 90 -14.584 78.019 80.683 1.00 18.16 +ATOM 49 CA SER A 90 -15.089 78.818 81.809 1.00 18.71 +ATOM 50 C SER A 90 -15.584 77.952 82.951 1.00 18.51 +ATOM 51 O SER A 90 -15.737 76.750 82.795 1.00 17.89 +ATOM 52 CB SER A 90 -16.253 79.718 81.376 1.00 18.61 +ATOM 53 OG SER A 90 -15.818 80.825 80.605 1.00 21.87 +ATOM 54 N LEU A 91 -15.839 78.573 84.099 1.00 18.93 +ATOM 55 CA LEU A 91 -16.343 77.836 85.246 1.00 20.24 +ATOM 56 C LEU A 91 -17.727 77.294 84.928 1.00 21.74 +ATOM 57 O LEU A 91 -18.540 77.973 84.281 1.00 22.26 +ATOM 58 CB LEU A 91 -16.443 78.728 86.482 1.00 19.23 +ATOM 59 CG LEU A 91 -15.139 79.157 87.148 1.00 20.38 +ATOM 60 CD1 LEU A 91 -15.461 79.926 88.422 1.00 19.78 +ATOM 61 CD2 LEU A 91 -14.286 77.934 87.469 1.00 21.05 +ATOM 62 N CYS A 92 -17.988 76.072 85.388 1.00 22.34 +ATOM 63 CA CYS A 92 -19.276 75.421 85.167 1.00 23.87 +ATOM 64 C CYS A 92 -20.379 76.025 86.033 1.00 22.62 +ATOM 65 O CYS A 92 -20.200 76.259 87.231 1.00 22.68 +ATOM 66 CB CYS A 92 -19.208 73.924 85.499 1.00 24.29 +ATOM 67 SG CYS A 92 -17.950 72.903 84.654 1.00 28.63 +ATOM 68 N PRO A 93 -21.543 76.283 85.432 1.00 22.29 +ATOM 69 CA PRO A 93 -22.665 76.848 86.192 1.00 21.47 +ATOM 70 C PRO A 93 -23.051 75.833 87.276 1.00 20.56 +ATOM 71 O PRO A 93 -23.027 74.633 87.025 1.00 20.96 +ATOM 72 CB PRO A 93 -23.747 77.016 85.124 1.00 21.42 +ATOM 73 CG PRO A 93 -23.387 75.953 84.102 1.00 21.53 +ATOM 74 CD PRO A 93 -21.897 76.087 84.016 1.00 21.41 +ATOM 75 N ILE A 94 -23.410 76.306 88.467 1.00 19.54 +ATOM 76 CA ILE A 94 -23.755 75.413 89.576 1.00 18.82 +ATOM 77 C ILE A 94 -24.907 75.922 90.443 1.00 18.69 +ATOM 78 O ILE A 94 -25.173 77.126 90.499 1.00 19.16 +ATOM 79 CB ILE A 94 -22.543 75.231 90.521 1.00 18.77 +ATOM 80 CG1 ILE A 94 -22.121 76.607 91.064 1.00 18.20 +ATOM 81 CG2 ILE A 94 -21.393 74.553 89.789 1.00 16.48 +ATOM 82 CD1 ILE A 94 -20.922 76.594 92.003 1.00 19.30 +ATOM 83 N ASN A 95 -25.561 75.007 91.151 1.00 17.85 +ATOM 84 CA ASN A 95 -26.661 75.382 92.034 1.00 17.80 +ATOM 85 C ASN A 95 -26.351 75.192 93.516 1.00 16.85 +ATOM 86 O ASN A 95 -26.893 75.894 94.356 1.00 18.58 +ATOM 87 CB ASN A 95 -27.918 74.600 91.657 1.00 18.29 +ATOM 88 CG ASN A 95 -28.406 74.950 90.270 1.00 18.81 +ATOM 89 OD1 ASN A 95 -28.697 76.115 89.985 1.00 20.87 +ATOM 90 ND2 ASN A 95 -28.481 73.958 89.395 1.00 16.41 +ATOM 91 N GLY A 96 -25.468 74.252 93.831 1.00 16.59 +ATOM 92 CA GLY A 96 -25.111 73.989 95.216 1.00 15.59 +ATOM 93 C GLY A 96 -23.809 73.213 95.304 1.00 16.10 +ATOM 94 O GLY A 96 -23.030 73.221 94.355 1.00 15.13 +ATOM 95 N TRP A 97 -23.565 72.533 96.421 1.00 14.71 +ATOM 96 CA TRP A 97 -22.320 71.792 96.572 1.00 13.24 +ATOM 97 C TRP A 97 -22.503 70.374 97.104 1.00 12.70 +ATOM 98 O TRP A 97 -23.161 70.160 98.114 1.00 13.47 +ATOM 99 CB TRP A 97 -21.382 72.573 97.488 1.00 13.31 +ATOM 100 CG TRP A 97 -21.232 73.988 97.069 1.00 12.85 +ATOM 101 CD1 TRP A 97 -22.087 75.026 97.338 1.00 12.77 +ATOM 102 CD2 TRP A 97 -20.202 74.523 96.237 1.00 13.15 +ATOM 103 NE1 TRP A 97 -21.650 76.173 96.721 1.00 12.28 +ATOM 104 CE2 TRP A 97 -20.494 75.891 96.036 1.00 14.86 +ATOM 105 CE3 TRP A 97 -19.058 73.978 95.633 1.00 12.71 +ATOM 106 CZ2 TRP A 97 -19.679 76.723 95.253 1.00 15.46 +ATOM 107 CZ3 TRP A 97 -18.250 74.805 94.856 1.00 13.67 +ATOM 108 CH2 TRP A 97 -18.566 76.162 94.673 1.00 12.77 +ATOM 109 N ALA A 98 -21.910 69.408 96.415 1.00 12.12 +ATOM 110 CA ALA A 98 -22.016 68.013 96.813 1.00 11.95 +ATOM 111 C ALA A 98 -20.751 67.550 97.524 1.00 12.20 +ATOM 112 O ALA A 98 -19.644 67.910 97.136 1.00 12.01 +ATOM 113 CB ALA A 98 -22.275 67.153 95.595 1.00 11.01 +ATOM 114 N VAL A 99 -20.922 66.743 98.564 1.00 12.65 +ATOM 115 CA VAL A 99 -19.781 66.243 99.322 1.00 14.64 +ATOM 116 C VAL A 99 -18.885 65.404 98.439 1.00 13.18 +ATOM 117 O VAL A 99 -19.359 64.549 97.708 1.00 12.64 +ATOM 118 CB VAL A 99 -20.202 65.356 100.485 1.00 15.97 +ATOM 119 CG1 VAL A 99 -19.354 65.693 101.700 1.00 15.79 +ATOM 120 CG2 VAL A 99 -21.686 65.519 100.760 1.00 19.35 +ATOM 121 N TYR A 100 -17.585 65.637 98.533 1.00 13.63 +ATOM 122 CA TYR A 100 -16.639 64.906 97.718 1.00 14.52 +ATOM 123 C TYR A 100 -15.803 63.930 98.553 1.00 15.51 +ATOM 124 O TYR A 100 -15.587 62.787 98.130 1.00 15.83 +ATOM 125 CB TYR A 100 -15.742 65.898 96.968 1.00 13.53 +ATOM 126 CG TYR A 100 -14.919 65.285 95.858 1.00 14.01 +ATOM 127 CD1 TYR A 100 -15.522 64.571 94.824 1.00 13.99 +ATOM 128 CD2 TYR A 100 -13.539 65.423 95.838 1.00 14.32 +ATOM 129 CE1 TYR A 100 -14.767 64.009 93.802 1.00 11.98 +ATOM 130 CE2 TYR A 100 -12.774 64.867 94.817 1.00 13.82 +ATOM 131 CZ TYR A 100 -13.391 64.160 93.805 1.00 14.31 +ATOM 132 OH TYR A 100 -12.618 63.581 92.812 1.00 15.72 +ATOM 133 N SER A 101 -15.357 64.365 99.735 1.00 13.51 +ATOM 134 CA SER A 101 -14.539 63.503 100.590 1.00 12.62 +ATOM 135 C SER A 101 -14.416 63.900 102.068 1.00 13.97 +ATOM 136 O SER A 101 -14.744 65.019 102.476 1.00 14.57 +ATOM 137 CB SER A 101 -13.128 63.407 100.015 1.00 11.77 +ATOM 138 OG SER A 101 -12.451 64.647 100.141 1.00 11.08 +ATOM 139 N LYS A 102 -13.918 62.962 102.861 1.00 13.04 +ATOM 140 CA LYS A 102 -13.698 63.181 104.283 1.00 14.72 +ATOM 141 C LYS A 102 -12.652 62.157 104.725 1.00 14.61 +ATOM 142 O LYS A 102 -12.870 60.955 104.596 1.00 16.89 +ATOM 143 CB LYS A 102 -15.000 62.996 105.070 1.00 13.78 +ATOM 144 CG LYS A 102 -14.871 63.366 106.540 1.00 14.11 +ATOM 145 CD LYS A 102 -16.194 63.259 107.267 1.00 12.86 +ATOM 146 CE LYS A 102 -16.174 64.042 108.565 1.00 12.67 +ATOM 147 NZ LYS A 102 -15.160 63.556 109.541 1.00 11.15 +ATOM 148 N ASP A 103 -11.525 62.621 105.249 1.00 13.72 +ATOM 149 CA ASP A 103 -10.469 61.700 105.643 1.00 15.37 +ATOM 150 C ASP A 103 -10.456 61.196 107.081 1.00 15.71 +ATOM 151 O ASP A 103 -9.741 60.245 107.380 1.00 17.23 +ATOM 152 CB ASP A 103 -9.093 62.287 105.270 1.00 17.90 +ATOM 153 CG ASP A 103 -8.857 63.683 105.838 1.00 20.44 +ATOM 154 OD1 ASP A 103 -8.066 64.443 105.226 1.00 22.27 +ATOM 155 OD2 ASP A 103 -9.440 64.022 106.892 1.00 22.08 +ATOM 156 N ASN A 104 -11.242 61.815 107.961 1.00 14.75 +ATOM 157 CA ASN A 104 -11.313 61.404 109.361 1.00 14.37 +ATOM 158 C ASN A 104 -9.945 61.165 109.986 1.00 15.66 +ATOM 159 O ASN A 104 -9.837 60.437 110.967 1.00 15.47 +ATOM 160 CB ASN A 104 -12.127 60.118 109.486 1.00 13.83 +ATOM 161 CG ASN A 104 -13.608 60.354 109.346 1.00 13.58 +ATOM 162 OD1 ASN A 104 -14.266 59.777 108.485 1.00 15.86 +ATOM 163 ND2 ASN A 104 -14.142 61.204 110.196 1.00 9.58 +ATOM 164 N SER A 105 -8.914 61.798 109.441 1.00 15.35 +ATOM 165 CA SER A 105 -7.551 61.594 109.916 1.00 17.55 +ATOM 166 C SER A 105 -7.300 61.629 111.429 1.00 17.96 +ATOM 167 O SER A 105 -6.501 60.841 111.936 1.00 18.51 +ATOM 168 CB SER A 105 -6.605 62.581 109.233 1.00 17.63 +ATOM 169 OG SER A 105 -6.594 63.816 109.924 1.00 23.37 +ATOM 170 N ILE A 106 -7.963 62.522 112.155 1.00 18.17 +ATOM 171 CA ILE A 106 -7.737 62.603 113.598 1.00 18.14 +ATOM 172 C ILE A 106 -8.428 61.497 114.398 1.00 18.35 +ATOM 173 O ILE A 106 -7.839 60.940 115.335 1.00 18.93 +ATOM 174 CB ILE A 106 -8.127 63.997 114.134 1.00 17.39 +ATOM 175 CG1 ILE A 106 -7.303 65.057 113.382 1.00 16.56 +ATOM 176 CG2 ILE A 106 -7.862 64.079 115.637 1.00 15.87 +ATOM 177 CD1 ILE A 106 -7.657 66.483 113.685 1.00 16.68 +ATOM 178 N ARG A 107 -9.665 61.169 114.031 1.00 17.47 +ATOM 179 CA ARG A 107 -10.393 60.093 114.711 1.00 16.32 +ATOM 180 C ARG A 107 -9.552 58.829 114.574 1.00 15.83 +ATOM 181 O ARG A 107 -9.335 58.098 115.540 1.00 17.65 +ATOM 182 CB ARG A 107 -11.762 59.865 114.056 1.00 15.15 +ATOM 183 CG ARG A 107 -12.830 60.880 114.442 1.00 13.35 +ATOM 184 CD ARG A 107 -14.025 60.798 113.502 1.00 13.94 +ATOM 185 NE ARG A 107 -14.687 59.494 113.511 1.00 13.22 +ATOM 186 CZ ARG A 107 -15.594 59.117 114.409 1.00 13.77 +ATOM 187 NH1 ARG A 107 -16.141 57.912 114.334 1.00 11.16 +ATOM 188 NH2 ARG A 107 -15.959 59.946 115.382 1.00 11.90 +ATOM 189 N ILE A 108 -9.072 58.601 113.358 1.00 14.27 +ATOM 190 CA ILE A 108 -8.256 57.451 113.029 1.00 13.04 +ATOM 191 C ILE A 108 -6.905 57.517 113.730 1.00 13.67 +ATOM 192 O ILE A 108 -6.420 56.519 114.255 1.00 11.98 +ATOM 193 CB ILE A 108 -8.052 57.377 111.502 1.00 13.65 +ATOM 194 CG1 ILE A 108 -9.407 57.168 110.819 1.00 13.81 +ATOM 195 CG2 ILE A 108 -7.096 56.256 111.146 1.00 13.28 +ATOM 196 CD1 ILE A 108 -9.343 57.167 109.300 1.00 13.22 +ATOM 197 N GLY A 109 -6.308 58.706 113.739 1.00 14.21 +ATOM 198 CA GLY A 109 -5.014 58.896 114.371 1.00 15.84 +ATOM 199 C GLY A 109 -4.987 58.579 115.860 1.00 16.48 +ATOM 200 O GLY A 109 -3.915 58.444 116.450 1.00 16.67 +ATOM 201 N SER A 110 -6.162 58.480 116.473 1.00 16.06 +ATOM 202 CA SER A 110 -6.251 58.155 117.884 1.00 16.27 +ATOM 203 C SER A 110 -5.436 56.890 118.108 1.00 15.55 +ATOM 204 O SER A 110 -4.780 56.734 119.137 1.00 14.14 +ATOM 205 CB SER A 110 -7.706 57.909 118.276 1.00 15.85 +ATOM 206 OG SER A 110 -7.838 57.664 119.669 1.00 18.13 +ATOM 207 N LYS A 111 -5.477 55.998 117.121 1.00 15.81 +ATOM 208 CA LYS A 111 -4.741 54.745 117.185 1.00 15.80 +ATOM 209 C LYS A 111 -3.734 54.559 116.047 1.00 16.01 +ATOM 210 O LYS A 111 -2.581 54.200 116.289 1.00 15.66 +ATOM 211 CB LYS A 111 -5.709 53.558 117.187 1.00 15.08 +ATOM 212 CG LYS A 111 -4.982 52.226 117.118 1.00 14.89 +ATOM 213 CD LYS A 111 -5.910 51.032 117.078 1.00 15.11 +ATOM 214 CE LYS A 111 -5.080 49.763 116.936 1.00 15.83 +ATOM 215 NZ LYS A 111 -5.884 48.611 116.462 1.00 18.51 +ATOM 216 N GLY A 112 -4.179 54.801 114.815 1.00 15.96 +ATOM 217 CA GLY A 112 -3.331 54.630 113.648 1.00 15.85 +ATOM 218 C GLY A 112 -2.126 55.547 113.553 1.00 17.80 +ATOM 219 O GLY A 112 -2.011 56.530 114.297 1.00 18.94 +ATOM 220 N ASP A 113 -1.217 55.223 112.638 1.00 16.57 +ATOM 221 CA ASP A 113 -0.023 56.025 112.446 1.00 16.98 +ATOM 222 C ASP A 113 -0.298 57.147 111.432 1.00 17.49 +ATOM 223 O ASP A 113 0.174 57.106 110.293 1.00 18.73 +ATOM 224 CB ASP A 113 1.129 55.141 111.960 1.00 17.33 +ATOM 225 CG ASP A 113 1.374 53.946 112.867 1.00 17.36 +ATOM 226 OD1 ASP A 113 1.422 54.126 114.102 1.00 18.85 +ATOM 227 OD2 ASP A 113 1.527 52.821 112.342 1.00 18.65 +ATOM 228 N VAL A 114 -1.064 58.144 111.868 1.00 16.14 +ATOM 229 CA VAL A 114 -1.443 59.295 111.046 1.00 15.92 +ATOM 230 C VAL A 114 -0.568 60.516 111.355 1.00 16.10 +ATOM 231 O VAL A 114 -0.405 60.875 112.520 1.00 17.40 +ATOM 232 CB VAL A 114 -2.909 59.696 111.320 1.00 15.02 +ATOM 233 CG1 VAL A 114 -3.301 60.874 110.451 1.00 16.47 +ATOM 234 CG2 VAL A 114 -3.822 58.525 111.075 1.00 13.66 +ATOM 235 N PHE A 115 -0.005 61.153 110.330 1.00 14.08 +ATOM 236 CA PHE A 115 0.820 62.338 110.565 1.00 13.37 +ATOM 237 C PHE A 115 -0.011 63.412 111.255 1.00 14.32 +ATOM 238 O PHE A 115 -1.235 63.375 111.227 1.00 13.85 +ATOM 239 CB PHE A 115 1.310 62.960 109.257 1.00 11.30 +ATOM 240 CG PHE A 115 2.461 62.253 108.624 1.00 12.01 +ATOM 241 CD1 PHE A 115 2.318 61.652 107.377 1.00 11.21 +ATOM 242 CD2 PHE A 115 3.709 62.238 109.240 1.00 11.72 +ATOM 243 CE1 PHE A 115 3.401 61.046 106.744 1.00 12.34 +ATOM 244 CE2 PHE A 115 4.804 61.634 108.617 1.00 11.24 +ATOM 245 CZ PHE A 115 4.649 61.038 107.365 1.00 11.63 +ATOM 246 N VAL A 116 0.671 64.355 111.893 1.00 14.38 +ATOM 247 CA VAL A 116 0.008 65.495 112.492 1.00 15.12 +ATOM 248 C VAL A 116 0.246 66.523 111.389 1.00 15.22 +ATOM 249 O VAL A 116 1.335 66.563 110.805 1.00 15.50 +ATOM 250 CB VAL A 116 0.692 65.952 113.794 1.00 16.30 +ATOM 251 CG1 VAL A 116 2.197 65.888 113.635 1.00 20.03 +ATOM 252 CG2 VAL A 116 0.261 67.380 114.129 1.00 13.51 +ATOM 253 N ILE A 117 -0.750 67.344 111.083 1.00 15.31 +ATOM 254 CA ILE A 117 -0.589 68.310 110.000 1.00 14.57 +ATOM 255 C ILE A 117 -1.445 69.564 110.118 1.00 13.57 +ATOM 256 O ILE A 117 -2.301 69.671 110.981 1.00 15.45 +ATOM 257 CB ILE A 117 -0.980 67.679 108.651 1.00 14.88 +ATOM 258 CG1 ILE A 117 -2.486 67.423 108.643 1.00 13.93 +ATOM 259 CG2 ILE A 117 -0.264 66.374 108.442 1.00 14.75 +ATOM 260 CD1 ILE A 117 -3.037 67.067 107.303 1.00 14.94 +ATOM 261 N ARG A 118 -1.201 70.490 109.200 1.00 11.73 +ATOM 262 CA ARG A 118 -1.945 71.736 109.070 1.00 12.45 +ATOM 263 C ARG A 118 -1.812 72.131 107.601 1.00 12.34 +ATOM 264 O ARG A 118 -1.036 71.528 106.856 1.00 12.14 +ATOM 265 CB ARG A 118 -1.358 72.856 109.932 1.00 13.80 +ATOM 266 CG ARG A 118 -1.832 72.927 111.373 1.00 16.79 +ATOM 267 CD ARG A 118 -3.322 73.221 111.525 1.00 18.17 +ATOM 268 NE ARG A 118 -3.815 74.351 110.729 1.00 22.44 +ATOM 269 CZ ARG A 118 -3.545 75.640 110.938 1.00 21.46 +ATOM 270 NH1 ARG A 118 -4.072 76.550 110.127 1.00 20.63 +ATOM 271 NH2 ARG A 118 -2.759 76.027 111.939 1.00 21.26 +ATOM 272 N GLU A 119 -2.567 73.142 107.191 1.00 10.70 +ATOM 273 CA GLU A 119 -2.518 73.632 105.829 1.00 10.49 +ATOM 274 C GLU A 119 -2.672 72.541 104.756 1.00 10.17 +ATOM 275 O GLU A 119 -1.805 72.360 103.907 1.00 9.01 +ATOM 276 CB GLU A 119 -1.207 74.404 105.608 1.00 11.76 +ATOM 277 CG GLU A 119 -0.942 75.589 106.564 1.00 13.65 +ATOM 278 CD GLU A 119 -0.349 75.185 107.924 1.00 15.97 +ATOM 279 OE1 GLU A 119 0.522 74.281 107.973 1.00 16.55 +ATOM 280 OE2 GLU A 119 -0.737 75.788 108.944 1.00 15.78 +ATOM 281 N PRO A 120 -3.782 71.791 104.787 1.00 10.69 +ATOM 282 CA PRO A 120 -3.985 70.747 103.783 1.00 11.04 +ATOM 283 C PRO A 120 -4.705 71.355 102.592 1.00 11.60 +ATOM 284 O PRO A 120 -5.366 72.386 102.719 1.00 13.09 +ATOM 285 CB PRO A 120 -4.882 69.763 104.507 1.00 10.05 +ATOM 286 CG PRO A 120 -5.804 70.688 105.220 1.00 9.70 +ATOM 287 CD PRO A 120 -4.823 71.702 105.826 1.00 11.40 +ATOM 288 N PHE A 121 -4.581 70.729 101.434 1.00 12.64 +ATOM 289 CA PHE A 121 -5.282 71.231 100.259 1.00 14.08 +ATOM 290 C PHE A 121 -5.328 70.173 99.177 1.00 14.60 +ATOM 291 O PHE A 121 -4.473 69.290 99.130 1.00 16.45 +ATOM 292 CB PHE A 121 -4.643 72.531 99.747 1.00 13.80 +ATOM 293 CG PHE A 121 -3.262 72.371 99.158 1.00 14.38 +ATOM 294 CD1 PHE A 121 -3.095 71.990 97.824 1.00 15.23 +ATOM 295 CD2 PHE A 121 -2.130 72.681 99.909 1.00 13.66 +ATOM 296 CE1 PHE A 121 -1.817 71.930 97.243 1.00 13.13 +ATOM 297 CE2 PHE A 121 -0.849 72.624 99.340 1.00 14.59 +ATOM 298 CZ PHE A 121 -0.695 72.248 98.002 1.00 13.42 +ATOM 299 N ILE A 122 -6.344 70.248 98.325 1.00 15.20 +ATOM 300 CA ILE A 122 -6.505 69.282 97.253 1.00 14.78 +ATOM 301 C ILE A 122 -6.142 69.885 95.915 1.00 14.81 +ATOM 302 O ILE A 122 -6.286 71.073 95.717 1.00 16.89 +ATOM 303 CB ILE A 122 -7.960 68.771 97.202 1.00 14.83 +ATOM 304 CG1 ILE A 122 -8.286 68.044 98.513 1.00 13.97 +ATOM 305 CG2 ILE A 122 -8.159 67.866 95.996 1.00 11.24 +ATOM 306 CD1 ILE A 122 -9.748 67.692 98.691 1.00 14.88 +ATOM 307 N SER A 123 -5.649 69.052 95.009 1.00 15.53 +ATOM 308 CA SER A 123 -5.282 69.483 93.668 1.00 14.96 +ATOM 309 C SER A 123 -5.404 68.267 92.763 1.00 14.76 +ATOM 310 O SER A 123 -5.152 67.151 93.205 1.00 14.69 +ATOM 311 CB SER A 123 -3.857 70.022 93.646 1.00 15.30 +ATOM 312 OG SER A 123 -3.563 70.560 92.373 1.00 18.23 +ATOM 313 N CYS A 124 -5.784 68.475 91.505 1.00 15.16 +ATOM 314 CA CYS A 124 -5.977 67.354 90.581 1.00 16.84 +ATOM 315 C CYS A 124 -5.188 67.445 89.274 1.00 16.83 +ATOM 316 O CYS A 124 -4.939 68.531 88.749 1.00 18.06 +ATOM 317 CB CYS A 124 -7.471 67.208 90.232 1.00 16.96 +ATOM 318 SG CYS A 124 -8.655 67.276 91.627 1.00 22.73 +ATOM 319 N SER A 125 -4.805 66.290 88.750 1.00 16.73 +ATOM 320 CA SER A 125 -4.076 66.215 87.488 1.00 17.78 +ATOM 321 C SER A 125 -5.138 65.903 86.446 1.00 19.79 +ATOM 322 O SER A 125 -6.319 66.178 86.658 1.00 20.56 +ATOM 323 CB SER A 125 -3.083 65.060 87.524 1.00 16.89 +ATOM 324 OG SER A 125 -3.779 63.823 87.611 1.00 16.11 +ATOM 325 N HIS A 126 -4.731 65.318 85.326 1.00 21.17 +ATOM 326 CA HIS A 126 -5.708 64.948 84.322 1.00 20.84 +ATOM 327 C HIS A 126 -6.220 63.547 84.638 1.00 21.27 +ATOM 328 O HIS A 126 -7.238 63.117 84.102 1.00 23.14 +ATOM 329 CB HIS A 126 -5.102 65.009 82.916 1.00 21.16 +ATOM 330 CG HIS A 126 -3.923 64.113 82.710 1.00 22.16 +ATOM 331 ND1 HIS A 126 -2.787 64.180 83.492 1.00 22.75 +ATOM 332 CD2 HIS A 126 -3.680 63.163 81.777 1.00 20.67 +ATOM 333 CE1 HIS A 126 -1.898 63.311 83.045 1.00 23.10 +ATOM 334 NE2 HIS A 126 -2.416 62.681 82.003 1.00 21.79 +ATOM 335 N LEU A 127 -5.544 62.847 85.545 1.00 20.68 +ATOM 336 CA LEU A 127 -5.957 61.491 85.897 1.00 20.77 +ATOM 337 C LEU A 127 -6.519 61.292 87.301 1.00 21.72 +ATOM 338 O LEU A 127 -7.474 60.529 87.476 1.00 22.12 +ATOM 339 CB LEU A 127 -4.791 60.528 85.713 1.00 19.06 +ATOM 340 CG LEU A 127 -4.171 60.495 84.317 1.00 20.69 +ATOM 341 CD1 LEU A 127 -2.973 59.561 84.353 1.00 21.10 +ATOM 342 CD2 LEU A 127 -5.192 60.034 83.270 1.00 15.04 +ATOM 343 N GLU A 128 -5.937 61.965 88.296 1.00 21.47 +ATOM 344 CA GLU A 128 -6.380 61.798 89.683 1.00 22.46 +ATOM 345 C GLU A 128 -6.322 63.080 90.521 1.00 21.54 +ATOM 346 O GLU A 128 -5.742 64.076 90.106 1.00 20.95 +ATOM 347 CB GLU A 128 -5.507 60.745 90.379 1.00 23.16 +ATOM 348 CG GLU A 128 -4.214 61.330 90.963 1.00 27.75 +ATOM 349 CD GLU A 128 -3.334 60.310 91.696 1.00 31.85 +ATOM 350 OE1 GLU A 128 -3.862 59.506 92.512 1.00 34.15 +ATOM 351 OE2 GLU A 128 -2.101 60.329 91.468 1.00 32.16 +ATOM 352 N CYS A 129 -6.915 63.028 91.713 1.00 20.84 +ATOM 353 CA CYS A 129 -6.901 64.151 92.649 1.00 21.08 +ATOM 354 C CYS A 129 -6.124 63.744 93.887 1.00 19.35 +ATOM 355 O CYS A 129 -6.320 62.651 94.413 1.00 19.42 +ATOM 356 CB CYS A 129 -8.309 64.547 93.094 1.00 22.09 +ATOM 357 SG CYS A 129 -9.358 65.356 91.843 1.00 28.57 +ATOM 358 N ARG A 130 -5.256 64.628 94.361 1.00 18.34 +ATOM 359 CA ARG A 130 -4.462 64.332 95.539 1.00 16.33 +ATOM 360 C ARG A 130 -4.642 65.369 96.630 1.00 16.35 +ATOM 361 O ARG A 130 -5.147 66.463 96.395 1.00 17.66 +ATOM 362 CB ARG A 130 -2.979 64.262 95.179 1.00 16.02 +ATOM 363 CG ARG A 130 -2.605 63.203 94.173 1.00 13.77 +ATOM 364 CD ARG A 130 -1.089 63.174 93.979 1.00 16.39 +ATOM 365 NE ARG A 130 -0.368 62.730 95.175 1.00 15.64 +ATOM 366 CZ ARG A 130 -0.365 61.478 95.622 1.00 16.75 +ATOM 367 NH1 ARG A 130 0.317 61.164 96.717 1.00 15.36 +ATOM 368 NH2 ARG A 130 -1.040 60.537 94.971 1.00 14.93 +ATOM 369 N THR A 131 -4.213 65.008 97.831 1.00 16.46 +ATOM 370 CA THR A 131 -4.277 65.896 98.980 1.00 15.45 +ATOM 371 C THR A 131 -2.852 66.156 99.436 1.00 14.12 +ATOM 372 O THR A 131 -2.120 65.224 99.759 1.00 14.28 +ATOM 373 CB THR A 131 -5.056 65.264 100.157 1.00 16.85 +ATOM 374 OG1 THR A 131 -6.395 64.974 99.741 1.00 19.90 +ATOM 375 CG2 THR A 131 -5.109 66.216 101.348 1.00 13.61 +ATOM 376 N PHE A 132 -2.452 67.423 99.432 1.00 11.60 +ATOM 377 CA PHE A 132 -1.121 67.796 99.882 1.00 11.10 +ATOM 378 C PHE A 132 -1.286 68.330 101.293 1.00 12.34 +ATOM 379 O PHE A 132 -2.378 68.759 101.675 1.00 13.64 +ATOM 380 CB PHE A 132 -0.523 68.888 98.998 1.00 9.73 +ATOM 381 CG PHE A 132 -0.243 68.445 97.605 1.00 9.05 +ATOM 382 CD1 PHE A 132 -1.281 68.210 96.716 1.00 9.95 +ATOM 383 CD2 PHE A 132 1.063 68.219 97.190 1.00 10.02 +ATOM 384 CE1 PHE A 132 -1.024 67.751 95.433 1.00 11.72 +ATOM 385 CE2 PHE A 132 1.338 67.760 95.910 1.00 9.99 +ATOM 386 CZ PHE A 132 0.295 67.523 95.026 1.00 10.49 +ATOM 387 N PHE A 133 -0.212 68.309 102.068 1.00 11.56 +ATOM 388 CA PHE A 133 -0.275 68.811 103.434 1.00 12.76 +ATOM 389 C PHE A 133 1.109 69.042 103.991 1.00 12.54 +ATOM 390 O PHE A 133 2.084 68.514 103.475 1.00 14.92 +ATOM 391 CB PHE A 133 -1.036 67.818 104.316 1.00 13.40 +ATOM 392 CG PHE A 133 -0.623 66.396 104.107 1.00 12.74 +ATOM 393 CD1 PHE A 133 0.481 65.875 104.768 1.00 11.65 +ATOM 394 CD2 PHE A 133 -1.312 65.591 103.203 1.00 11.19 +ATOM 395 CE1 PHE A 133 0.896 64.574 104.532 1.00 11.99 +ATOM 396 CE2 PHE A 133 -0.906 64.284 102.959 1.00 9.08 +ATOM 397 CZ PHE A 133 0.197 63.775 103.621 1.00 10.66 +ATOM 398 N LEU A 134 1.194 69.853 105.034 1.00 12.98 +ATOM 399 CA LEU A 134 2.471 70.122 105.663 1.00 13.35 +ATOM 400 C LEU A 134 2.458 69.391 106.987 1.00 13.58 +ATOM 401 O LEU A 134 1.697 69.736 107.885 1.00 13.79 +ATOM 402 CB LEU A 134 2.664 71.623 105.878 1.00 14.01 +ATOM 403 CG LEU A 134 2.787 72.479 104.607 1.00 14.92 +ATOM 404 CD1 LEU A 134 2.923 73.941 104.989 1.00 16.45 +ATOM 405 CD2 LEU A 134 3.984 72.040 103.789 1.00 13.82 +ATOM 406 N THR A 135 3.287 68.365 107.099 1.00 13.16 +ATOM 407 CA THR A 135 3.346 67.591 108.325 1.00 14.13 +ATOM 408 C THR A 135 4.173 68.325 109.358 1.00 14.75 +ATOM 409 O THR A 135 4.788 69.348 109.070 1.00 15.08 +ATOM 410 CB THR A 135 4.041 66.242 108.125 1.00 14.70 +ATOM 411 OG1 THR A 135 5.457 66.461 108.073 1.00 13.58 +ATOM 412 CG2 THR A 135 3.575 65.567 106.838 1.00 14.11 +ATOM 413 N GLN A 136 4.189 67.773 110.564 1.00 15.42 +ATOM 414 CA GLN A 136 4.975 68.321 111.658 1.00 14.86 +ATOM 415 C GLN A 136 6.053 67.300 112.025 1.00 14.30 +ATOM 416 O GLN A 136 6.588 67.324 113.129 1.00 15.22 +ATOM 417 CB GLN A 136 4.084 68.610 112.867 1.00 15.30 +ATOM 418 CG GLN A 136 3.244 69.860 112.731 1.00 14.49 +ATOM 419 CD GLN A 136 4.069 71.114 112.869 1.00 14.17 +ATOM 420 OE1 GLN A 136 5.292 71.052 113.021 1.00 13.75 +ATOM 421 NE2 GLN A 136 3.409 72.266 112.817 1.00 13.78 +ATOM 422 N GLY A 137 6.352 66.397 111.093 1.00 12.52 +ATOM 423 CA GLY A 137 7.374 65.389 111.322 1.00 12.32 +ATOM 424 C GLY A 137 7.116 64.478 112.505 1.00 12.26 +ATOM 425 O GLY A 137 8.052 63.999 113.139 1.00 11.95 +ATOM 426 N ALA A 138 5.844 64.241 112.804 1.00 11.64 +ATOM 427 CA ALA A 138 5.469 63.384 113.917 1.00 12.14 +ATOM 428 C ALA A 138 4.072 62.821 113.715 1.00 12.16 +ATOM 429 O ALA A 138 3.336 63.234 112.816 1.00 13.25 +ATOM 430 CB ALA A 138 5.526 64.166 115.224 1.00 13.75 +ATOM 431 N LEU A 139 3.705 61.876 114.566 1.00 11.29 +ATOM 432 CA LEU A 139 2.401 61.252 114.472 1.00 10.17 +ATOM 433 C LEU A 139 1.505 61.676 115.624 1.00 10.47 +ATOM 434 O LEU A 139 1.989 62.142 116.659 1.00 10.95 +ATOM 435 CB LEU A 139 2.563 59.734 114.479 1.00 9.31 +ATOM 436 CG LEU A 139 3.488 59.151 113.411 1.00 9.14 +ATOM 437 CD1 LEU A 139 3.443 57.630 113.492 1.00 6.78 +ATOM 438 CD2 LEU A 139 3.056 59.631 112.027 1.00 9.30 +ATOM 439 N LEU A 140 0.197 61.518 115.438 1.00 9.18 +ATOM 440 CA LEU A 140 -0.757 61.856 116.477 1.00 10.38 +ATOM 441 C LEU A 140 -0.622 60.885 117.660 1.00 12.16 +ATOM 442 O LEU A 140 -0.257 59.728 117.478 1.00 10.42 +ATOM 443 CB LEU A 140 -2.180 61.798 115.920 1.00 8.34 +ATOM 444 CG LEU A 140 -2.610 62.960 115.023 1.00 6.62 +ATOM 445 CD1 LEU A 140 -3.965 62.667 114.402 1.00 5.72 +ATOM 446 CD2 LEU A 140 -2.661 64.229 115.837 1.00 6.32 +ATOM 447 N ASN A 141 -0.906 61.378 118.866 1.00 13.73 +ATOM 448 CA ASN A 141 -0.845 60.589 120.101 1.00 15.45 +ATOM 449 C ASN A 141 0.545 60.065 120.464 1.00 16.09 +ATOM 450 O ASN A 141 0.679 59.061 121.168 1.00 14.85 +ATOM 451 CB ASN A 141 -1.839 59.424 120.050 1.00 16.37 +ATOM 452 CG ASN A 141 -2.930 59.547 121.102 1.00 18.52 +ATOM 453 OD1 ASN A 141 -2.819 60.350 122.028 1.00 19.32 +ATOM 454 ND2 ASN A 141 -3.986 58.740 120.972 1.00 19.01 +ATOM 455 N ASP A 142 1.568 60.766 119.982 1.00 17.35 +ATOM 456 CA ASP A 142 2.967 60.443 120.260 1.00 16.99 +ATOM 457 C ASP A 142 3.572 61.678 120.916 1.00 17.21 +ATOM 458 O ASP A 142 3.108 62.789 120.679 1.00 16.10 +ATOM 459 CB ASP A 142 3.725 60.131 118.968 1.00 16.59 +ATOM 460 CG ASP A 142 5.212 59.950 119.202 1.00 19.46 +ATOM 461 OD1 ASP A 142 5.592 59.008 119.939 1.00 18.72 +ATOM 462 OD2 ASP A 142 5.999 60.757 118.658 1.00 19.65 +ATOM 463 N LYS A 143 4.599 61.501 121.742 1.00 17.87 +ATOM 464 CA LYS A 143 5.200 62.659 122.403 1.00 18.78 +ATOM 465 C LYS A 143 5.726 63.715 121.435 1.00 20.49 +ATOM 466 O LYS A 143 5.691 64.902 121.725 1.00 20.51 +ATOM 467 CB LYS A 143 6.327 62.234 123.346 1.00 18.10 +ATOM 468 CG LYS A 143 7.564 61.691 122.670 1.00 16.91 +ATOM 469 CD LYS A 143 8.563 61.357 123.750 1.00 17.38 +ATOM 470 CE LYS A 143 9.909 61.068 123.142 1.00 17.64 +ATOM 471 NZ LYS A 143 10.956 60.927 124.173 1.00 16.33 +ATOM 472 N HIS A 144 6.212 63.300 120.277 1.00 20.84 +ATOM 473 CA HIS A 144 6.745 64.284 119.342 1.00 21.75 +ATOM 474 C HIS A 144 5.720 65.188 118.708 1.00 22.31 +ATOM 475 O HIS A 144 6.039 66.040 117.883 1.00 21.29 +ATOM 476 CB HIS A 144 7.522 63.582 118.264 1.00 19.38 +ATOM 477 CG HIS A 144 8.702 62.849 118.796 1.00 19.76 +ATOM 478 ND1 HIS A 144 9.850 63.490 119.190 1.00 18.78 +ATOM 479 CD2 HIS A 144 8.887 61.536 119.060 1.00 19.56 +ATOM 480 CE1 HIS A 144 10.702 62.603 119.674 1.00 20.12 +ATOM 481 NE2 HIS A 144 10.140 61.412 119.606 1.00 20.06 +ATOM 482 N SER A 145 4.482 65.005 119.117 1.00 22.78 +ATOM 483 CA SER A 145 3.393 65.781 118.587 1.00 24.35 +ATOM 484 C SER A 145 3.206 66.993 119.468 1.00 25.73 +ATOM 485 O SER A 145 2.278 67.767 119.267 1.00 25.63 +ATOM 486 CB SER A 145 2.149 64.921 118.598 1.00 23.72 +ATOM 487 OG SER A 145 1.000 65.691 118.404 1.00 25.63 +ATOM 488 N ASN A 146 4.111 67.154 120.432 1.00 26.92 +ATOM 489 CA ASN A 146 4.051 68.255 121.377 1.00 29.14 +ATOM 490 C ASN A 146 3.702 69.619 120.769 1.00 31.40 +ATOM 491 O ASN A 146 2.719 69.733 120.046 1.00 35.76 +ATOM 492 CB ASN A 146 5.351 68.344 122.175 1.00 28.58 +ATOM 493 CG ASN A 146 5.105 68.729 123.617 1.00 28.25 +ATOM 494 OD1 ASN A 146 5.981 68.625 124.466 1.00 32.09 +ATOM 495 ND2 ASN A 146 3.898 69.177 123.898 1.00 28.39 +ATOM 496 N GLY A 147 4.479 70.656 121.060 1.00 29.48 +ATOM 497 CA GLY A 147 4.160 71.977 120.535 1.00 29.06 +ATOM 498 C GLY A 147 3.999 72.158 119.032 1.00 28.93 +ATOM 499 O GLY A 147 4.566 73.088 118.459 1.00 27.69 +ATOM 500 N THR A 148 3.214 71.293 118.398 1.00 28.93 +ATOM 501 CA THR A 148 2.984 71.349 116.960 1.00 30.72 +ATOM 502 C THR A 148 2.120 72.546 116.553 1.00 32.32 +ATOM 503 O THR A 148 1.466 72.550 115.510 1.00 32.96 +ATOM 504 CB THR A 148 2.345 70.037 116.469 1.00 29.97 +ATOM 505 OG1 THR A 148 1.276 69.664 117.342 1.00 27.37 +ATOM 506 CG2 THR A 148 3.379 68.930 116.451 1.00 29.61 +ATOM 507 N VAL A 149 2.146 73.576 117.385 1.00 34.07 +ATOM 508 CA VAL A 149 1.387 74.783 117.123 1.00 34.56 +ATOM 509 C VAL A 149 2.317 75.885 116.625 1.00 34.64 +ATOM 510 O VAL A 149 1.852 76.905 116.119 1.00 33.07 +ATOM 511 CB VAL A 149 0.707 75.278 118.403 1.00 35.42 +ATOM 512 CG1 VAL A 149 -0.421 76.236 118.065 1.00 35.39 +ATOM 513 CG2 VAL A 149 0.204 74.098 119.190 1.00 39.00 +ATOM 514 N LYS A 150 3.626 75.657 116.752 1.00 34.96 +ATOM 515 CA LYS A 150 4.654 76.635 116.376 1.00 36.65 +ATOM 516 C LYS A 150 4.674 77.225 114.962 1.00 36.13 +ATOM 517 O LYS A 150 5.222 78.317 114.767 1.00 38.05 +ATOM 518 CB LYS A 150 6.051 76.086 116.704 1.00 37.94 +ATOM 519 CG LYS A 150 6.377 74.755 116.046 1.00 42.58 +ATOM 520 CD LYS A 150 7.768 74.263 116.445 1.00 44.14 +ATOM 521 CE LYS A 150 8.019 72.834 115.965 1.00 43.96 +ATOM 522 NZ LYS A 150 9.401 72.384 116.297 1.00 44.57 +ATOM 523 N ASP A 151 4.092 76.533 113.988 1.00 32.40 +ATOM 524 CA ASP A 151 4.071 77.024 112.605 1.00 29.85 +ATOM 525 C ASP A 151 5.261 76.587 111.778 1.00 27.16 +ATOM 526 O ASP A 151 5.171 75.667 110.972 1.00 27.45 +ATOM 527 CB ASP A 151 4.028 78.552 112.528 1.00 30.57 +ATOM 528 CG ASP A 151 2.629 79.098 112.546 1.00 33.24 +ATOM 529 OD1 ASP A 151 1.773 78.515 111.854 1.00 34.72 +ATOM 530 OD2 ASP A 151 2.383 80.119 113.227 1.00 33.32 +ATOM 531 N ARG A 152 6.379 77.274 111.971 1.00 24.66 +ATOM 532 CA ARG A 152 7.587 76.992 111.207 1.00 23.84 +ATOM 533 C ARG A 152 8.675 76.252 111.995 1.00 23.80 +ATOM 534 O ARG A 152 8.967 76.574 113.151 1.00 25.22 +ATOM 535 CB ARG A 152 8.139 78.305 110.622 1.00 20.17 +ATOM 536 CG ARG A 152 7.115 79.092 109.788 1.00 18.08 +ATOM 537 CD ARG A 152 7.649 80.450 109.285 1.00 16.14 +ATOM 538 NE ARG A 152 7.933 81.440 110.330 1.00 11.59 +ATOM 539 CZ ARG A 152 7.027 81.994 111.136 1.00 11.15 +ATOM 540 NH1 ARG A 152 7.407 82.884 112.037 1.00 9.97 +ATOM 541 NH2 ARG A 152 5.749 81.660 111.056 1.00 9.14 +ATOM 542 N SER A 153 9.259 75.247 111.350 1.00 22.13 +ATOM 543 CA SER A 153 10.313 74.435 111.944 1.00 21.10 +ATOM 544 C SER A 153 11.014 73.629 110.850 1.00 20.20 +ATOM 545 O SER A 153 10.460 73.410 109.771 1.00 18.46 +ATOM 546 CB SER A 153 9.741 73.475 112.992 1.00 20.29 +ATOM 547 OG SER A 153 9.638 72.152 112.487 1.00 22.31 +ATOM 548 N PRO A 154 12.253 73.187 111.119 1.00 19.77 +ATOM 549 CA PRO A 154 13.078 72.400 110.193 1.00 19.09 +ATOM 550 C PRO A 154 12.494 71.030 109.842 1.00 19.97 +ATOM 551 O PRO A 154 12.870 70.440 108.830 1.00 21.37 +ATOM 552 CB PRO A 154 14.400 72.260 110.943 1.00 18.68 +ATOM 553 CG PRO A 154 14.458 73.501 111.773 1.00 20.13 +ATOM 554 CD PRO A 154 13.047 73.625 112.284 1.00 19.33 +ATOM 555 N HIS A 155 11.580 70.538 110.678 1.00 19.09 +ATOM 556 CA HIS A 155 10.965 69.219 110.496 1.00 19.11 +ATOM 557 C HIS A 155 9.682 69.227 109.677 1.00 19.11 +ATOM 558 O HIS A 155 9.126 68.177 109.361 1.00 20.75 +ATOM 559 CB HIS A 155 10.673 68.612 111.866 1.00 18.06 +ATOM 560 CG HIS A 155 11.810 68.741 112.825 1.00 16.37 +ATOM 561 ND1 HIS A 155 11.669 69.298 114.078 1.00 15.19 +ATOM 562 CD2 HIS A 155 13.120 68.427 112.697 1.00 15.11 +ATOM 563 CE1 HIS A 155 12.844 69.326 114.679 1.00 14.48 +ATOM 564 NE2 HIS A 155 13.742 68.804 113.862 1.00 14.98 +ATOM 565 N ARG A 156 9.207 70.415 109.346 1.00 19.43 +ATOM 566 CA ARG A 156 7.985 70.572 108.571 1.00 19.90 +ATOM 567 C ARG A 156 8.232 70.072 107.131 1.00 18.64 +ATOM 568 O ARG A 156 9.210 70.470 106.497 1.00 18.36 +ATOM 569 CB ARG A 156 7.617 72.058 108.564 1.00 22.63 +ATOM 570 CG ARG A 156 6.164 72.385 108.712 1.00 24.33 +ATOM 571 CD ARG A 156 5.682 72.321 110.137 1.00 24.77 +ATOM 572 NE ARG A 156 4.238 72.086 110.131 1.00 28.72 +ATOM 573 CZ ARG A 156 3.330 72.984 109.768 1.00 28.59 +ATOM 574 NH1 ARG A 156 2.039 72.670 109.784 1.00 28.23 +ATOM 575 NH2 ARG A 156 3.710 74.203 109.415 1.00 31.69 +ATOM 576 N THR A 157 7.365 69.196 106.623 1.00 16.36 +ATOM 577 CA THR A 157 7.518 68.683 105.264 1.00 14.26 +ATOM 578 C THR A 157 6.207 68.588 104.490 1.00 14.29 +ATOM 579 O THR A 157 5.146 68.326 105.060 1.00 15.55 +ATOM 580 CB THR A 157 8.172 67.287 105.239 1.00 14.42 +ATOM 581 OG1 THR A 157 7.309 66.338 105.875 1.00 12.21 +ATOM 582 CG2 THR A 157 9.521 67.314 105.937 1.00 14.38 +ATOM 583 N LEU A 158 6.303 68.798 103.182 1.00 12.76 +ATOM 584 CA LEU A 158 5.163 68.748 102.275 1.00 11.52 +ATOM 585 C LEU A 158 5.029 67.345 101.708 1.00 12.41 +ATOM 586 O LEU A 158 5.946 66.839 101.060 1.00 12.17 +ATOM 587 CB LEU A 158 5.369 69.733 101.123 1.00 10.49 +ATOM 588 CG LEU A 158 4.335 69.698 100.002 1.00 9.44 +ATOM 589 CD1 LEU A 158 3.004 70.145 100.554 1.00 9.91 +ATOM 590 CD2 LEU A 158 4.767 70.595 98.855 1.00 9.64 +ATOM 591 N MET A 159 3.883 66.720 101.949 1.00 12.21 +ATOM 592 CA MET A 159 3.642 65.369 101.455 1.00 12.43 +ATOM 593 C MET A 159 2.235 65.263 100.883 1.00 12.54 +ATOM 594 O MET A 159 1.434 66.184 101.043 1.00 11.04 +ATOM 595 CB MET A 159 3.846 64.364 102.588 1.00 12.43 +ATOM 596 CG MET A 159 5.265 64.377 103.135 1.00 14.11 +ATOM 597 SD MET A 159 5.577 63.201 104.483 1.00 15.72 +ATOM 598 CE MET A 159 6.136 61.769 103.587 1.00 15.45 +ATOM 599 N SER A 160 1.934 64.152 100.211 1.00 12.65 +ATOM 600 CA SER A 160 0.607 63.976 99.623 1.00 13.42 +ATOM 601 C SER A 160 0.123 62.534 99.560 1.00 13.89 +ATOM 602 O SER A 160 0.909 61.596 99.607 1.00 16.26 +ATOM 603 CB SER A 160 0.567 64.576 98.208 1.00 14.35 +ATOM 604 OG SER A 160 1.421 63.880 97.308 1.00 13.57 +ATOM 605 N CYS A 161 -1.189 62.374 99.454 1.00 13.60 +ATOM 606 CA CYS A 161 -1.816 61.065 99.352 1.00 14.96 +ATOM 607 C CYS A 161 -3.140 61.245 98.626 1.00 13.94 +ATOM 608 O CYS A 161 -3.607 62.366 98.445 1.00 13.94 +ATOM 609 CB CYS A 161 -2.053 60.463 100.739 1.00 15.56 +ATOM 610 SG CYS A 161 -3.216 61.368 101.776 1.00 17.03 +ATOM 611 N PRO A 162 -3.751 60.149 98.172 1.00 14.12 +ATOM 612 CA PRO A 162 -5.031 60.299 97.468 1.00 15.73 +ATOM 613 C PRO A 162 -6.146 60.873 98.345 1.00 15.28 +ATOM 614 O PRO A 162 -6.218 60.586 99.541 1.00 16.13 +ATOM 615 CB PRO A 162 -5.324 58.876 96.966 1.00 14.12 +ATOM 616 CG PRO A 162 -4.534 58.006 97.875 1.00 14.50 +ATOM 617 CD PRO A 162 -3.256 58.770 98.068 1.00 14.22 +ATOM 618 N VAL A 163 -7.005 61.693 97.744 1.00 15.09 +ATOM 619 CA VAL A 163 -8.106 62.312 98.477 1.00 16.49 +ATOM 620 C VAL A 163 -8.956 61.327 99.265 1.00 16.24 +ATOM 621 O VAL A 163 -9.288 60.246 98.784 1.00 15.60 +ATOM 622 CB VAL A 163 -9.050 63.106 97.542 1.00 15.94 +ATOM 623 CG1 VAL A 163 -8.470 64.469 97.259 1.00 16.20 +ATOM 624 CG2 VAL A 163 -9.257 62.351 96.250 1.00 16.55 +ATOM 625 N GLY A 164 -9.303 61.716 100.485 1.00 15.93 +ATOM 626 CA GLY A 164 -10.128 60.872 101.328 1.00 16.32 +ATOM 627 C GLY A 164 -9.346 59.985 102.275 1.00 16.33 +ATOM 628 O GLY A 164 -9.886 59.512 103.280 1.00 15.96 +ATOM 629 N GLU A 165 -8.074 59.760 101.964 1.00 16.52 +ATOM 630 CA GLU A 165 -7.233 58.916 102.799 1.00 16.59 +ATOM 631 C GLU A 165 -6.550 59.699 103.912 1.00 16.59 +ATOM 632 O GLU A 165 -6.176 60.859 103.738 1.00 17.31 +ATOM 633 CB GLU A 165 -6.179 58.212 101.941 1.00 16.72 +ATOM 634 CG GLU A 165 -6.735 57.090 101.090 1.00 19.33 +ATOM 635 CD GLU A 165 -5.690 56.483 100.184 1.00 20.82 +ATOM 636 OE1 GLU A 165 -4.503 56.483 100.572 1.00 22.85 +ATOM 637 OE2 GLU A 165 -6.051 55.999 99.091 1.00 22.37 +ATOM 638 N ALA A 166 -6.401 59.065 105.065 1.00 16.31 +ATOM 639 CA ALA A 166 -5.740 59.712 106.189 1.00 17.13 +ATOM 640 C ALA A 166 -4.246 59.758 105.871 1.00 17.18 +ATOM 641 O ALA A 166 -3.673 58.768 105.432 1.00 16.83 +ATOM 642 CB ALA A 166 -5.984 58.921 107.470 1.00 14.37 +ATOM 643 N PRO A 167 -3.601 60.916 106.072 1.00 18.06 +ATOM 644 CA PRO A 167 -2.167 61.033 105.791 1.00 18.13 +ATOM 645 C PRO A 167 -1.329 60.210 106.770 1.00 18.51 +ATOM 646 O PRO A 167 -1.409 60.388 107.991 1.00 19.87 +ATOM 647 CB PRO A 167 -1.917 62.533 105.901 1.00 18.19 +ATOM 648 CG PRO A 167 -2.911 62.958 106.930 1.00 18.93 +ATOM 649 CD PRO A 167 -4.155 62.204 106.518 1.00 17.97 +ATOM 650 N SER A 168 -0.531 59.303 106.218 1.00 18.19 +ATOM 651 CA SER A 168 0.314 58.415 107.002 1.00 16.81 +ATOM 652 C SER A 168 1.625 58.155 106.283 1.00 17.05 +ATOM 653 O SER A 168 1.734 58.369 105.083 1.00 17.56 +ATOM 654 CB SER A 168 -0.416 57.093 107.225 1.00 17.20 +ATOM 655 OG SER A 168 0.484 56.000 107.223 1.00 17.34 +ATOM 656 N PRO A 169 2.645 57.687 107.017 1.00 17.76 +ATOM 657 CA PRO A 169 3.961 57.388 106.457 1.00 16.84 +ATOM 658 C PRO A 169 3.908 56.133 105.603 1.00 16.72 +ATOM 659 O PRO A 169 4.902 55.736 104.994 1.00 19.79 +ATOM 660 CB PRO A 169 4.810 57.191 107.698 1.00 18.24 +ATOM 661 CG PRO A 169 3.834 56.543 108.644 1.00 18.22 +ATOM 662 CD PRO A 169 2.630 57.427 108.468 1.00 18.74 +ATOM 663 N TYR A 169A 2.737 55.514 105.558 1.00 14.35 +ATOM 664 CA TYR A 169A 2.552 54.291 104.802 1.00 13.55 +ATOM 665 C TYR A 169A 1.834 54.558 103.493 1.00 13.83 +ATOM 666 O TYR A 169A 1.915 53.766 102.560 1.00 13.20 +ATOM 667 CB TYR A 169A 1.748 53.287 105.636 1.00 11.83 +ATOM 668 CG TYR A 169A 2.282 53.094 107.044 1.00 13.24 +ATOM 669 CD1 TYR A 169A 1.422 52.747 108.091 1.00 13.30 +ATOM 670 CD2 TYR A 169A 3.640 53.285 107.340 1.00 11.45 +ATOM 671 CE1 TYR A 169A 1.892 52.603 109.389 1.00 11.97 +ATOM 672 CE2 TYR A 169A 4.118 53.142 108.634 1.00 10.85 +ATOM 673 CZ TYR A 169A 3.237 52.802 109.654 1.00 12.54 +ATOM 674 OH TYR A 169A 3.691 52.654 110.942 1.00 13.81 +ATOM 675 N ASN A 170 1.129 55.679 103.416 1.00 14.72 +ATOM 676 CA ASN A 170 0.392 55.996 102.204 1.00 14.49 +ATOM 677 C ASN A 170 0.765 57.346 101.605 1.00 14.78 +ATOM 678 O ASN A 170 0.175 57.760 100.609 1.00 15.13 +ATOM 679 CB ASN A 170 -1.114 55.950 102.497 1.00 13.54 +ATOM 680 CG ASN A 170 -1.639 57.229 103.140 1.00 14.47 +ATOM 681 OD1 ASN A 170 -0.953 57.881 103.915 1.00 12.69 +ATOM 682 ND2 ASN A 170 -2.880 57.574 102.825 1.00 16.36 +ATOM 683 N SER A 171 1.758 58.015 102.191 1.00 14.96 +ATOM 684 CA SER A 171 2.155 59.342 101.724 1.00 15.74 +ATOM 685 C SER A 171 3.406 59.482 100.877 1.00 16.29 +ATOM 686 O SER A 171 4.470 58.951 101.201 1.00 16.68 +ATOM 687 CB SER A 171 2.278 60.294 102.913 1.00 15.80 +ATOM 688 OG SER A 171 1.006 60.585 103.455 1.00 13.97 +ATOM 689 N ARG A 172 3.264 60.225 99.789 1.00 15.46 +ATOM 690 CA ARG A 172 4.375 60.488 98.898 1.00 15.65 +ATOM 691 C ARG A 172 5.103 61.709 99.443 1.00 14.88 +ATOM 692 O ARG A 172 4.458 62.670 99.857 1.00 15.76 +ATOM 693 CB ARG A 172 3.861 60.801 97.497 1.00 18.25 +ATOM 694 CG ARG A 172 4.953 61.282 96.557 1.00 24.32 +ATOM 695 CD ARG A 172 4.385 61.876 95.287 1.00 27.91 +ATOM 696 NE ARG A 172 3.642 60.907 94.489 1.00 31.75 +ATOM 697 CZ ARG A 172 2.870 61.250 93.461 1.00 35.48 +ATOM 698 NH1 ARG A 172 2.220 60.314 92.765 1.00 36.39 +ATOM 699 NH2 ARG A 172 2.735 62.539 93.137 1.00 36.25 +ATOM 700 N PHE A 173 6.431 61.680 99.464 1.00 13.97 +ATOM 701 CA PHE A 173 7.177 62.843 99.941 1.00 14.19 +ATOM 702 C PHE A 173 7.262 63.827 98.776 1.00 15.27 +ATOM 703 O PHE A 173 7.448 63.418 97.629 1.00 16.03 +ATOM 704 CB PHE A 173 8.593 62.477 100.378 1.00 11.87 +ATOM 705 CG PHE A 173 9.394 63.658 100.856 1.00 12.10 +ATOM 706 CD1 PHE A 173 9.288 64.107 102.172 1.00 12.60 +ATOM 707 CD2 PHE A 173 10.223 64.355 99.978 1.00 9.95 +ATOM 708 CE1 PHE A 173 10.001 65.241 102.606 1.00 12.52 +ATOM 709 CE2 PHE A 173 10.934 65.484 100.401 1.00 10.21 +ATOM 710 CZ PHE A 173 10.825 65.928 101.713 1.00 11.44 +ATOM 711 N GLU A 174 7.136 65.117 99.068 1.00 14.59 +ATOM 712 CA GLU A 174 7.180 66.126 98.026 1.00 15.86 +ATOM 713 C GLU A 174 8.316 67.129 98.207 1.00 16.68 +ATOM 714 O GLU A 174 9.098 67.364 97.280 1.00 16.53 +ATOM 715 CB GLU A 174 5.843 66.863 97.976 1.00 15.82 +ATOM 716 CG GLU A 174 4.637 65.944 97.799 1.00 19.64 +ATOM 717 CD GLU A 174 4.461 65.452 96.368 1.00 20.00 +ATOM 718 OE1 GLU A 174 3.522 64.663 96.116 1.00 20.92 +ATOM 719 OE2 GLU A 174 5.256 65.862 95.493 1.00 21.74 +ATOM 720 N SER A 175 8.414 67.720 99.395 1.00 15.95 +ATOM 721 CA SER A 175 9.463 68.702 99.638 1.00 16.43 +ATOM 722 C SER A 175 9.549 69.084 101.113 1.00 15.99 +ATOM 723 O SER A 175 8.646 68.774 101.887 1.00 16.16 +ATOM 724 CB SER A 175 9.192 69.953 98.787 1.00 15.73 +ATOM 725 OG SER A 175 10.357 70.750 98.652 1.00 18.70 +ATOM 726 N VAL A 176 10.646 69.733 101.504 1.00 14.56 +ATOM 727 CA VAL A 176 10.814 70.185 102.885 1.00 14.64 +ATOM 728 C VAL A 176 10.205 71.589 102.921 1.00 14.61 +ATOM 729 O VAL A 176 10.632 72.470 102.169 1.00 14.91 +ATOM 730 CB VAL A 176 12.305 70.277 103.290 1.00 14.07 +ATOM 731 CG1 VAL A 176 12.412 70.792 104.707 1.00 12.39 +ATOM 732 CG2 VAL A 176 12.987 68.908 103.162 1.00 12.09 +ATOM 733 N ALA A 177 9.206 71.805 103.774 1.00 13.74 +ATOM 734 CA ALA A 177 8.581 73.117 103.808 1.00 13.52 +ATOM 735 C ALA A 177 7.637 73.420 104.959 1.00 14.47 +ATOM 736 O ALA A 177 6.999 72.525 105.520 1.00 14.07 +ATOM 737 CB ALA A 177 7.841 73.336 102.512 1.00 13.42 +ATOM 738 N TRP A 178 7.552 74.701 105.301 1.00 12.76 +ATOM 739 CA TRP A 178 6.623 75.138 106.323 1.00 14.37 +ATOM 740 C TRP A 178 5.613 76.071 105.651 1.00 14.73 +ATOM 741 O TRP A 178 4.874 76.804 106.303 1.00 15.75 +ATOM 742 CB TRP A 178 7.330 75.819 107.519 1.00 15.18 +ATOM 743 CG TRP A 178 8.476 76.752 107.229 1.00 16.55 +ATOM 744 CD1 TRP A 178 9.800 76.525 107.488 1.00 17.15 +ATOM 745 CD2 TRP A 178 8.401 78.065 106.659 1.00 17.97 +ATOM 746 NE1 TRP A 178 10.553 77.611 107.116 1.00 17.58 +ATOM 747 CE2 TRP A 178 9.722 78.572 106.602 1.00 18.01 +ATOM 748 CE3 TRP A 178 7.349 78.863 106.186 1.00 17.54 +ATOM 749 CZ2 TRP A 178 10.019 79.841 106.091 1.00 16.69 +ATOM 750 CZ3 TRP A 178 7.645 80.125 105.673 1.00 18.26 +ATOM 751 CH2 TRP A 178 8.972 80.599 105.630 1.00 18.07 +ATOM 752 N SER A 179 5.594 76.018 104.323 1.00 15.21 +ATOM 753 CA SER A 179 4.683 76.811 103.502 1.00 14.69 +ATOM 754 C SER A 179 4.796 76.248 102.081 1.00 15.08 +ATOM 755 O SER A 179 5.909 76.085 101.576 1.00 16.07 +ATOM 756 CB SER A 179 5.091 78.287 103.528 1.00 14.20 +ATOM 757 OG SER A 179 4.072 79.110 102.984 1.00 12.31 +ATOM 758 N ALA A 180 3.663 75.957 101.436 1.00 14.15 +ATOM 759 CA ALA A 180 3.697 75.365 100.099 1.00 14.26 +ATOM 760 C ALA A 180 2.550 75.663 99.142 1.00 14.78 +ATOM 761 O ALA A 180 1.605 76.387 99.452 1.00 15.64 +ATOM 762 CB ALA A 180 3.833 73.860 100.224 1.00 14.35 +ATOM 763 N SER A 181 2.665 75.069 97.961 1.00 14.71 +ATOM 764 CA SER A 181 1.672 75.187 96.905 1.00 16.39 +ATOM 765 C SER A 181 2.019 74.110 95.893 1.00 17.26 +ATOM 766 O SER A 181 3.134 73.581 95.923 1.00 17.76 +ATOM 767 CB SER A 181 1.739 76.566 96.241 1.00 16.73 +ATOM 768 OG SER A 181 0.825 76.649 95.164 1.00 15.59 +ATOM 769 N ALA A 182 1.071 73.775 95.013 1.00 17.66 +ATOM 770 CA ALA A 182 1.300 72.762 93.979 1.00 16.85 +ATOM 771 C ALA A 182 0.155 72.692 92.979 1.00 16.50 +ATOM 772 O ALA A 182 -0.989 72.993 93.313 1.00 17.67 +ATOM 773 CB ALA A 182 1.506 71.398 94.618 1.00 16.60 +ATOM 774 N CYS A 183 0.478 72.308 91.747 1.00 16.55 +ATOM 775 CA CYS A 183 -0.517 72.163 90.681 1.00 17.23 +ATOM 776 C CYS A 183 0.039 71.295 89.557 1.00 16.74 +ATOM 777 O CYS A 183 1.255 71.215 89.377 1.00 16.65 +ATOM 778 CB CYS A 183 -0.942 73.534 90.133 1.00 18.35 +ATOM 779 SG CYS A 183 0.437 74.657 89.757 1.00 19.85 +ATOM 780 N HIS A 184 -0.856 70.630 88.827 1.00 16.65 +ATOM 781 CA HIS A 184 -0.480 69.751 87.714 1.00 16.62 +ATOM 782 C HIS A 184 -0.830 70.447 86.398 1.00 17.43 +ATOM 783 O HIS A 184 -1.959 70.901 86.224 1.00 17.68 +ATOM 784 CB HIS A 184 -1.235 68.421 87.825 1.00 15.68 +ATOM 785 CG HIS A 184 -0.647 67.316 86.995 1.00 15.85 +ATOM 786 ND1 HIS A 184 0.017 66.237 87.549 1.00 12.45 +ATOM 787 CD2 HIS A 184 -0.603 67.129 85.654 1.00 13.21 +ATOM 788 CE1 HIS A 184 0.441 65.442 86.587 1.00 12.37 +ATOM 789 NE2 HIS A 184 0.080 65.960 85.425 1.00 11.38 +ATOM 790 N ASP A 185 0.127 70.520 85.473 1.00 18.02 +ATOM 791 CA ASP A 185 -0.088 71.207 84.192 1.00 18.48 +ATOM 792 C ASP A 185 -0.532 70.324 83.040 1.00 18.85 +ATOM 793 O ASP A 185 -0.493 70.745 81.883 1.00 19.77 +ATOM 794 CB ASP A 185 1.188 71.927 83.758 1.00 18.12 +ATOM 795 CG ASP A 185 2.287 70.961 83.320 1.00 19.36 +ATOM 796 OD1 ASP A 185 2.087 69.727 83.403 1.00 22.51 +ATOM 797 OD2 ASP A 185 3.358 71.433 82.891 1.00 19.12 +ATOM 798 N GLY A 186 -0.946 69.104 83.345 1.00 19.50 +ATOM 799 CA GLY A 186 -1.363 68.196 82.292 1.00 19.99 +ATOM 800 C GLY A 186 -0.292 67.150 82.038 1.00 20.02 +ATOM 801 O GLY A 186 -0.596 66.033 81.623 1.00 19.56 +ATOM 802 N THR A 187 0.964 67.512 82.301 1.00 19.63 +ATOM 803 CA THR A 187 2.074 66.596 82.097 1.00 19.77 +ATOM 804 C THR A 187 2.663 66.112 83.430 1.00 20.52 +ATOM 805 O THR A 187 2.736 64.905 83.681 1.00 20.76 +ATOM 806 CB THR A 187 3.197 67.259 81.237 1.00 20.36 +ATOM 807 OG1 THR A 187 2.702 67.523 79.919 1.00 17.91 +ATOM 808 CG2 THR A 187 4.413 66.343 81.126 1.00 18.53 +ATOM 809 N SER A 188 3.090 67.041 84.282 1.00 19.43 +ATOM 810 CA SER A 188 3.674 66.654 85.561 1.00 18.54 +ATOM 811 C SER A 188 3.284 67.596 86.684 1.00 18.42 +ATOM 812 O SER A 188 2.775 68.705 86.452 1.00 17.95 +ATOM 813 CB SER A 188 5.200 66.605 85.460 1.00 20.57 +ATOM 814 OG SER A 188 5.733 67.884 85.167 1.00 20.00 +ATOM 815 N TRP A 189 3.542 67.140 87.906 1.00 16.60 +ATOM 816 CA TRP A 189 3.257 67.914 89.100 1.00 14.42 +ATOM 817 C TRP A 189 4.303 68.974 89.347 1.00 14.89 +ATOM 818 O TRP A 189 5.495 68.756 89.149 1.00 16.37 +ATOM 819 CB TRP A 189 3.205 67.024 90.345 1.00 11.76 +ATOM 820 CG TRP A 189 1.915 66.313 90.525 1.00 10.33 +ATOM 821 CD1 TRP A 189 1.665 65.014 90.248 1.00 7.66 +ATOM 822 CD2 TRP A 189 0.672 66.882 90.966 1.00 8.70 +ATOM 823 NE1 TRP A 189 0.345 64.726 90.481 1.00 12.11 +ATOM 824 CE2 TRP A 189 -0.290 65.856 90.924 1.00 8.28 +ATOM 825 CE3 TRP A 189 0.282 68.160 91.394 1.00 9.83 +ATOM 826 CZ2 TRP A 189 -1.628 66.062 91.285 1.00 8.52 +ATOM 827 CZ3 TRP A 189 -1.055 68.370 91.757 1.00 8.96 +ATOM 828 CH2 TRP A 189 -1.989 67.322 91.699 1.00 8.47 +ATOM 829 N LEU A 190 3.838 70.128 89.788 1.00 14.56 +ATOM 830 CA LEU A 190 4.714 71.224 90.136 1.00 13.95 +ATOM 831 C LEU A 190 4.485 71.440 91.626 1.00 13.37 +ATOM 832 O LEU A 190 3.357 71.685 92.048 1.00 13.74 +ATOM 833 CB LEU A 190 4.334 72.496 89.363 1.00 13.34 +ATOM 834 CG LEU A 190 4.723 73.824 90.028 1.00 14.53 +ATOM 835 CD1 LEU A 190 6.235 73.907 90.211 1.00 14.05 +ATOM 836 CD2 LEU A 190 4.230 74.980 89.185 1.00 14.25 +ATOM 837 N THR A 191 5.533 71.310 92.427 1.00 13.26 +ATOM 838 CA THR A 191 5.384 71.553 93.856 1.00 14.83 +ATOM 839 C THR A 191 6.250 72.741 94.247 1.00 14.74 +ATOM 840 O THR A 191 7.291 72.998 93.636 1.00 15.06 +ATOM 841 CB THR A 191 5.788 70.335 94.736 1.00 13.66 +ATOM 842 OG1 THR A 191 7.133 69.948 94.446 1.00 13.69 +ATOM 843 CG2 THR A 191 4.842 69.172 94.509 1.00 11.41 +ATOM 844 N ILE A 192 5.801 73.461 95.268 1.00 14.08 +ATOM 845 CA ILE A 192 6.501 74.629 95.772 1.00 13.48 +ATOM 846 C ILE A 192 6.616 74.520 97.293 1.00 14.02 +ATOM 847 O ILE A 192 5.610 74.515 98.008 1.00 13.60 +ATOM 848 CB ILE A 192 5.745 75.921 95.381 1.00 12.78 +ATOM 849 CG1 ILE A 192 5.768 76.094 93.859 1.00 12.04 +ATOM 850 CG2 ILE A 192 6.383 77.120 96.033 1.00 11.88 +ATOM 851 CD1 ILE A 192 4.840 77.168 93.345 1.00 9.66 +ATOM 852 N GLY A 193 7.855 74.418 97.772 1.00 14.28 +ATOM 853 CA GLY A 193 8.104 74.300 99.198 1.00 13.24 +ATOM 854 C GLY A 193 9.115 75.285 99.755 1.00 13.46 +ATOM 855 O GLY A 193 10.286 75.310 99.361 1.00 14.00 +ATOM 856 N ILE A 194 8.648 76.102 100.691 1.00 13.81 +ATOM 857 CA ILE A 194 9.479 77.111 101.332 1.00 13.65 +ATOM 858 C ILE A 194 10.003 76.612 102.678 1.00 14.57 +ATOM 859 O ILE A 194 9.253 76.050 103.482 1.00 14.81 +ATOM 860 CB ILE A 194 8.675 78.404 101.586 1.00 12.89 +ATOM 861 CG1 ILE A 194 8.058 78.899 100.280 1.00 11.80 +ATOM 862 CG2 ILE A 194 9.569 79.460 102.221 1.00 8.82 +ATOM 863 CD1 ILE A 194 7.137 80.090 100.455 1.00 11.28 +ATOM 864 N SER A 195 11.292 76.830 102.919 1.00 14.67 +ATOM 865 CA SER A 195 11.916 76.428 104.172 1.00 13.97 +ATOM 866 C SER A 195 13.059 77.403 104.489 1.00 13.92 +ATOM 867 O SER A 195 13.301 78.344 103.734 1.00 14.53 +ATOM 868 CB SER A 195 12.430 74.985 104.058 1.00 13.25 +ATOM 869 OG SER A 195 12.734 74.444 105.333 1.00 15.17 +ATOM 870 N GLY A 196 13.757 77.183 105.599 1.00 13.69 +ATOM 871 CA GLY A 196 14.849 78.066 105.965 1.00 13.88 +ATOM 872 C GLY A 196 14.416 79.048 107.034 1.00 14.64 +ATOM 873 O GLY A 196 13.262 79.015 107.452 1.00 16.74 +ATOM 874 N PRO A 197 15.304 79.947 107.486 1.00 14.34 +ATOM 875 CA PRO A 197 14.966 80.931 108.524 1.00 13.98 +ATOM 876 C PRO A 197 14.046 82.043 108.023 1.00 14.68 +ATOM 877 O PRO A 197 13.959 82.304 106.819 1.00 13.28 +ATOM 878 CB PRO A 197 16.332 81.454 108.948 1.00 13.21 +ATOM 879 CG PRO A 197 17.075 81.466 107.640 1.00 14.14 +ATOM 880 CD PRO A 197 16.691 80.129 107.019 1.00 14.10 +ATOM 881 N ASP A 198 13.370 82.707 108.951 1.00 14.35 +ATOM 882 CA ASP A 198 12.458 83.786 108.588 1.00 14.81 +ATOM 883 C ASP A 198 13.113 84.920 107.801 1.00 14.85 +ATOM 884 O ASP A 198 12.466 85.554 106.970 1.00 14.91 +ATOM 885 CB ASP A 198 11.792 84.346 109.841 1.00 14.02 +ATOM 886 CG ASP A 198 10.942 83.311 110.552 1.00 15.60 +ATOM 887 OD1 ASP A 198 10.681 82.252 109.945 1.00 14.62 +ATOM 888 OD2 ASP A 198 10.533 83.554 111.709 1.00 15.98 +ATOM 889 N ASN A 199 14.394 85.172 108.047 1.00 15.38 +ATOM 890 CA ASN A 199 15.086 86.242 107.347 1.00 15.07 +ATOM 891 C ASN A 199 15.774 85.858 106.042 1.00 15.78 +ATOM 892 O ASN A 199 16.567 86.643 105.526 1.00 17.47 +ATOM 893 CB ASN A 199 16.116 86.897 108.263 1.00 16.04 +ATOM 894 CG ASN A 199 17.181 85.929 108.717 1.00 16.30 +ATOM 895 OD1 ASN A 199 17.629 85.079 107.953 1.00 15.08 +ATOM 896 ND2 ASN A 199 17.600 86.061 109.962 1.00 16.62 +ATOM 897 N GLY A 200 15.496 84.670 105.508 1.00 15.75 +ATOM 898 CA GLY A 200 16.118 84.282 104.247 1.00 14.71 +ATOM 899 C GLY A 200 15.541 83.019 103.630 1.00 16.41 +ATOM 900 O GLY A 200 16.248 82.282 102.943 1.00 15.71 +ATOM 901 N ALA A 201 14.253 82.773 103.858 1.00 14.50 +ATOM 902 CA ALA A 201 13.607 81.576 103.346 1.00 14.60 +ATOM 903 C ALA A 201 13.690 81.441 101.826 1.00 15.35 +ATOM 904 O ALA A 201 13.641 82.428 101.097 1.00 14.62 +ATOM 905 CB ALA A 201 12.150 81.539 103.800 1.00 14.23 +ATOM 906 N VAL A 202 13.822 80.204 101.359 1.00 13.56 +ATOM 907 CA VAL A 202 13.904 79.937 99.937 1.00 16.11 +ATOM 908 C VAL A 202 12.898 78.880 99.510 1.00 16.30 +ATOM 909 O VAL A 202 12.806 77.807 100.114 1.00 16.24 +ATOM 910 CB VAL A 202 15.337 79.484 99.505 1.00 16.86 +ATOM 911 CG1 VAL A 202 15.984 78.673 100.597 1.00 20.69 +ATOM 912 CG2 VAL A 202 15.258 78.626 98.247 1.00 16.22 +ATOM 913 N ALA A 203 12.137 79.207 98.468 1.00 15.86 +ATOM 914 CA ALA A 203 11.141 78.297 97.926 1.00 16.91 +ATOM 915 C ALA A 203 11.836 77.430 96.897 1.00 16.41 +ATOM 916 O ALA A 203 12.491 77.943 95.997 1.00 18.30 +ATOM 917 CB ALA A 203 10.006 79.073 97.279 1.00 14.00 +ATOM 918 N VAL A 204 11.708 76.118 97.047 1.00 16.44 +ATOM 919 CA VAL A 204 12.330 75.182 96.122 1.00 16.22 +ATOM 920 C VAL A 204 11.241 74.630 95.219 1.00 16.64 +ATOM 921 O VAL A 204 10.335 73.958 95.693 1.00 18.11 +ATOM 922 CB VAL A 204 13.000 74.004 96.884 1.00 16.21 +ATOM 923 CG1 VAL A 204 13.651 73.044 95.893 1.00 16.33 +ATOM 924 CG2 VAL A 204 14.038 74.531 97.866 1.00 11.84 +ATOM 925 N LEU A 205 11.322 74.919 93.924 1.00 16.63 +ATOM 926 CA LEU A 205 10.320 74.437 92.980 1.00 16.67 +ATOM 927 C LEU A 205 10.752 73.115 92.388 1.00 17.74 +ATOM 928 O LEU A 205 11.932 72.923 92.077 1.00 18.84 +ATOM 929 CB LEU A 205 10.117 75.416 91.823 1.00 16.03 +ATOM 930 CG LEU A 205 9.851 76.900 92.058 1.00 17.28 +ATOM 931 CD1 LEU A 205 9.144 77.442 90.825 1.00 16.88 +ATOM 932 CD2 LEU A 205 9.008 77.124 93.275 1.00 16.63 +ATOM 933 N LYS A 206 9.798 72.203 92.224 1.00 16.47 +ATOM 934 CA LYS A 206 10.101 70.910 91.640 1.00 16.33 +ATOM 935 C LYS A 206 9.100 70.526 90.571 1.00 16.01 +ATOM 936 O LYS A 206 7.894 70.752 90.711 1.00 14.46 +ATOM 937 CB LYS A 206 10.107 69.811 92.698 1.00 17.02 +ATOM 938 CG LYS A 206 11.212 69.898 93.731 1.00 18.08 +ATOM 939 CD LYS A 206 11.089 68.734 94.695 1.00 17.22 +ATOM 940 CE LYS A 206 12.080 68.823 95.831 1.00 17.22 +ATOM 941 NZ LYS A 206 11.876 67.675 96.752 1.00 18.88 +ATOM 942 N TYR A 207 9.621 69.953 89.493 1.00 15.13 +ATOM 943 CA TYR A 207 8.790 69.475 88.411 1.00 15.30 +ATOM 944 C TYR A 207 9.071 67.973 88.417 1.00 17.12 +ATOM 945 O TYR A 207 10.227 67.548 88.380 1.00 18.83 +ATOM 946 CB TYR A 207 9.203 70.131 87.091 1.00 13.70 +ATOM 947 CG TYR A 207 8.162 70.025 85.997 1.00 12.91 +ATOM 948 CD1 TYR A 207 8.376 69.216 84.878 1.00 11.58 +ATOM 949 CD2 TYR A 207 6.955 70.730 86.081 1.00 10.05 +ATOM 950 CE1 TYR A 207 7.419 69.109 83.871 1.00 8.67 +ATOM 951 CE2 TYR A 207 5.994 70.627 85.079 1.00 8.71 +ATOM 952 CZ TYR A 207 6.234 69.813 83.980 1.00 9.88 +ATOM 953 OH TYR A 207 5.287 69.684 82.993 1.00 13.41 +ATOM 954 N ASN A 208 8.012 67.177 88.501 1.00 17.55 +ATOM 955 CA ASN A 208 8.119 65.721 88.556 1.00 17.60 +ATOM 956 C ASN A 208 9.107 65.258 89.625 1.00 16.90 +ATOM 957 O ASN A 208 9.823 64.276 89.437 1.00 16.39 +ATOM 958 CB ASN A 208 8.521 65.132 87.201 1.00 18.87 +ATOM 959 CG ASN A 208 7.825 63.797 86.920 1.00 21.68 +ATOM 960 OD1 ASN A 208 7.767 62.911 87.779 1.00 19.65 +ATOM 961 ND2 ASN A 208 7.288 63.653 85.710 1.00 25.42 +ATOM 962 N GLY A 209 9.150 65.975 90.744 1.00 15.89 +ATOM 963 CA GLY A 209 10.039 65.596 91.830 1.00 16.40 +ATOM 964 C GLY A 209 11.485 66.053 91.757 1.00 16.90 +ATOM 965 O GLY A 209 12.258 65.781 92.672 1.00 16.45 +ATOM 966 N ILE A 210 11.865 66.731 90.677 1.00 16.86 +ATOM 967 CA ILE A 210 13.237 67.214 90.537 1.00 17.52 +ATOM 968 C ILE A 210 13.270 68.736 90.512 1.00 15.69 +ATOM 969 O ILE A 210 12.503 69.377 89.789 1.00 15.92 +ATOM 970 CB ILE A 210 13.921 66.647 89.259 1.00 18.33 +ATOM 971 CG1 ILE A 210 13.080 66.966 88.028 1.00 23.38 +ATOM 972 CG2 ILE A 210 14.068 65.136 89.380 1.00 19.17 +ATOM 973 CD1 ILE A 210 13.357 66.058 86.819 1.00 25.05 +ATOM 974 N ILE A 211 14.158 69.298 91.325 1.00 13.73 +ATOM 975 CA ILE A 211 14.318 70.742 91.439 1.00 14.42 +ATOM 976 C ILE A 211 14.547 71.441 90.090 1.00 14.33 +ATOM 977 O ILE A 211 15.494 71.116 89.375 1.00 12.95 +ATOM 978 CB ILE A 211 15.484 71.088 92.399 1.00 13.13 +ATOM 979 CG1 ILE A 211 15.191 70.522 93.796 1.00 12.89 +ATOM 980 CG2 ILE A 211 15.671 72.588 92.459 1.00 12.43 +ATOM 981 CD1 ILE A 211 16.200 70.899 94.862 1.00 12.42 +ATOM 982 N THR A 212 13.668 72.393 89.757 1.00 14.25 +ATOM 983 CA THR A 212 13.747 73.146 88.499 1.00 14.24 +ATOM 984 C THR A 212 14.023 74.647 88.677 1.00 16.12 +ATOM 985 O THR A 212 14.270 75.356 87.701 1.00 17.58 +ATOM 986 CB THR A 212 12.457 73.019 87.675 1.00 12.14 +ATOM 987 OG1 THR A 212 11.323 73.222 88.529 1.00 13.02 +ATOM 988 CG2 THR A 212 12.378 71.672 87.011 1.00 8.11 +ATOM 989 N ASP A 213 13.960 75.134 89.912 1.00 16.31 +ATOM 990 CA ASP A 213 14.237 76.537 90.177 1.00 18.02 +ATOM 991 C ASP A 213 14.207 76.844 91.667 1.00 18.66 +ATOM 992 O ASP A 213 13.748 76.039 92.465 1.00 18.52 +ATOM 993 CB ASP A 213 13.227 77.439 89.459 1.00 20.01 +ATOM 994 CG ASP A 213 13.772 78.839 89.221 1.00 21.40 +ATOM 995 OD1 ASP A 213 14.929 79.094 89.632 1.00 19.78 +ATOM 996 OD2 ASP A 213 13.057 79.674 88.617 1.00 21.95 +ATOM 997 N THR A 214 14.710 78.020 92.027 1.00 20.06 +ATOM 998 CA THR A 214 14.730 78.489 93.413 1.00 19.90 +ATOM 999 C THR A 214 14.381 79.979 93.466 1.00 19.53 +ATOM 1000 O THR A 214 14.735 80.734 92.569 1.00 19.00 +ATOM 1001 CB THR A 214 16.119 78.278 94.062 1.00 19.71 +ATOM 1002 OG1 THR A 214 16.133 77.034 94.772 1.00 19.73 +ATOM 1003 CG2 THR A 214 16.432 79.402 95.021 1.00 19.77 +ATOM 1004 N ILE A 215 13.682 80.387 94.521 1.00 20.02 +ATOM 1005 CA ILE A 215 13.297 81.781 94.708 1.00 19.70 +ATOM 1006 C ILE A 215 13.598 82.158 96.151 1.00 21.02 +ATOM 1007 O ILE A 215 12.970 81.630 97.070 1.00 20.95 +ATOM 1008 CB ILE A 215 11.795 81.976 94.477 1.00 20.44 +ATOM 1009 CG1 ILE A 215 11.398 81.396 93.115 1.00 20.30 +ATOM 1010 CG2 ILE A 215 11.444 83.456 94.560 1.00 18.77 +ATOM 1011 CD1 ILE A 215 9.894 81.275 92.921 1.00 21.91 +ATOM 1012 N LYS A 216 14.561 83.057 96.356 1.00 21.91 +ATOM 1013 CA LYS A 216 14.918 83.495 97.707 1.00 22.79 +ATOM 1014 C LYS A 216 14.113 84.713 98.133 1.00 21.11 +ATOM 1015 O LYS A 216 13.692 85.506 97.298 1.00 20.34 +ATOM 1016 CB LYS A 216 16.416 83.823 97.798 1.00 26.84 +ATOM 1017 CG LYS A 216 16.961 84.715 96.654 1.00 33.31 +ATOM 1018 CD LYS A 216 18.473 85.028 96.845 1.00 35.34 +ATOM 1019 CE LYS A 216 19.166 85.488 95.542 1.00 35.90 +ATOM 1020 NZ LYS A 216 19.311 84.392 94.514 1.00 34.35 +ATOM 1021 N SER A 217 13.897 84.840 99.440 1.00 21.03 +ATOM 1022 CA SER A 217 13.158 85.960 100.022 1.00 20.08 +ATOM 1023 C SER A 217 13.775 87.258 99.515 1.00 20.87 +ATOM 1024 O SER A 217 14.998 87.363 99.441 1.00 20.37 +ATOM 1025 CB SER A 217 13.260 85.900 101.549 1.00 19.57 +ATOM 1026 OG SER A 217 12.803 87.093 102.164 1.00 18.17 +ATOM 1027 N TRP A 218 12.940 88.239 99.169 1.00 20.53 +ATOM 1028 CA TRP A 218 13.439 89.518 98.658 1.00 21.29 +ATOM 1029 C TRP A 218 13.279 90.680 99.639 1.00 22.57 +ATOM 1030 O TRP A 218 13.714 91.806 99.359 1.00 23.16 +ATOM 1031 CB TRP A 218 12.764 89.857 97.323 1.00 19.09 +ATOM 1032 CG TRP A 218 11.284 90.047 97.405 1.00 19.09 +ATOM 1033 CD1 TRP A 218 10.623 91.201 97.682 1.00 18.47 +ATOM 1034 CD2 TRP A 218 10.275 89.043 97.206 1.00 17.64 +ATOM 1035 NE1 TRP A 218 9.263 90.987 97.665 1.00 18.95 +ATOM 1036 CE2 TRP A 218 9.023 89.670 97.377 1.00 17.86 +ATOM 1037 CE3 TRP A 218 10.311 87.676 96.900 1.00 17.01 +ATOM 1038 CZ2 TRP A 218 7.812 88.977 97.252 1.00 16.86 +ATOM 1039 CZ3 TRP A 218 9.113 86.989 96.775 1.00 16.49 +ATOM 1040 CH2 TRP A 218 7.876 87.644 96.951 1.00 17.12 +ATOM 1041 N ARG A 219 12.672 90.395 100.788 1.00 22.35 +ATOM 1042 CA ARG A 219 12.456 91.388 101.839 1.00 23.85 +ATOM 1043 C ARG A 219 12.930 90.827 103.180 1.00 23.12 +ATOM 1044 O ARG A 219 12.836 91.490 104.213 1.00 22.27 +ATOM 1045 CB ARG A 219 10.966 91.748 101.944 1.00 27.83 +ATOM 1046 CG ARG A 219 10.473 92.719 100.882 1.00 32.52 +ATOM 1047 CD ARG A 219 11.072 94.105 101.111 1.00 36.73 +ATOM 1048 NE ARG A 219 10.860 94.981 99.962 1.00 42.65 +ATOM 1049 CZ ARG A 219 11.556 96.095 99.736 1.00 46.40 +ATOM 1050 NH1 ARG A 219 12.509 96.474 100.588 1.00 46.53 +ATOM 1051 NH2 ARG A 219 11.324 96.817 98.641 1.00 47.83 +ATOM 1052 N ASN A 220 13.424 89.594 103.155 1.00 22.06 +ATOM 1053 CA ASN A 220 13.913 88.927 104.356 1.00 21.70 +ATOM 1054 C ASN A 220 12.917 88.919 105.511 1.00 21.14 +ATOM 1055 O ASN A 220 13.292 89.170 106.654 1.00 21.07 +ATOM 1056 CB ASN A 220 15.212 89.571 104.843 1.00 22.13 +ATOM 1057 CG ASN A 220 16.327 89.484 103.826 1.00 22.35 +ATOM 1058 OD1 ASN A 220 16.275 88.695 102.876 1.00 24.78 +ATOM 1059 ND2 ASN A 220 17.354 90.287 104.027 1.00 21.25 +ATOM 1060 N ASN A 221 11.652 88.636 105.231 1.00 19.94 +ATOM 1061 CA ASN A 221 10.675 88.591 106.308 1.00 18.24 +ATOM 1062 C ASN A 221 9.594 87.539 106.067 1.00 18.45 +ATOM 1063 O ASN A 221 8.444 87.858 105.756 1.00 18.58 +ATOM 1064 CB ASN A 221 10.050 89.971 106.518 1.00 15.30 +ATOM 1065 CG ASN A 221 9.119 90.016 107.712 1.00 13.88 +ATOM 1066 OD1 ASN A 221 9.035 89.067 108.491 1.00 13.89 +ATOM 1067 ND2 ASN A 221 8.417 91.131 107.867 1.00 13.96 +ATOM 1068 N ILE A 222 10.001 86.281 106.213 1.00 17.92 +ATOM 1069 CA ILE A 222 9.132 85.122 106.062 1.00 17.46 +ATOM 1070 C ILE A 222 8.481 84.939 104.693 1.00 18.31 +ATOM 1071 O ILE A 222 7.258 85.065 104.564 1.00 19.09 +ATOM 1072 CB ILE A 222 8.024 85.142 107.135 1.00 17.38 +ATOM 1073 CG1 ILE A 222 8.653 85.375 108.510 1.00 17.48 +ATOM 1074 CG2 ILE A 222 7.265 83.814 107.148 1.00 16.00 +ATOM 1075 CD1 ILE A 222 7.642 85.457 109.633 1.00 17.28 +ATOM 1076 N LEU A 223 9.282 84.642 103.669 1.00 17.87 +ATOM 1077 CA LEU A 223 8.715 84.417 102.336 1.00 17.68 +ATOM 1078 C LEU A 223 7.676 83.307 102.493 1.00 16.86 +ATOM 1079 O LEU A 223 7.967 82.248 103.052 1.00 18.58 +ATOM 1080 CB LEU A 223 9.798 83.979 101.343 1.00 17.39 +ATOM 1081 CG LEU A 223 9.298 83.453 99.991 1.00 15.33 +ATOM 1082 CD1 LEU A 223 8.748 84.577 99.120 1.00 14.72 +ATOM 1083 CD2 LEU A 223 10.445 82.775 99.296 1.00 15.84 +ATOM 1084 N ARG A 224 6.466 83.555 102.013 1.00 16.16 +ATOM 1085 CA ARG A 224 5.386 82.589 102.141 1.00 15.25 +ATOM 1086 C ARG A 224 4.525 82.542 100.887 1.00 17.33 +ATOM 1087 O ARG A 224 4.617 83.427 100.026 1.00 17.63 +ATOM 1088 CB ARG A 224 4.534 82.931 103.368 1.00 15.94 +ATOM 1089 CG ARG A 224 4.292 84.431 103.591 1.00 13.60 +ATOM 1090 CD ARG A 224 3.724 84.711 104.991 1.00 13.60 +ATOM 1091 NE ARG A 224 3.363 86.117 105.180 1.00 14.30 +ATOM 1092 CZ ARG A 224 4.230 87.128 105.149 1.00 13.33 +ATOM 1093 NH1 ARG A 224 3.812 88.372 105.326 1.00 11.92 +ATOM 1094 NH2 ARG A 224 5.522 86.899 104.944 1.00 16.20 +ATOM 1095 N THR A 225 3.686 81.511 100.780 1.00 17.09 +ATOM 1096 CA THR A 225 2.850 81.366 99.599 1.00 16.04 +ATOM 1097 C THR A 225 1.401 80.912 99.853 1.00 15.72 +ATOM 1098 O THR A 225 0.877 81.042 100.963 1.00 15.84 +ATOM 1099 CB THR A 225 3.549 80.428 98.565 1.00 16.09 +ATOM 1100 OG1 THR A 225 2.916 80.567 97.288 1.00 16.81 +ATOM 1101 CG2 THR A 225 3.487 78.971 99.014 1.00 16.31 +ATOM 1102 N GLN A 226 0.779 80.366 98.812 1.00 14.72 +ATOM 1103 CA GLN A 226 -0.618 79.949 98.823 1.00 15.51 +ATOM 1104 C GLN A 226 -1.198 79.017 99.873 1.00 16.28 +ATOM 1105 O GLN A 226 -2.249 79.311 100.432 1.00 16.26 +ATOM 1106 CB GLN A 226 -0.987 79.379 97.462 1.00 15.49 +ATOM 1107 CG GLN A 226 -0.769 80.325 96.310 1.00 16.37 +ATOM 1108 CD GLN A 226 -1.419 79.815 95.044 1.00 18.64 +ATOM 1109 OE1 GLN A 226 -2.649 79.694 94.972 1.00 19.04 +ATOM 1110 NE2 GLN A 226 -0.603 79.500 94.039 1.00 17.39 +ATOM 1111 N GLU A 227 -0.546 77.889 100.125 1.00 16.63 +ATOM 1112 CA GLU A 227 -1.070 76.916 101.077 1.00 17.34 +ATOM 1113 C GLU A 227 -2.335 76.294 100.458 1.00 17.58 +ATOM 1114 O GLU A 227 -3.255 75.884 101.165 1.00 17.17 +ATOM 1115 CB GLU A 227 -1.394 77.577 102.431 1.00 18.30 +ATOM 1116 CG GLU A 227 -0.250 78.417 103.031 1.00 21.61 +ATOM 1117 CD GLU A 227 0.943 77.590 103.502 1.00 22.82 +ATOM 1118 OE1 GLU A 227 1.419 76.720 102.739 1.00 22.58 +ATOM 1119 OE2 GLU A 227 1.420 77.822 104.643 1.00 26.66 +ATOM 1120 N SER A 228 -2.364 76.266 99.120 1.00 18.04 +ATOM 1121 CA SER A 228 -3.443 75.673 98.314 1.00 17.11 +ATOM 1122 C SER A 228 -2.865 75.430 96.917 1.00 17.69 +ATOM 1123 O SER A 228 -1.654 75.523 96.732 1.00 18.70 +ATOM 1124 CB SER A 228 -4.702 76.562 98.243 1.00 15.77 +ATOM 1125 OG SER A 228 -4.458 77.845 97.713 1.00 16.72 +ATOM 1126 N GLU A 229 -3.702 75.133 95.931 1.00 17.57 +ATOM 1127 CA GLU A 229 -3.183 74.833 94.602 1.00 17.95 +ATOM 1128 C GLU A 229 -2.904 76.050 93.742 1.00 19.18 +ATOM 1129 O GLU A 229 -3.588 77.064 93.848 1.00 21.05 +ATOM 1130 CB GLU A 229 -4.145 73.905 93.843 1.00 17.55 +ATOM 1131 CG GLU A 229 -5.455 74.572 93.451 1.00 18.04 +ATOM 1132 CD GLU A 229 -6.276 73.790 92.417 1.00 21.04 +ATOM 1133 OE1 GLU A 229 -7.278 74.353 91.910 1.00 22.18 +ATOM 1134 OE2 GLU A 229 -5.937 72.624 92.107 1.00 19.92 +ATOM 1135 N CYS A 230 -1.879 75.944 92.899 1.00 18.58 +ATOM 1136 CA CYS A 230 -1.543 77.011 91.981 1.00 17.96 +ATOM 1137 C CYS A 230 -2.349 76.718 90.730 1.00 17.75 +ATOM 1138 O CYS A 230 -2.863 75.615 90.578 1.00 18.47 +ATOM 1139 CB CYS A 230 -0.043 77.035 91.666 1.00 19.57 +ATOM 1140 SG CYS A 230 0.860 75.448 91.577 1.00 20.47 +ATOM 1141 N ALA A 231 -2.467 77.688 89.834 1.00 16.75 +ATOM 1142 CA ALA A 231 -3.271 77.488 88.631 1.00 15.71 +ATOM 1143 C ALA A 231 -2.463 77.357 87.343 1.00 14.41 +ATOM 1144 O ALA A 231 -1.535 78.119 87.105 1.00 11.66 +ATOM 1145 CB ALA A 231 -4.288 78.625 88.503 1.00 13.01 +ATOM 1146 N CYS A 232 -2.821 76.390 86.508 1.00 15.49 +ATOM 1147 CA CYS A 232 -2.097 76.210 85.252 1.00 18.33 +ATOM 1148 C CYS A 232 -2.986 76.478 84.044 1.00 17.57 +ATOM 1149 O CYS A 232 -4.144 76.096 84.021 1.00 17.12 +ATOM 1150 CB CYS A 232 -1.511 74.794 85.155 1.00 19.17 +ATOM 1151 SG CYS A 232 -0.420 74.247 86.524 1.00 24.32 +ATOM 1152 N VAL A 233 -2.429 77.149 83.045 1.00 19.06 +ATOM 1153 CA VAL A 233 -3.152 77.462 81.815 1.00 19.04 +ATOM 1154 C VAL A 233 -2.256 77.314 80.591 1.00 19.53 +ATOM 1155 O VAL A 233 -1.123 77.794 80.585 1.00 20.82 +ATOM 1156 CB VAL A 233 -3.674 78.903 81.834 1.00 19.55 +ATOM 1157 CG1 VAL A 233 -4.174 79.289 80.452 1.00 20.27 +ATOM 1158 CG2 VAL A 233 -4.784 79.031 82.849 1.00 19.12 +ATOM 1159 N ASN A 234 -2.756 76.639 79.561 1.00 19.31 +ATOM 1160 CA ASN A 234 -2.002 76.471 78.317 1.00 18.99 +ATOM 1161 C ASN A 234 -0.517 76.146 78.509 1.00 18.57 +ATOM 1162 O ASN A 234 0.320 76.604 77.748 1.00 20.21 +ATOM 1163 CB ASN A 234 -2.184 77.747 77.460 1.00 20.56 +ATOM 1164 CG ASN A 234 -1.309 77.780 76.203 1.00 20.42 +ATOM 1165 OD1 ASN A 234 -1.147 76.777 75.504 1.00 19.14 +ATOM 1166 ND2 ASN A 234 -0.760 78.960 75.903 1.00 19.19 +ATOM 1167 N GLY A 235 -0.189 75.359 79.527 1.00 17.82 +ATOM 1168 CA GLY A 235 1.199 74.985 79.741 1.00 16.50 +ATOM 1169 C GLY A 235 1.986 75.832 80.723 1.00 17.60 +ATOM 1170 O GLY A 235 3.190 75.647 80.874 1.00 17.35 +ATOM 1171 N SER A 236 1.317 76.765 81.394 1.00 17.84 +ATOM 1172 CA SER A 236 1.990 77.626 82.365 1.00 16.59 +ATOM 1173 C SER A 236 1.208 77.613 83.672 1.00 17.57 +ATOM 1174 O SER A 236 -0.028 77.570 83.678 1.00 17.29 +ATOM 1175 CB SER A 236 2.075 79.060 81.847 1.00 13.78 +ATOM 1176 OG SER A 236 2.628 79.102 80.551 1.00 15.90 +ATOM 1177 N CYS A 237 1.928 77.645 84.783 1.00 17.52 +ATOM 1178 CA CYS A 237 1.283 77.647 86.082 1.00 18.25 +ATOM 1179 C CYS A 237 1.661 78.941 86.788 1.00 17.52 +ATOM 1180 O CYS A 237 2.790 79.412 86.668 1.00 19.08 +ATOM 1181 CB CYS A 237 1.722 76.425 86.881 1.00 18.69 +ATOM 1182 SG CYS A 237 1.471 74.843 86.006 1.00 24.99 +ATOM 1183 N PHE A 238 0.709 79.522 87.508 1.00 16.21 +ATOM 1184 CA PHE A 238 0.947 80.777 88.197 1.00 17.13 +ATOM 1185 C PHE A 238 0.657 80.673 89.692 1.00 18.10 +ATOM 1186 O PHE A 238 -0.274 79.977 90.117 1.00 17.83 +ATOM 1187 CB PHE A 238 0.070 81.886 87.606 1.00 18.08 +ATOM 1188 CG PHE A 238 0.034 81.915 86.104 1.00 17.47 +ATOM 1189 CD1 PHE A 238 -0.723 80.991 85.395 1.00 16.41 +ATOM 1190 CD2 PHE A 238 0.737 82.886 85.399 1.00 17.84 +ATOM 1191 CE1 PHE A 238 -0.783 81.031 84.011 1.00 16.39 +ATOM 1192 CE2 PHE A 238 0.686 82.938 84.015 1.00 17.48 +ATOM 1193 CZ PHE A 238 -0.078 82.006 83.317 1.00 18.09 +ATOM 1194 N THR A 239 1.450 81.383 90.485 1.00 17.33 +ATOM 1195 CA THR A 239 1.275 81.368 91.928 1.00 18.69 +ATOM 1196 C THR A 239 1.481 82.775 92.470 1.00 16.95 +ATOM 1197 O THR A 239 1.864 83.686 91.739 1.00 16.98 +ATOM 1198 CB THR A 239 2.296 80.406 92.589 1.00 19.82 +ATOM 1199 OG1 THR A 239 1.947 80.183 93.962 1.00 20.69 +ATOM 1200 CG2 THR A 239 3.694 80.996 92.515 1.00 20.11 +ATOM 1201 N VAL A 240 1.214 82.941 93.757 1.00 16.21 +ATOM 1202 CA VAL A 240 1.375 84.225 94.421 1.00 15.43 +ATOM 1203 C VAL A 240 2.209 84.019 95.682 1.00 16.34 +ATOM 1204 O VAL A 240 2.050 83.015 96.381 1.00 16.76 +ATOM 1205 CB VAL A 240 0.015 84.821 94.828 1.00 14.04 +ATOM 1206 CG1 VAL A 240 0.228 86.123 95.581 1.00 11.84 +ATOM 1207 CG2 VAL A 240 -0.851 85.040 93.597 1.00 12.13 +ATOM 1208 N MET A 241 3.105 84.961 95.957 1.00 16.27 +ATOM 1209 CA MET A 241 3.953 84.892 97.139 1.00 16.44 +ATOM 1210 C MET A 241 3.995 86.250 97.831 1.00 15.64 +ATOM 1211 O MET A 241 3.777 87.292 97.209 1.00 13.83 +ATOM 1212 CB MET A 241 5.380 84.451 96.774 1.00 16.12 +ATOM 1213 CG MET A 241 5.462 83.104 96.079 1.00 17.09 +ATOM 1214 SD MET A 241 7.139 82.417 96.050 1.00 19.59 +ATOM 1215 CE MET A 241 6.853 80.814 96.712 1.00 19.24 +ATOM 1216 N THR A 242 4.276 86.223 99.126 1.00 15.52 +ATOM 1217 CA THR A 242 4.334 87.431 99.928 1.00 17.74 +ATOM 1218 C THR A 242 5.589 87.429 100.784 1.00 19.29 +ATOM 1219 O THR A 242 6.012 86.387 101.291 1.00 20.92 +ATOM 1220 CB THR A 242 3.118 87.529 100.872 1.00 18.00 +ATOM 1221 OG1 THR A 242 1.920 87.654 100.099 1.00 16.57 +ATOM 1222 CG2 THR A 242 3.254 88.729 101.807 1.00 18.87 +ATOM 1223 N ASP A 243 6.185 88.602 100.938 1.00 20.13 +ATOM 1224 CA ASP A 243 7.375 88.755 101.755 1.00 20.39 +ATOM 1225 C ASP A 243 7.196 90.091 102.444 1.00 21.62 +ATOM 1226 O ASP A 243 6.955 91.116 101.796 1.00 22.88 +ATOM 1227 CB ASP A 243 8.631 88.754 100.881 1.00 20.85 +ATOM 1228 CG ASP A 243 9.893 88.397 101.660 1.00 20.14 +ATOM 1229 OD1 ASP A 243 10.912 88.088 101.008 1.00 18.95 +ATOM 1230 OD2 ASP A 243 9.869 88.428 102.913 1.00 19.21 +ATOM 1231 N GLY A 244 7.292 90.080 103.762 1.00 21.25 +ATOM 1232 CA GLY A 244 7.116 91.303 104.508 1.00 21.20 +ATOM 1233 C GLY A 244 6.270 91.037 105.738 1.00 21.87 +ATOM 1234 O GLY A 244 6.097 89.889 106.146 1.00 22.84 +ATOM 1235 N PRO A 245 5.729 92.088 106.358 1.00 21.51 +ATOM 1236 CA PRO A 245 4.901 91.946 107.560 1.00 20.46 +ATOM 1237 C PRO A 245 3.490 91.381 107.369 1.00 18.97 +ATOM 1238 O PRO A 245 2.806 91.699 106.395 1.00 18.63 +ATOM 1239 CB PRO A 245 4.849 93.375 108.120 1.00 20.01 +ATOM 1240 CG PRO A 245 6.088 94.021 107.572 1.00 21.17 +ATOM 1241 CD PRO A 245 6.121 93.495 106.159 1.00 22.47 +ATOM 1242 N SER A 246 3.068 90.537 108.305 1.00 16.47 +ATOM 1243 CA SER A 246 1.716 90.014 108.275 1.00 17.78 +ATOM 1244 C SER A 246 0.980 91.093 109.065 1.00 17.84 +ATOM 1245 O SER A 246 -0.235 91.062 109.243 1.00 17.71 +ATOM 1246 CB SER A 246 1.632 88.650 108.977 1.00 17.06 +ATOM 1247 OG SER A 246 2.086 88.686 110.319 1.00 17.05 +ATOM 1248 N ASN A 247 1.775 92.079 109.477 1.00 18.92 +ATOM 1249 CA ASN A 247 1.379 93.229 110.282 1.00 19.28 +ATOM 1250 C ASN A 247 0.971 94.522 109.551 1.00 19.62 +ATOM 1251 O ASN A 247 0.338 95.388 110.149 1.00 18.83 +ATOM 1252 CB ASN A 247 2.532 93.573 111.222 1.00 17.32 +ATOM 1253 CG ASN A 247 2.131 93.498 112.664 1.00 18.57 +ATOM 1254 OD1 ASN A 247 0.952 93.336 112.972 1.00 21.15 +ATOM 1255 ND2 ASN A 247 3.100 93.621 113.563 1.00 16.08 +ATOM 1256 N GLY A 248 1.367 94.673 108.288 1.00 19.48 +ATOM 1257 CA GLY A 248 1.038 95.873 107.537 1.00 18.63 +ATOM 1258 C GLY A 248 1.415 95.707 106.072 1.00 20.78 +ATOM 1259 O GLY A 248 1.420 94.579 105.561 1.00 19.82 +ATOM 1260 N GLN A 249 1.729 96.816 105.395 1.00 20.62 +ATOM 1261 CA GLN A 249 2.108 96.794 103.979 1.00 19.77 +ATOM 1262 C GLN A 249 3.204 95.767 103.722 1.00 19.68 +ATOM 1263 O GLN A 249 4.280 95.851 104.307 1.00 20.48 +ATOM 1264 CB GLN A 249 2.640 98.168 103.540 1.00 20.37 +ATOM 1265 CG GLN A 249 1.855 98.864 102.433 1.00 21.92 +ATOM 1266 CD GLN A 249 1.507 97.948 101.273 1.00 23.74 +ATOM 1267 OE1 GLN A 249 2.339 97.171 100.805 1.00 27.13 +ATOM 1268 NE2 GLN A 249 0.274 98.042 100.798 1.00 23.97 +ATOM 1269 N ALA A 250 2.942 94.807 102.844 1.00 18.79 +ATOM 1270 CA ALA A 250 3.944 93.799 102.512 1.00 17.00 +ATOM 1271 C ALA A 250 4.130 93.773 101.000 1.00 16.74 +ATOM 1272 O ALA A 250 3.350 94.378 100.269 1.00 17.10 +ATOM 1273 CB ALA A 250 3.515 92.434 103.017 1.00 16.68 +ATOM 1274 N SER A 251 5.162 93.078 100.533 1.00 15.85 +ATOM 1275 CA SER A 251 5.443 92.997 99.108 1.00 14.41 +ATOM 1276 C SER A 251 4.795 91.749 98.505 1.00 14.77 +ATOM 1277 O SER A 251 4.950 90.637 99.015 1.00 15.16 +ATOM 1278 CB SER A 251 6.962 92.992 98.877 1.00 15.66 +ATOM 1279 OG SER A 251 7.296 92.980 97.496 1.00 16.54 +ATOM 1280 N TYR A 252 4.070 91.943 97.411 1.00 14.28 +ATOM 1281 CA TYR A 252 3.385 90.849 96.746 1.00 14.04 +ATOM 1282 C TYR A 252 3.882 90.613 95.323 1.00 15.37 +ATOM 1283 O TYR A 252 4.092 91.559 94.556 1.00 17.17 +ATOM 1284 CB TYR A 252 1.888 91.138 96.720 1.00 12.14 +ATOM 1285 CG TYR A 252 1.416 91.819 97.973 1.00 12.56 +ATOM 1286 CD1 TYR A 252 1.040 93.159 97.964 1.00 10.94 +ATOM 1287 CD2 TYR A 252 1.411 91.141 99.193 1.00 13.62 +ATOM 1288 CE1 TYR A 252 0.678 93.810 99.143 1.00 11.43 +ATOM 1289 CE2 TYR A 252 1.051 91.784 100.374 1.00 13.38 +ATOM 1290 CZ TYR A 252 0.689 93.112 100.343 1.00 11.77 +ATOM 1291 OH TYR A 252 0.339 93.728 101.516 1.00 13.26 +ATOM 1292 N LYS A 253 4.048 89.344 94.964 1.00 15.35 +ATOM 1293 CA LYS A 253 4.506 88.997 93.628 1.00 15.47 +ATOM 1294 C LYS A 253 3.765 87.822 92.993 1.00 15.71 +ATOM 1295 O LYS A 253 3.369 86.872 93.671 1.00 15.63 +ATOM 1296 CB LYS A 253 5.997 88.672 93.650 1.00 16.29 +ATOM 1297 CG LYS A 253 6.906 89.824 93.993 1.00 16.45 +ATOM 1298 CD LYS A 253 8.328 89.408 93.716 1.00 18.46 +ATOM 1299 CE LYS A 253 9.331 90.478 94.091 1.00 19.78 +ATOM 1300 NZ LYS A 253 10.679 90.094 93.579 1.00 20.99 +ATOM 1301 N ILE A 254 3.594 87.902 91.678 1.00 15.00 +ATOM 1302 CA ILE A 254 2.945 86.851 90.900 1.00 16.74 +ATOM 1303 C ILE A 254 4.011 86.173 90.056 1.00 17.50 +ATOM 1304 O ILE A 254 4.766 86.841 89.346 1.00 16.97 +ATOM 1305 CB ILE A 254 1.918 87.403 89.921 1.00 17.38 +ATOM 1306 CG1 ILE A 254 0.695 87.927 90.660 1.00 19.83 +ATOM 1307 CG2 ILE A 254 1.527 86.318 88.949 1.00 19.77 +ATOM 1308 CD1 ILE A 254 -0.284 88.615 89.733 1.00 21.52 +ATOM 1309 N PHE A 255 4.071 84.849 90.112 1.00 17.67 +ATOM 1310 CA PHE A 255 5.063 84.141 89.325 1.00 16.41 +ATOM 1311 C PHE A 255 4.433 83.287 88.243 1.00 15.89 +ATOM 1312 O PHE A 255 3.390 82.674 88.444 1.00 16.19 +ATOM 1313 CB PHE A 255 5.942 83.274 90.227 1.00 17.18 +ATOM 1314 CG PHE A 255 6.676 84.048 91.287 1.00 16.90 +ATOM 1315 CD1 PHE A 255 6.007 84.518 92.414 1.00 18.38 +ATOM 1316 CD2 PHE A 255 8.036 84.306 91.162 1.00 17.18 +ATOM 1317 CE1 PHE A 255 6.687 85.233 93.405 1.00 17.18 +ATOM 1318 CE2 PHE A 255 8.721 85.018 92.143 1.00 16.39 +ATOM 1319 CZ PHE A 255 8.044 85.480 93.267 1.00 17.09 +ATOM 1320 N LYS A 256 5.064 83.288 87.075 1.00 16.28 +ATOM 1321 CA LYS A 256 4.609 82.491 85.944 1.00 15.77 +ATOM 1322 C LYS A 256 5.728 81.495 85.693 1.00 16.39 +ATOM 1323 O LYS A 256 6.895 81.881 85.604 1.00 18.78 +ATOM 1324 CB LYS A 256 4.409 83.351 84.700 1.00 14.02 +ATOM 1325 CG LYS A 256 4.025 82.521 83.485 1.00 14.64 +ATOM 1326 CD LYS A 256 4.015 83.319 82.198 1.00 14.42 +ATOM 1327 CE LYS A 256 3.668 82.419 81.034 1.00 15.57 +ATOM 1328 NZ LYS A 256 3.453 83.195 79.803 1.00 17.47 +ATOM 1329 N MET A 257 5.391 80.218 85.580 1.00 16.02 +ATOM 1330 CA MET A 257 6.423 79.217 85.367 1.00 16.13 +ATOM 1331 C MET A 257 6.076 78.169 84.338 1.00 15.67 +ATOM 1332 O MET A 257 4.905 77.886 84.090 1.00 15.76 +ATOM 1333 CB MET A 257 6.763 78.552 86.697 1.00 17.02 +ATOM 1334 CG MET A 257 5.651 78.663 87.693 1.00 19.14 +ATOM 1335 SD MET A 257 6.209 78.980 89.387 1.00 20.04 +ATOM 1336 CE MET A 257 4.666 78.803 90.187 1.00 18.42 +ATOM 1337 N GLU A 258 7.117 77.602 83.742 1.00 15.11 +ATOM 1338 CA GLU A 258 6.969 76.569 82.728 1.00 17.34 +ATOM 1339 C GLU A 258 7.953 75.437 83.034 1.00 17.75 +ATOM 1340 O GLU A 258 9.167 75.649 83.105 1.00 18.45 +ATOM 1341 CB GLU A 258 7.200 77.179 81.335 1.00 16.82 +ATOM 1342 CG GLU A 258 6.150 78.248 81.001 1.00 20.00 +ATOM 1343 CD GLU A 258 6.322 78.905 79.634 1.00 21.70 +ATOM 1344 OE1 GLU A 258 5.491 79.785 79.306 1.00 20.98 +ATOM 1345 OE2 GLU A 258 7.273 78.550 78.892 1.00 24.44 +ATOM 1346 N LYS A 259 7.407 74.239 83.230 1.00 18.65 +ATOM 1347 CA LYS A 259 8.181 73.053 83.574 1.00 18.46 +ATOM 1348 C LYS A 259 8.910 73.294 84.878 1.00 18.40 +ATOM 1349 O LYS A 259 10.021 72.802 85.080 1.00 18.47 +ATOM 1350 CB LYS A 259 9.192 72.721 82.491 1.00 20.45 +ATOM 1351 CG LYS A 259 8.591 72.421 81.147 1.00 23.51 +ATOM 1352 CD LYS A 259 9.701 72.020 80.189 1.00 26.95 +ATOM 1353 CE LYS A 259 9.295 72.236 78.735 1.00 29.70 +ATOM 1354 NZ LYS A 259 10.400 71.825 77.810 1.00 33.29 +ATOM 1355 N GLY A 260 8.287 74.080 85.751 1.00 18.13 +ATOM 1356 CA GLY A 260 8.873 74.372 87.047 1.00 17.29 +ATOM 1357 C GLY A 260 9.911 75.478 87.105 1.00 17.89 +ATOM 1358 O GLY A 260 10.545 75.677 88.140 1.00 18.33 +ATOM 1359 N LYS A 261 10.099 76.202 86.007 1.00 18.80 +ATOM 1360 CA LYS A 261 11.077 77.290 85.981 1.00 19.44 +ATOM 1361 C LYS A 261 10.370 78.640 85.841 1.00 17.56 +ATOM 1362 O LYS A 261 9.460 78.787 85.022 1.00 17.74 +ATOM 1363 CB LYS A 261 12.068 77.077 84.820 1.00 20.88 +ATOM 1364 CG LYS A 261 13.096 78.192 84.644 1.00 24.29 +ATOM 1365 CD LYS A 261 14.158 77.861 83.583 1.00 25.75 +ATOM 1366 CE LYS A 261 15.360 77.107 84.171 1.00 30.06 +ATOM 1367 NZ LYS A 261 15.102 75.659 84.558 1.00 30.49 +ATOM 1368 N VAL A 262 10.778 79.617 86.649 1.00 16.06 +ATOM 1369 CA VAL A 262 10.179 80.953 86.596 1.00 15.30 +ATOM 1370 C VAL A 262 10.578 81.648 85.292 1.00 15.37 +ATOM 1371 O VAL A 262 11.743 81.965 85.100 1.00 16.59 +ATOM 1372 CB VAL A 262 10.636 81.832 87.797 1.00 13.91 +ATOM 1373 CG1 VAL A 262 10.070 83.234 87.664 1.00 11.83 +ATOM 1374 CG2 VAL A 262 10.177 81.214 89.107 1.00 11.51 +ATOM 1375 N VAL A 263 9.613 81.869 84.401 1.00 14.98 +ATOM 1376 CA VAL A 263 9.881 82.519 83.113 1.00 16.11 +ATOM 1377 C VAL A 263 9.571 84.016 83.143 1.00 17.55 +ATOM 1378 O VAL A 263 10.046 84.771 82.288 1.00 18.00 +ATOM 1379 CB VAL A 263 9.071 81.867 81.956 1.00 15.38 +ATOM 1380 CG1 VAL A 263 9.633 80.500 81.634 1.00 14.63 +ATOM 1381 CG2 VAL A 263 7.604 81.745 82.346 1.00 13.23 +ATOM 1382 N LYS A 264 8.757 84.428 84.116 1.00 17.88 +ATOM 1383 CA LYS A 264 8.396 85.828 84.311 1.00 17.64 +ATOM 1384 C LYS A 264 7.827 86.029 85.699 1.00 18.40 +ATOM 1385 O LYS A 264 7.310 85.097 86.303 1.00 18.77 +ATOM 1386 CB LYS A 264 7.362 86.298 83.300 1.00 17.85 +ATOM 1387 CG LYS A 264 7.054 87.780 83.459 1.00 17.69 +ATOM 1388 CD LYS A 264 6.217 88.317 82.331 1.00 19.96 +ATOM 1389 CE LYS A 264 6.270 89.837 82.314 1.00 21.57 +ATOM 1390 NZ LYS A 264 5.504 90.403 81.165 1.00 24.30 +ATOM 1391 N SER A 265 7.920 87.255 86.199 1.00 19.91 +ATOM 1392 CA SER A 265 7.412 87.590 87.522 1.00 19.50 +ATOM 1393 C SER A 265 7.120 89.077 87.608 1.00 19.57 +ATOM 1394 O SER A 265 7.826 89.895 87.016 1.00 21.74 +ATOM 1395 CB SER A 265 8.445 87.242 88.585 1.00 20.27 +ATOM 1396 OG SER A 265 9.453 88.238 88.636 1.00 19.91 +ATOM 1397 N VAL A 266 6.088 89.432 88.359 1.00 18.91 +ATOM 1398 CA VAL A 266 5.728 90.830 88.520 1.00 17.61 +ATOM 1399 C VAL A 266 5.368 91.116 89.960 1.00 18.38 +ATOM 1400 O VAL A 266 4.799 90.264 90.645 1.00 17.12 +ATOM 1401 CB VAL A 266 4.524 91.201 87.652 1.00 18.22 +ATOM 1402 CG1 VAL A 266 4.139 92.639 87.910 1.00 17.04 +ATOM 1403 CG2 VAL A 266 4.851 90.977 86.181 1.00 18.53 +ATOM 1404 N GLU A 267 5.710 92.310 90.434 1.00 20.06 +ATOM 1405 CA GLU A 267 5.363 92.668 91.797 1.00 22.23 +ATOM 1406 C GLU A 267 4.155 93.570 91.736 1.00 22.36 +ATOM 1407 O GLU A 267 4.137 94.533 90.981 1.00 23.90 +ATOM 1408 CB GLU A 267 6.494 93.402 92.504 1.00 22.29 +ATOM 1409 CG GLU A 267 6.158 93.677 93.963 1.00 23.38 +ATOM 1410 CD GLU A 267 7.309 94.294 94.711 1.00 25.29 +ATOM 1411 OE1 GLU A 267 8.461 93.855 94.509 1.00 26.74 +ATOM 1412 OE2 GLU A 267 7.063 95.209 95.516 1.00 27.37 +ATOM 1413 N LEU A 268 3.142 93.252 92.529 1.00 22.34 +ATOM 1414 CA LEU A 268 1.935 94.050 92.538 1.00 22.47 +ATOM 1415 C LEU A 268 2.127 95.431 93.160 1.00 22.71 +ATOM 1416 O LEU A 268 2.804 95.605 94.183 1.00 21.44 +ATOM 1417 CB LEU A 268 0.822 93.308 93.278 1.00 22.51 +ATOM 1418 CG LEU A 268 0.406 91.946 92.711 1.00 22.16 +ATOM 1419 CD1 LEU A 268 -0.806 91.448 93.482 1.00 19.54 +ATOM 1420 CD2 LEU A 268 0.076 92.066 91.219 1.00 21.22 +ATOM 1421 N ASP A 269 1.526 96.412 92.505 1.00 23.65 +ATOM 1422 CA ASP A 269 1.552 97.788 92.958 1.00 23.74 +ATOM 1423 C ASP A 269 0.227 97.900 93.703 1.00 23.76 +ATOM 1424 O ASP A 269 -0.742 98.472 93.204 1.00 23.92 +ATOM 1425 CB ASP A 269 1.574 98.728 91.753 1.00 24.07 +ATOM 1426 CG ASP A 269 1.772 100.179 92.145 1.00 23.92 +ATOM 1427 OD1 ASP A 269 2.024 100.450 93.336 1.00 24.00 +ATOM 1428 OD2 ASP A 269 1.688 101.049 91.251 1.00 26.05 +ATOM 1429 N ALA A 270 0.191 97.323 94.896 1.00 23.43 +ATOM 1430 CA ALA A 270 -1.017 97.316 95.694 1.00 22.54 +ATOM 1431 C ALA A 270 -0.881 98.086 96.999 1.00 21.28 +ATOM 1432 O ALA A 270 -0.808 97.504 98.083 1.00 21.28 +ATOM 1433 CB ALA A 270 -1.429 95.878 95.973 1.00 23.08 +ATOM 1434 N PRO A 271 -0.828 99.414 96.916 1.00 19.82 +ATOM 1435 CA PRO A 271 -0.709 100.142 98.178 1.00 18.93 +ATOM 1436 C PRO A 271 -2.004 100.008 98.988 1.00 17.93 +ATOM 1437 O PRO A 271 -3.101 100.056 98.433 1.00 16.66 +ATOM 1438 CB PRO A 271 -0.429 101.573 97.721 1.00 19.07 +ATOM 1439 CG PRO A 271 -1.123 101.648 96.382 1.00 19.01 +ATOM 1440 CD PRO A 271 -0.743 100.325 95.761 1.00 19.84 +ATOM 1441 N ASN A 272 -1.853 99.823 100.297 1.00 18.05 +ATOM 1442 CA ASN A 272 -2.966 99.670 101.239 1.00 17.66 +ATOM 1443 C ASN A 272 -3.688 98.319 101.114 1.00 18.77 +ATOM 1444 O ASN A 272 -4.724 98.081 101.739 1.00 17.93 +ATOM 1445 CB ASN A 272 -3.959 100.824 101.085 1.00 15.09 +ATOM 1446 CG ASN A 272 -4.929 100.908 102.245 1.00 14.89 +ATOM 1447 OD1 ASN A 272 -4.531 100.839 103.404 1.00 12.31 +ATOM 1448 ND2 ASN A 272 -6.204 101.064 101.937 1.00 15.61 +ATOM 1449 N TYR A 273 -3.123 97.434 100.297 1.00 19.10 +ATOM 1450 CA TYR A 273 -3.671 96.098 100.106 1.00 18.81 +ATOM 1451 C TYR A 273 -2.814 95.114 100.909 1.00 18.33 +ATOM 1452 O TYR A 273 -1.695 95.439 101.299 1.00 16.95 +ATOM 1453 CB TYR A 273 -3.599 95.698 98.636 1.00 18.80 +ATOM 1454 CG TYR A 273 -4.723 96.190 97.771 1.00 18.77 +ATOM 1455 CD1 TYR A 273 -4.884 97.542 97.498 1.00 18.48 +ATOM 1456 CD2 TYR A 273 -5.598 95.283 97.166 1.00 19.28 +ATOM 1457 CE1 TYR A 273 -5.883 97.981 96.639 1.00 18.53 +ATOM 1458 CE2 TYR A 273 -6.594 95.708 96.309 1.00 17.62 +ATOM 1459 CZ TYR A 273 -6.731 97.054 96.048 1.00 18.72 +ATOM 1460 OH TYR A 273 -7.703 97.458 95.170 1.00 20.82 +ATOM 1461 N HIS A 274 -3.341 93.919 101.153 1.00 18.37 +ATOM 1462 CA HIS A 274 -2.586 92.887 101.861 1.00 18.21 +ATOM 1463 C HIS A 274 -3.000 91.542 101.301 1.00 18.35 +ATOM 1464 O HIS A 274 -4.185 91.201 101.309 1.00 17.69 +ATOM 1465 CB HIS A 274 -2.859 92.914 103.365 1.00 17.96 +ATOM 1466 CG HIS A 274 -1.788 92.256 104.181 1.00 18.41 +ATOM 1467 ND1 HIS A 274 -1.991 91.086 104.883 1.00 17.22 +ATOM 1468 CD2 HIS A 274 -0.507 92.621 104.431 1.00 18.59 +ATOM 1469 CE1 HIS A 274 -0.887 90.766 105.532 1.00 16.76 +ATOM 1470 NE2 HIS A 274 0.031 91.681 105.275 1.00 17.51 +ATOM 1471 N TYR A 275 -2.024 90.789 100.803 1.00 18.22 +ATOM 1472 CA TYR A 275 -2.293 89.481 100.230 1.00 16.41 +ATOM 1473 C TYR A 275 -1.562 88.355 100.921 1.00 16.40 +ATOM 1474 O TYR A 275 -0.352 88.412 101.115 1.00 15.31 +ATOM 1475 CB TYR A 275 -1.915 89.443 98.750 1.00 17.39 +ATOM 1476 CG TYR A 275 -2.797 90.278 97.860 1.00 19.38 +ATOM 1477 CD1 TYR A 275 -2.401 91.544 97.442 1.00 19.77 +ATOM 1478 CD2 TYR A 275 -4.037 89.808 97.449 1.00 19.77 +ATOM 1479 CE1 TYR A 275 -3.224 92.321 96.631 1.00 20.45 +ATOM 1480 CE2 TYR A 275 -4.865 90.577 96.647 1.00 20.45 +ATOM 1481 CZ TYR A 275 -4.453 91.831 96.240 1.00 20.43 +ATOM 1482 OH TYR A 275 -5.279 92.587 95.444 1.00 22.17 +ATOM 1483 N GLU A 276 -2.309 87.317 101.276 1.00 17.45 +ATOM 1484 CA GLU A 276 -1.734 86.145 101.908 1.00 18.16 +ATOM 1485 C GLU A 276 -2.593 84.916 101.704 1.00 17.63 +ATOM 1486 O GLU A 276 -3.814 85.003 101.667 1.00 19.63 +ATOM 1487 CB GLU A 276 -1.493 86.397 103.401 1.00 19.83 +ATOM 1488 CG GLU A 276 0.003 86.550 103.701 1.00 24.91 +ATOM 1489 CD GLU A 276 0.290 87.481 104.851 1.00 26.23 +ATOM 1490 OE1 GLU A 276 1.470 87.656 105.200 1.00 27.86 +ATOM 1491 OE2 GLU A 276 -0.664 88.044 105.412 1.00 30.74 +ATOM 1492 N GLU A 277 -1.937 83.775 101.538 1.00 17.18 +ATOM 1493 CA GLU A 277 -2.619 82.508 101.349 1.00 15.52 +ATOM 1494 C GLU A 277 -3.742 82.577 100.317 1.00 16.08 +ATOM 1495 O GLU A 277 -4.887 82.209 100.593 1.00 17.71 +ATOM 1496 CB GLU A 277 -3.152 82.039 102.696 1.00 15.54 +ATOM 1497 CG GLU A 277 -2.106 82.140 103.796 1.00 14.26 +ATOM 1498 CD GLU A 277 -2.611 81.691 105.150 1.00 14.37 +ATOM 1499 OE1 GLU A 277 -3.804 81.900 105.446 1.00 15.24 +ATOM 1500 OE2 GLU A 277 -1.810 81.145 105.927 1.00 15.56 +ATOM 1501 N CYS A 278 -3.400 83.048 99.122 1.00 16.28 +ATOM 1502 CA CYS A 278 -4.352 83.162 98.022 1.00 15.76 +ATOM 1503 C CYS A 278 -4.822 81.818 97.492 1.00 15.62 +ATOM 1504 O CYS A 278 -4.075 80.838 97.473 1.00 15.51 +ATOM 1505 CB CYS A 278 -3.730 83.910 96.840 1.00 15.98 +ATOM 1506 SG CYS A 278 -3.392 85.668 97.129 1.00 18.94 +ATOM 1507 N SER A 279 -6.069 81.794 97.049 1.00 14.09 +ATOM 1508 CA SER A 279 -6.645 80.610 96.454 1.00 14.16 +ATOM 1509 C SER A 279 -6.870 81.054 95.013 1.00 14.41 +ATOM 1510 O SER A 279 -7.693 81.929 94.743 1.00 13.79 +ATOM 1511 CB SER A 279 -7.957 80.261 97.149 1.00 15.96 +ATOM 1512 OG SER A 279 -7.729 79.938 98.511 1.00 17.65 +ATOM 1513 N CYS A 280 -6.112 80.484 94.087 1.00 13.99 +ATOM 1514 CA CYS A 280 -6.240 80.893 92.696 1.00 14.62 +ATOM 1515 C CYS A 280 -6.788 79.819 91.778 1.00 15.94 +ATOM 1516 O CYS A 280 -6.360 78.671 91.822 1.00 16.02 +ATOM 1517 CB CYS A 280 -4.894 81.338 92.149 1.00 15.13 +ATOM 1518 SG CYS A 280 -3.970 82.597 93.092 1.00 16.83 +ATOM 1519 N TYR A 281 -7.738 80.204 90.935 1.00 16.95 +ATOM 1520 CA TYR A 281 -8.320 79.273 89.991 1.00 16.38 +ATOM 1521 C TYR A 281 -8.287 79.829 88.575 1.00 17.17 +ATOM 1522 O TYR A 281 -8.368 81.039 88.356 1.00 16.39 +ATOM 1523 CB TYR A 281 -9.769 78.935 90.369 1.00 15.76 +ATOM 1524 CG TYR A 281 -10.743 80.091 90.293 1.00 17.35 +ATOM 1525 CD1 TYR A 281 -11.004 80.886 91.409 1.00 18.39 +ATOM 1526 CD2 TYR A 281 -11.416 80.385 89.106 1.00 17.36 +ATOM 1527 CE1 TYR A 281 -11.918 81.946 91.342 1.00 18.30 +ATOM 1528 CE2 TYR A 281 -12.324 81.436 89.029 1.00 17.74 +ATOM 1529 CZ TYR A 281 -12.570 82.212 90.147 1.00 18.03 +ATOM 1530 OH TYR A 281 -13.458 83.257 90.060 1.00 18.79 +ATOM 1531 N PRO A 282 -8.151 78.938 87.588 1.00 18.77 +ATOM 1532 CA PRO A 282 -8.118 79.383 86.193 1.00 17.47 +ATOM 1533 C PRO A 282 -9.547 79.575 85.694 1.00 18.09 +ATOM 1534 O PRO A 282 -10.465 78.905 86.172 1.00 17.09 +ATOM 1535 CB PRO A 282 -7.399 78.234 85.488 1.00 18.10 +ATOM 1536 CG PRO A 282 -7.865 77.031 86.280 1.00 17.58 +ATOM 1537 CD PRO A 282 -7.783 77.514 87.708 1.00 16.47 +ATOM 1538 N ASN A 283 -9.727 80.501 84.750 1.00 18.47 +ATOM 1539 CA ASN A 283 -11.038 80.780 84.167 1.00 17.74 +ATOM 1540 C ASN A 283 -10.917 81.585 82.862 1.00 17.41 +ATOM 1541 O ASN A 283 -10.389 82.699 82.845 1.00 15.74 +ATOM 1542 CB ASN A 283 -11.930 81.520 85.179 1.00 19.18 +ATOM 1543 CG ASN A 283 -13.310 81.830 84.620 1.00 20.22 +ATOM 1544 OD1 ASN A 283 -13.495 82.823 83.918 1.00 22.25 +ATOM 1545 ND2 ASN A 283 -14.278 80.968 84.908 1.00 19.62 +ATOM 1546 N ALA A 284 -11.406 81.000 81.772 1.00 16.49 +ATOM 1547 CA ALA A 284 -11.352 81.631 80.461 1.00 16.58 +ATOM 1548 C ALA A 284 -9.943 82.124 80.114 1.00 16.81 +ATOM 1549 O ALA A 284 -9.762 83.247 79.638 1.00 16.92 +ATOM 1550 CB ALA A 284 -12.353 82.785 80.393 1.00 15.43 +ATOM 1551 N GLY A 285 -8.949 81.280 80.370 1.00 17.17 +ATOM 1552 CA GLY A 285 -7.571 81.617 80.052 1.00 18.52 +ATOM 1553 C GLY A 285 -6.827 82.563 80.976 1.00 20.18 +ATOM 1554 O GLY A 285 -5.684 82.926 80.689 1.00 21.24 +ATOM 1555 N GLU A 286 -7.454 82.959 82.079 1.00 20.52 +ATOM 1556 CA GLU A 286 -6.831 83.867 83.032 1.00 20.91 +ATOM 1557 C GLU A 286 -6.969 83.326 84.447 1.00 20.93 +ATOM 1558 O GLU A 286 -7.704 82.368 84.681 1.00 21.44 +ATOM 1559 CB GLU A 286 -7.478 85.245 82.926 1.00 23.35 +ATOM 1560 CG GLU A 286 -7.332 85.839 81.542 1.00 28.20 +ATOM 1561 CD GLU A 286 -7.936 87.223 81.417 1.00 30.02 +ATOM 1562 OE1 GLU A 286 -7.568 88.113 82.216 1.00 31.04 +ATOM 1563 OE2 GLU A 286 -8.773 87.422 80.510 1.00 31.75 +ATOM 1564 N ILE A 287 -6.273 83.948 85.393 1.00 19.37 +ATOM 1565 CA ILE A 287 -6.306 83.488 86.768 1.00 18.48 +ATOM 1566 C ILE A 287 -6.954 84.488 87.708 1.00 19.16 +ATOM 1567 O ILE A 287 -6.761 85.701 87.576 1.00 19.81 +ATOM 1568 CB ILE A 287 -4.879 83.184 87.283 1.00 18.70 +ATOM 1569 CG1 ILE A 287 -4.299 81.996 86.522 1.00 19.38 +ATOM 1570 CG2 ILE A 287 -4.903 82.862 88.776 1.00 18.59 +ATOM 1571 CD1 ILE A 287 -4.041 82.263 85.062 1.00 21.60 +ATOM 1572 N THR A 288 -7.722 83.966 88.660 1.00 17.27 +ATOM 1573 CA THR A 288 -8.389 84.787 89.660 1.00 15.45 +ATOM 1574 C THR A 288 -8.030 84.267 91.049 1.00 16.00 +ATOM 1575 O THR A 288 -8.109 83.065 91.318 1.00 15.30 +ATOM 1576 CB THR A 288 -9.909 84.725 89.510 1.00 14.52 +ATOM 1577 OG1 THR A 288 -10.267 85.106 88.181 1.00 15.99 +ATOM 1578 CG2 THR A 288 -10.581 85.663 90.505 1.00 13.45 +ATOM 1579 N CYS A 289 -7.634 85.172 91.930 1.00 15.73 +ATOM 1580 CA CYS A 289 -7.287 84.777 93.278 1.00 15.74 +ATOM 1581 C CYS A 289 -8.054 85.592 94.312 1.00 15.92 +ATOM 1582 O CYS A 289 -8.225 86.801 94.172 1.00 15.90 +ATOM 1583 CB CYS A 289 -5.798 84.976 93.541 1.00 17.68 +ATOM 1584 SG CYS A 289 -4.593 84.367 92.321 1.00 18.32 +ATOM 1585 N VAL A 290 -8.519 84.906 95.349 1.00 15.22 +ATOM 1586 CA VAL A 290 -9.220 85.531 96.458 1.00 14.10 +ATOM 1587 C VAL A 290 -8.328 85.108 97.609 1.00 15.24 +ATOM 1588 O VAL A 290 -8.080 83.922 97.801 1.00 15.10 +ATOM 1589 CB VAL A 290 -10.644 84.976 96.619 1.00 13.95 +ATOM 1590 CG1 VAL A 290 -11.262 85.470 97.924 1.00 12.44 +ATOM 1591 CG2 VAL A 290 -11.497 85.428 95.437 1.00 12.77 +ATOM 1592 N CYS A 291 -7.832 86.087 98.359 1.00 15.70 +ATOM 1593 CA CYS A 291 -6.898 85.823 99.432 1.00 14.63 +ATOM 1594 C CYS A 291 -7.319 86.302 100.803 1.00 15.19 +ATOM 1595 O CYS A 291 -8.461 86.680 101.029 1.00 13.69 +ATOM 1596 CB CYS A 291 -5.570 86.468 99.071 1.00 15.07 +ATOM 1597 SG CYS A 291 -5.257 86.491 97.276 1.00 16.85 +ATOM 1598 N ARG A 292 -6.349 86.301 101.710 1.00 15.88 +ATOM 1599 CA ARG A 292 -6.556 86.714 103.090 1.00 15.74 +ATOM 1600 C ARG A 292 -5.842 88.020 103.447 1.00 16.56 +ATOM 1601 O ARG A 292 -4.658 88.173 103.149 1.00 16.27 +ATOM 1602 CB ARG A 292 -6.055 85.603 104.011 1.00 14.39 +ATOM 1603 CG ARG A 292 -5.768 86.016 105.436 1.00 14.25 +ATOM 1604 CD ARG A 292 -5.104 84.856 106.154 1.00 15.20 +ATOM 1605 NE ARG A 292 -4.765 85.151 107.538 1.00 15.02 +ATOM 1606 CZ ARG A 292 -4.438 84.221 108.433 1.00 17.19 +ATOM 1607 NH1 ARG A 292 -4.135 84.568 109.686 1.00 14.78 +ATOM 1608 NH2 ARG A 292 -4.428 82.939 108.080 1.00 13.64 +ATOM 1609 N ASP A 293 -6.566 88.958 104.066 1.00 16.62 +ATOM 1610 CA ASP A 293 -5.974 90.225 104.515 1.00 17.40 +ATOM 1611 C ASP A 293 -5.850 90.113 106.037 1.00 17.07 +ATOM 1612 O ASP A 293 -6.847 90.190 106.784 1.00 17.74 +ATOM 1613 CB ASP A 293 -6.842 91.432 104.134 1.00 19.84 +ATOM 1614 CG ASP A 293 -6.264 92.758 104.645 1.00 22.07 +ATOM 1615 OD1 ASP A 293 -6.524 93.814 104.017 1.00 22.11 +ATOM 1616 OD2 ASP A 293 -5.561 92.747 105.684 1.00 21.93 +ATOM 1617 N ASN A 294 -4.611 89.920 106.477 1.00 15.19 +ATOM 1618 CA ASN A 294 -4.282 89.728 107.884 1.00 15.13 +ATOM 1619 C ASN A 294 -3.913 91.048 108.551 1.00 14.99 +ATOM 1620 O ASN A 294 -3.764 91.147 109.776 1.00 13.97 +ATOM 1621 CB ASN A 294 -3.103 88.752 107.978 1.00 14.01 +ATOM 1622 CG ASN A 294 -2.946 88.157 109.354 1.00 14.61 +ATOM 1623 OD1 ASN A 294 -3.820 87.434 109.825 1.00 14.78 +ATOM 1624 ND2 ASN A 294 -1.827 88.455 110.011 1.00 13.33 +ATOM 1625 N TRP A 295 -3.775 92.062 107.715 1.00 15.09 +ATOM 1626 CA TRP A 295 -3.389 93.384 108.152 1.00 14.75 +ATOM 1627 C TRP A 295 -4.528 94.226 108.725 1.00 15.69 +ATOM 1628 O TRP A 295 -4.571 94.494 109.930 1.00 13.11 +ATOM 1629 CB TRP A 295 -2.730 94.075 106.968 1.00 14.51 +ATOM 1630 CG TRP A 295 -2.400 95.504 107.142 1.00 14.23 +ATOM 1631 CD1 TRP A 295 -2.323 96.204 108.310 1.00 14.46 +ATOM 1632 CD2 TRP A 295 -2.060 96.417 106.102 1.00 13.53 +ATOM 1633 NE1 TRP A 295 -1.957 97.503 108.061 1.00 15.12 +ATOM 1634 CE2 TRP A 295 -1.788 97.662 106.708 1.00 15.21 +ATOM 1635 CE3 TRP A 295 -1.956 96.307 104.710 1.00 12.55 +ATOM 1636 CZ2 TRP A 295 -1.419 98.795 105.969 1.00 14.06 +ATOM 1637 CZ3 TRP A 295 -1.587 97.434 103.974 1.00 13.82 +ATOM 1638 CH2 TRP A 295 -1.325 98.661 104.608 1.00 13.31 +ATOM 1639 N HIS A 296 -5.460 94.612 107.860 1.00 16.92 +ATOM 1640 CA HIS A 296 -6.567 95.461 108.269 1.00 17.76 +ATOM 1641 C HIS A 296 -7.843 95.284 107.436 1.00 18.19 +ATOM 1642 O HIS A 296 -8.479 96.265 107.060 1.00 19.49 +ATOM 1643 CB HIS A 296 -6.102 96.920 108.197 1.00 19.33 +ATOM 1644 CG HIS A 296 -5.546 97.308 106.857 1.00 19.42 +ATOM 1645 ND1 HIS A 296 -5.721 96.542 105.729 1.00 21.58 +ATOM 1646 CD2 HIS A 296 -4.896 98.428 106.458 1.00 20.17 +ATOM 1647 CE1 HIS A 296 -5.208 97.174 104.682 1.00 19.36 +ATOM 1648 NE2 HIS A 296 -4.705 98.318 105.099 1.00 20.39 +ATOM 1649 N GLY A 297 -8.223 94.040 107.159 1.00 19.59 +ATOM 1650 CA GLY A 297 -9.414 93.798 106.360 1.00 18.92 +ATOM 1651 C GLY A 297 -10.291 92.629 106.789 1.00 20.10 +ATOM 1652 O GLY A 297 -9.803 91.521 107.020 1.00 20.07 +ATOM 1653 N SER A 298 -11.593 92.895 106.895 1.00 20.85 +ATOM 1654 CA SER A 298 -12.596 91.897 107.270 1.00 21.33 +ATOM 1655 C SER A 298 -13.129 91.202 106.020 1.00 21.13 +ATOM 1656 O SER A 298 -13.686 90.110 106.093 1.00 22.10 +ATOM 1657 CB SER A 298 -13.783 92.553 107.978 1.00 19.96 +ATOM 1658 OG SER A 298 -13.526 92.718 109.345 1.00 22.31 +ATOM 1659 N ASN A 299 -12.998 91.872 104.884 1.00 18.78 +ATOM 1660 CA ASN A 299 -13.450 91.325 103.616 1.00 18.07 +ATOM 1661 C ASN A 299 -12.224 90.775 102.880 1.00 17.38 +ATOM 1662 O ASN A 299 -11.090 91.035 103.281 1.00 17.23 +ATOM 1663 CB ASN A 299 -14.145 92.421 102.800 1.00 19.01 +ATOM 1664 CG ASN A 299 -13.326 93.700 102.716 1.00 19.50 +ATOM 1665 OD1 ASN A 299 -12.586 94.045 103.650 1.00 20.20 +ATOM 1666 ND2 ASN A 299 -13.471 94.423 101.608 1.00 17.42 +ATOM 1667 N ARG A 300 -12.439 90.025 101.806 1.00 15.65 +ATOM 1668 CA ARG A 300 -11.304 89.448 101.101 1.00 15.45 +ATOM 1669 C ARG A 300 -10.807 90.206 99.878 1.00 14.91 +ATOM 1670 O ARG A 300 -11.595 90.692 99.070 1.00 15.66 +ATOM 1671 CB ARG A 300 -11.605 87.988 100.726 1.00 13.13 +ATOM 1672 CG ARG A 300 -11.760 87.090 101.948 1.00 10.90 +ATOM 1673 CD ARG A 300 -11.649 85.611 101.610 1.00 12.43 +ATOM 1674 NE ARG A 300 -11.766 84.781 102.813 1.00 14.24 +ATOM 1675 CZ ARG A 300 -10.793 84.582 103.702 1.00 13.14 +ATOM 1676 NH1 ARG A 300 -11.014 83.818 104.766 1.00 12.19 +ATOM 1677 NH2 ARG A 300 -9.593 85.122 103.521 1.00 11.87 +ATOM 1678 N PRO A 301 -9.476 90.349 99.755 1.00 14.35 +ATOM 1679 CA PRO A 301 -8.868 91.045 98.617 1.00 15.33 +ATOM 1680 C PRO A 301 -8.702 90.066 97.450 1.00 15.66 +ATOM 1681 O PRO A 301 -8.688 88.851 97.656 1.00 15.46 +ATOM 1682 CB PRO A 301 -7.530 91.510 99.180 1.00 14.51 +ATOM 1683 CG PRO A 301 -7.174 90.386 100.114 1.00 14.76 +ATOM 1684 CD PRO A 301 -8.486 90.141 100.828 1.00 13.14 +ATOM 1685 N TRP A 302 -8.578 90.591 96.232 1.00 16.43 +ATOM 1686 CA TRP A 302 -8.415 89.739 95.053 1.00 16.39 +ATOM 1687 C TRP A 302 -7.460 90.270 93.985 1.00 16.05 +ATOM 1688 O TRP A 302 -7.142 91.459 93.938 1.00 16.92 +ATOM 1689 CB TRP A 302 -9.776 89.467 94.399 1.00 15.24 +ATOM 1690 CG TRP A 302 -10.526 90.701 93.936 1.00 15.15 +ATOM 1691 CD1 TRP A 302 -11.523 91.348 94.604 1.00 15.17 +ATOM 1692 CD2 TRP A 302 -10.393 91.376 92.675 1.00 14.38 +ATOM 1693 NE1 TRP A 302 -12.027 92.371 93.839 1.00 14.59 +ATOM 1694 CE2 TRP A 302 -11.353 92.412 92.649 1.00 13.94 +ATOM 1695 CE3 TRP A 302 -9.560 91.202 91.562 1.00 14.20 +ATOM 1696 CZ2 TRP A 302 -11.510 93.269 91.557 1.00 13.69 +ATOM 1697 CZ3 TRP A 302 -9.715 92.056 90.472 1.00 14.67 +ATOM 1698 CH2 TRP A 302 -10.687 93.076 90.482 1.00 14.11 +ATOM 1699 N VAL A 303 -7.008 89.367 93.125 1.00 15.50 +ATOM 1700 CA VAL A 303 -6.113 89.721 92.031 1.00 17.00 +ATOM 1701 C VAL A 303 -6.419 88.774 90.899 1.00 17.39 +ATOM 1702 O VAL A 303 -6.537 87.570 91.106 1.00 16.83 +ATOM 1703 CB VAL A 303 -4.615 89.500 92.346 1.00 17.21 +ATOM 1704 CG1 VAL A 303 -3.760 90.223 91.306 1.00 16.85 +ATOM 1705 CG2 VAL A 303 -4.288 89.959 93.711 1.00 18.65 +ATOM 1706 N SER A 304 -6.557 89.319 89.703 1.00 17.52 +ATOM 1707 CA SER A 304 -6.810 88.490 88.547 1.00 19.38 +ATOM 1708 C SER A 304 -5.774 88.965 87.555 1.00 19.75 +ATOM 1709 O SER A 304 -5.351 90.124 87.607 1.00 19.43 +ATOM 1710 CB SER A 304 -8.228 88.701 88.022 1.00 18.24 +ATOM 1711 OG SER A 304 -8.466 90.068 87.767 1.00 24.22 +ATOM 1712 N PHE A 305 -5.332 88.070 86.683 1.00 19.58 +ATOM 1713 CA PHE A 305 -4.327 88.442 85.709 1.00 21.72 +ATOM 1714 C PHE A 305 -4.279 87.521 84.503 1.00 23.12 +ATOM 1715 O PHE A 305 -4.718 86.375 84.566 1.00 24.34 +ATOM 1716 CB PHE A 305 -2.958 88.511 86.389 1.00 19.16 +ATOM 1717 CG PHE A 305 -2.617 87.296 87.200 1.00 17.70 +ATOM 1718 CD1 PHE A 305 -1.955 86.222 86.630 1.00 17.21 +ATOM 1719 CD2 PHE A 305 -2.941 87.239 88.549 1.00 18.41 +ATOM 1720 CE1 PHE A 305 -1.618 85.110 87.395 1.00 17.82 +ATOM 1721 CE2 PHE A 305 -2.608 86.132 89.320 1.00 17.71 +ATOM 1722 CZ PHE A 305 -1.944 85.069 88.742 1.00 16.47 +ATOM 1723 N ASN A 306 -3.751 88.056 83.407 1.00 24.71 +ATOM 1724 CA ASN A 306 -3.607 87.352 82.138 1.00 27.34 +ATOM 1725 C ASN A 306 -2.321 86.508 82.130 1.00 26.13 +ATOM 1726 O ASN A 306 -1.581 86.473 83.112 1.00 25.41 +ATOM 1727 CB ASN A 306 -3.582 88.396 81.008 1.00 32.70 +ATOM 1728 CG ASN A 306 -3.269 87.795 79.650 1.00 39.43 +ATOM 1729 OD1 ASN A 306 -3.695 86.666 79.324 1.00 43.18 +ATOM 1730 ND2 ASN A 306 -2.528 88.548 78.833 1.00 42.48 +ATOM 1731 N GLN A 308 -2.049 85.835 81.021 1.00 25.29 +ATOM 1732 CA GLN A 308 -0.859 85.010 80.925 1.00 25.40 +ATOM 1733 C GLN A 308 0.433 85.781 80.743 1.00 25.71 +ATOM 1734 O GLN A 308 1.484 85.179 80.539 1.00 27.13 +ATOM 1735 CB GLN A 308 -1.025 83.981 79.817 1.00 25.12 +ATOM 1736 CG GLN A 308 -1.873 82.817 80.276 1.00 25.67 +ATOM 1737 CD GLN A 308 -2.533 82.093 79.133 1.00 27.06 +ATOM 1738 OE1 GLN A 308 -1.863 81.514 78.274 1.00 26.71 +ATOM 1739 NE2 GLN A 308 -3.864 82.125 79.108 1.00 27.62 +ATOM 1740 N ASN A 309 0.348 87.108 80.809 1.00 25.55 +ATOM 1741 CA ASN A 309 1.521 87.966 80.723 1.00 25.28 +ATOM 1742 C ASN A 309 1.563 88.805 81.992 1.00 24.35 +ATOM 1743 O ASN A 309 2.109 89.907 82.011 1.00 24.01 +ATOM 1744 CB ASN A 309 1.464 88.879 79.503 1.00 29.15 +ATOM 1745 CG ASN A 309 1.753 88.144 78.227 1.00 32.68 +ATOM 1746 OD1 ASN A 309 2.818 87.519 78.081 1.00 35.07 +ATOM 1747 ND2 ASN A 309 0.810 88.199 77.285 1.00 33.77 +ATOM 1748 N LEU A 310 0.951 88.278 83.047 1.00 23.08 +ATOM 1749 CA LEU A 310 0.929 88.940 84.342 1.00 21.65 +ATOM 1750 C LEU A 310 0.387 90.370 84.343 1.00 21.38 +ATOM 1751 O LEU A 310 0.746 91.178 85.196 1.00 20.58 +ATOM 1752 CB LEU A 310 2.334 88.900 84.948 1.00 21.49 +ATOM 1753 CG LEU A 310 2.742 87.616 85.684 1.00 21.20 +ATOM 1754 CD1 LEU A 310 1.992 86.410 85.160 1.00 20.86 +ATOM 1755 CD2 LEU A 310 4.240 87.424 85.550 1.00 21.56 +ATOM 1756 N GLU A 311 -0.453 90.693 83.368 1.00 21.18 +ATOM 1757 CA GLU A 311 -1.081 92.001 83.340 1.00 20.87 +ATOM 1758 C GLU A 311 -2.211 91.719 84.323 1.00 20.55 +ATOM 1759 O GLU A 311 -2.943 90.736 84.161 1.00 19.65 +ATOM 1760 CB GLU A 311 -1.605 92.305 81.940 1.00 22.96 +ATOM 1761 CG GLU A 311 -0.491 92.357 80.915 1.00 27.26 +ATOM 1762 CD GLU A 311 -0.986 92.291 79.477 1.00 30.89 +ATOM 1763 OE1 GLU A 311 -1.760 91.363 79.144 1.00 34.30 +ATOM 1764 OE2 GLU A 311 -0.592 93.157 78.668 1.00 32.81 +ATOM 1765 N TYR A 312 -2.352 92.567 85.338 1.00 19.26 +ATOM 1766 CA TYR A 312 -3.338 92.330 86.383 1.00 18.85 +ATOM 1767 C TYR A 312 -4.286 93.458 86.796 1.00 19.80 +ATOM 1768 O TYR A 312 -4.181 94.601 86.358 1.00 20.05 +ATOM 1769 CB TYR A 312 -2.587 91.869 87.625 1.00 17.70 +ATOM 1770 CG TYR A 312 -1.670 92.951 88.166 1.00 16.10 +ATOM 1771 CD1 TYR A 312 -2.170 93.978 88.971 1.00 15.75 +ATOM 1772 CD2 TYR A 312 -0.325 92.992 87.812 1.00 15.39 +ATOM 1773 CE1 TYR A 312 -1.354 95.020 89.406 1.00 15.64 +ATOM 1774 CE2 TYR A 312 0.502 94.033 88.242 1.00 15.42 +ATOM 1775 CZ TYR A 312 -0.023 95.043 89.039 1.00 15.48 +ATOM 1776 OH TYR A 312 0.776 96.069 89.468 1.00 15.28 +ATOM 1777 N GLN A 313 -5.196 93.092 87.693 1.00 21.32 +ATOM 1778 CA GLN A 313 -6.195 93.987 88.268 1.00 22.33 +ATOM 1779 C GLN A 313 -6.398 93.518 89.701 1.00 20.79 +ATOM 1780 O GLN A 313 -6.397 92.317 89.974 1.00 20.50 +ATOM 1781 CB GLN A 313 -7.526 93.869 87.533 1.00 24.53 +ATOM 1782 CG GLN A 313 -7.513 94.345 86.102 1.00 28.85 +ATOM 1783 CD GLN A 313 -8.892 94.240 85.454 1.00 32.32 +ATOM 1784 OE1 GLN A 313 -9.095 94.683 84.321 1.00 35.54 +ATOM 1785 NE2 GLN A 313 -9.846 93.650 86.171 1.00 33.23 +ATOM 1786 N ILE A 314 -6.588 94.456 90.612 1.00 20.41 +ATOM 1787 CA ILE A 314 -6.789 94.105 92.011 1.00 20.02 +ATOM 1788 C ILE A 314 -8.100 94.679 92.533 1.00 20.42 +ATOM 1789 O ILE A 314 -8.746 95.477 91.866 1.00 21.39 +ATOM 1790 CB ILE A 314 -5.638 94.646 92.862 1.00 18.62 +ATOM 1791 CG1 ILE A 314 -5.457 96.140 92.573 1.00 18.32 +ATOM 1792 CG2 ILE A 314 -4.363 93.871 92.566 1.00 19.58 +ATOM 1793 CD1 ILE A 314 -4.252 96.785 93.248 1.00 16.62 +ATOM 1794 N GLY A 315 -8.485 94.264 93.733 1.00 20.83 +ATOM 1795 CA GLY A 315 -9.700 94.768 94.336 1.00 19.25 +ATOM 1796 C GLY A 315 -10.021 94.028 95.617 1.00 19.79 +ATOM 1797 O GLY A 315 -9.214 93.235 96.107 1.00 17.16 +ATOM 1798 N TYR A 316 -11.203 94.313 96.160 1.00 19.70 +ATOM 1799 CA TYR A 316 -11.698 93.669 97.368 1.00 20.21 +ATOM 1800 C TYR A 316 -13.152 93.275 97.071 1.00 20.84 +ATOM 1801 O TYR A 316 -13.847 93.961 96.313 1.00 22.32 +ATOM 1802 CB TYR A 316 -11.648 94.632 98.572 1.00 20.12 +ATOM 1803 CG TYR A 316 -10.339 94.656 99.356 1.00 20.35 +ATOM 1804 CD1 TYR A 316 -9.189 95.260 98.836 1.00 20.06 +ATOM 1805 CD2 TYR A 316 -10.254 94.076 100.627 1.00 19.46 +ATOM 1806 CE1 TYR A 316 -7.977 95.284 99.573 1.00 20.35 +ATOM 1807 CE2 TYR A 316 -9.056 94.091 101.368 1.00 19.43 +ATOM 1808 CZ TYR A 316 -7.921 94.693 100.839 1.00 19.85 +ATOM 1809 OH TYR A 316 -6.745 94.689 101.567 1.00 16.51 +ATOM 1810 N ILE A 317 -13.606 92.161 97.635 1.00 19.07 +ATOM 1811 CA ILE A 317 -14.982 91.728 97.431 1.00 17.54 +ATOM 1812 C ILE A 317 -15.822 92.749 98.183 1.00 17.68 +ATOM 1813 O ILE A 317 -15.615 92.973 99.382 1.00 18.06 +ATOM 1814 CB ILE A 317 -15.200 90.316 97.993 1.00 16.55 +ATOM 1815 CG1 ILE A 317 -14.337 89.320 97.202 1.00 16.27 +ATOM 1816 CG2 ILE A 317 -16.672 89.961 97.926 1.00 17.05 +ATOM 1817 CD1 ILE A 317 -14.373 87.897 97.716 1.00 14.15 +ATOM 1818 N CYS A 318 -16.769 93.360 97.481 1.00 17.55 +ATOM 1819 CA CYS A 318 -17.585 94.420 98.057 1.00 17.96 +ATOM 1820 C CYS A 318 -18.764 94.046 98.957 1.00 18.60 +ATOM 1821 O CYS A 318 -19.248 94.884 99.721 1.00 19.89 +ATOM 1822 CB CYS A 318 -18.092 95.327 96.937 1.00 19.47 +ATOM 1823 SG CYS A 318 -16.936 95.803 95.605 1.00 20.75 +ATOM 1824 N SER A 319 -19.219 92.800 98.873 1.00 18.21 +ATOM 1825 CA SER A 319 -20.355 92.305 99.649 1.00 17.20 +ATOM 1826 C SER A 319 -20.331 92.575 101.159 1.00 17.35 +ATOM 1827 O SER A 319 -19.296 92.470 101.811 1.00 16.66 +ATOM 1828 CB SER A 319 -20.498 90.794 99.414 1.00 17.64 +ATOM 1829 OG SER A 319 -21.642 90.254 100.053 1.00 16.88 +ATOM 1830 N GLY A 320 -21.493 92.921 101.705 1.00 18.21 +ATOM 1831 CA GLY A 320 -21.608 93.154 103.133 1.00 18.50 +ATOM 1832 C GLY A 320 -21.669 91.816 103.864 1.00 19.31 +ATOM 1833 O GLY A 320 -22.024 91.743 105.043 1.00 18.51 +ATOM 1834 N VAL A 321 -21.356 90.744 103.141 1.00 19.60 +ATOM 1835 CA VAL A 321 -21.334 89.399 103.711 1.00 19.60 +ATOM 1836 C VAL A 321 -19.856 89.131 103.834 1.00 19.42 +ATOM 1837 O VAL A 321 -19.255 88.465 102.998 1.00 19.91 +ATOM 1838 CB VAL A 321 -21.986 88.365 102.768 1.00 19.75 +ATOM 1839 CG1 VAL A 321 -21.932 86.966 103.389 1.00 18.97 +ATOM 1840 CG2 VAL A 321 -23.429 88.766 102.500 1.00 19.10 +ATOM 1841 N PHE A 322 -19.274 89.700 104.879 1.00 19.37 +ATOM 1842 CA PHE A 322 -17.846 89.598 105.126 1.00 19.61 +ATOM 1843 C PHE A 322 -17.342 88.160 105.165 1.00 19.69 +ATOM 1844 O PHE A 322 -17.880 87.321 105.903 1.00 20.23 +ATOM 1845 CB PHE A 322 -17.527 90.345 106.415 1.00 20.52 +ATOM 1846 CG PHE A 322 -18.082 91.744 106.444 1.00 20.88 +ATOM 1847 CD1 PHE A 322 -18.971 92.136 107.449 1.00 21.01 +ATOM 1848 CD2 PHE A 322 -17.722 92.670 105.467 1.00 20.09 +ATOM 1849 CE1 PHE A 322 -19.492 93.436 107.482 1.00 19.61 +ATOM 1850 CE2 PHE A 322 -18.235 93.970 105.486 1.00 19.22 +ATOM 1851 CZ PHE A 322 -19.121 94.353 106.497 1.00 20.99 +ATOM 1852 N GLY A 323 -16.296 87.891 104.383 1.00 18.32 +ATOM 1853 CA GLY A 323 -15.756 86.546 104.296 1.00 18.97 +ATOM 1854 C GLY A 323 -14.558 86.126 105.136 1.00 19.98 +ATOM 1855 O GLY A 323 -14.267 84.940 105.198 1.00 20.66 +ATOM 1856 N ASP A 324 -13.855 87.065 105.767 1.00 18.62 +ATOM 1857 CA ASP A 324 -12.688 86.736 106.595 1.00 17.59 +ATOM 1858 C ASP A 324 -13.148 86.376 108.011 1.00 18.02 +ATOM 1859 O ASP A 324 -14.298 86.609 108.373 1.00 17.87 +ATOM 1860 CB ASP A 324 -11.734 87.952 106.661 1.00 17.36 +ATOM 1861 CG ASP A 324 -10.338 87.596 107.186 1.00 16.53 +ATOM 1862 OD1 ASP A 324 -9.541 88.528 107.482 1.00 17.05 +ATOM 1863 OD2 ASP A 324 -10.036 86.386 107.294 1.00 17.08 +ATOM 1864 N ASN A 325 -12.256 85.784 108.802 1.00 17.90 +ATOM 1865 CA ASN A 325 -12.560 85.450 110.206 1.00 17.88 +ATOM 1866 C ASN A 325 -11.283 85.759 110.999 1.00 18.23 +ATOM 1867 O ASN A 325 -10.237 85.163 110.759 1.00 18.17 +ATOM 1868 CB ASN A 325 -12.985 83.991 110.355 1.00 17.46 +ATOM 1869 CG ASN A 325 -13.128 83.567 111.824 1.00 17.80 +ATOM 1870 OD1 ASN A 325 -12.177 83.105 112.441 1.00 18.59 +ATOM 1871 ND2 ASN A 325 -14.319 83.738 112.381 1.00 16.87 +ATOM 1872 N PRO A 326 -11.381 86.599 112.040 1.00 19.35 +ATOM 1873 CA PRO A 326 -12.549 87.360 112.500 1.00 17.69 +ATOM 1874 C PRO A 326 -13.136 88.329 111.516 1.00 17.38 +ATOM 1875 O PRO A 326 -12.541 88.613 110.480 1.00 16.75 +ATOM 1876 CB PRO A 326 -12.028 88.050 113.753 1.00 17.86 +ATOM 1877 CG PRO A 326 -10.655 88.416 113.352 1.00 18.60 +ATOM 1878 CD PRO A 326 -10.148 87.144 112.658 1.00 18.78 +ATOM 1879 N ARG A 327 -14.305 88.847 111.869 1.00 16.81 +ATOM 1880 CA ARG A 327 -15.038 89.788 111.045 1.00 17.44 +ATOM 1881 C ARG A 327 -16.190 90.311 111.904 1.00 19.31 +ATOM 1882 O ARG A 327 -16.557 89.686 112.899 1.00 21.27 +ATOM 1883 CB ARG A 327 -15.630 89.070 109.828 1.00 15.81 +ATOM 1884 CG ARG A 327 -16.691 88.025 110.195 1.00 12.82 +ATOM 1885 CD ARG A 327 -17.501 87.611 108.971 1.00 12.38 +ATOM 1886 NE ARG A 327 -18.529 86.614 109.271 1.00 10.72 +ATOM 1887 CZ ARG A 327 -18.314 85.303 109.368 1.00 10.11 +ATOM 1888 NH1 ARG A 327 -19.323 84.492 109.644 1.00 12.25 +ATOM 1889 NH2 ARG A 327 -17.106 84.793 109.179 1.00 8.06 +ATOM 1890 N PRO A 328 -16.774 91.460 111.530 1.00 18.97 +ATOM 1891 CA PRO A 328 -17.891 92.032 112.285 1.00 18.79 +ATOM 1892 C PRO A 328 -19.175 91.409 111.754 1.00 19.38 +ATOM 1893 O PRO A 328 -19.152 90.722 110.732 1.00 20.57 +ATOM 1894 CB PRO A 328 -17.809 93.509 111.933 1.00 18.09 +ATOM 1895 CG PRO A 328 -17.420 93.450 110.486 1.00 17.41 +ATOM 1896 CD PRO A 328 -16.319 92.397 110.484 1.00 18.00 +ATOM 1897 N ASN A 329 -20.290 91.636 112.440 1.00 20.00 +ATOM 1898 CA ASN A 329 -21.571 91.116 111.965 1.00 20.64 +ATOM 1899 C ASN A 329 -21.822 91.723 110.585 1.00 20.73 +ATOM 1900 O ASN A 329 -21.322 92.803 110.286 1.00 20.42 +ATOM 1901 CB ASN A 329 -22.710 91.528 112.903 1.00 19.97 +ATOM 1902 CG ASN A 329 -22.623 90.860 114.243 1.00 20.87 +ATOM 1903 OD1 ASN A 329 -22.572 89.639 114.328 1.00 23.63 +ATOM 1904 ND2 ASN A 329 -22.607 91.653 115.305 1.00 21.79 +ATOM 1905 N ASP A 330 -22.604 91.031 109.762 1.00 21.64 +ATOM 1906 CA ASP A 330 -22.921 91.495 108.415 1.00 22.76 +ATOM 1907 C ASP A 330 -23.576 92.872 108.358 1.00 24.07 +ATOM 1908 O ASP A 330 -24.437 93.210 109.181 1.00 24.56 +ATOM 1909 CB ASP A 330 -23.824 90.487 107.705 1.00 23.14 +ATOM 1910 CG ASP A 330 -23.110 89.183 107.395 1.00 24.88 +ATOM 1911 OD1 ASP A 330 -21.887 89.223 107.126 1.00 24.81 +ATOM 1912 OD2 ASP A 330 -23.773 88.121 107.406 1.00 24.33 +ATOM 1913 N GLY A 331 -23.166 93.664 107.373 1.00 23.60 +ATOM 1914 CA GLY A 331 -23.727 94.992 107.231 1.00 23.77 +ATOM 1915 C GLY A 331 -23.452 95.601 105.871 1.00 23.25 +ATOM 1916 O GLY A 331 -23.762 95.012 104.827 1.00 23.19 +ATOM 1917 N THR A 332 -22.869 96.792 105.890 1.00 22.68 +ATOM 1918 CA THR A 332 -22.541 97.493 104.665 1.00 23.15 +ATOM 1919 C THR A 332 -21.078 97.210 104.358 1.00 22.70 +ATOM 1920 O THR A 332 -20.194 97.527 105.155 1.00 21.60 +ATOM 1921 CB THR A 332 -22.750 99.005 104.829 1.00 24.25 +ATOM 1922 OG1 THR A 332 -24.032 99.253 105.427 1.00 25.74 +ATOM 1923 CG2 THR A 332 -22.688 99.697 103.469 1.00 23.98 +ATOM 1924 N GLY A 333 -20.840 96.600 103.203 1.00 21.87 +ATOM 1925 CA GLY A 333 -19.499 96.246 102.820 1.00 22.05 +ATOM 1926 C GLY A 333 -18.740 97.398 102.224 1.00 22.53 +ATOM 1927 O GLY A 333 -19.127 98.551 102.343 1.00 22.76 +ATOM 1928 N SER A 335 -17.632 97.084 101.577 1.00 23.16 +ATOM 1929 CA SER A 335 -16.817 98.110 100.962 1.00 23.73 +ATOM 1930 C SER A 335 -15.968 97.473 99.887 1.00 24.68 +ATOM 1931 O SER A 335 -15.516 96.348 100.021 1.00 24.15 +ATOM 1932 CB SER A 335 -15.903 98.747 101.989 1.00 24.08 +ATOM 1933 OG SER A 335 -14.912 99.531 101.344 1.00 24.52 +ATOM 1934 N CYS A 336 -15.739 98.194 98.806 1.00 25.58 +ATOM 1935 CA CYS A 336 -14.931 97.624 97.750 1.00 26.83 +ATOM 1936 C CYS A 336 -13.448 97.779 98.140 1.00 25.76 +ATOM 1937 O CYS A 336 -12.533 97.430 97.370 1.00 25.96 +ATOM 1938 CB CYS A 336 -15.238 98.297 96.419 1.00 26.49 +ATOM 1939 SG CYS A 336 -16.821 97.838 95.644 1.00 30.14 +ATOM 1940 N GLY A 339 -13.205 98.256 99.361 1.00 24.87 +ATOM 1941 CA GLY A 339 -11.832 98.409 99.810 1.00 23.44 +ATOM 1942 C GLY A 339 -11.706 97.699 101.132 1.00 22.92 +ATOM 1943 O GLY A 339 -12.665 97.072 101.595 1.00 22.02 +ATOM 1944 N PRO A 340 -10.541 97.778 101.768 1.00 21.86 +ATOM 1945 CA PRO A 340 -10.353 97.111 103.056 1.00 21.25 +ATOM 1946 C PRO A 340 -11.332 97.549 104.146 1.00 21.01 +ATOM 1947 O PRO A 340 -11.393 98.735 104.461 1.00 20.98 +ATOM 1948 CB PRO A 340 -8.926 97.507 103.452 1.00 23.51 +ATOM 1949 CG PRO A 340 -8.252 97.842 102.146 1.00 23.94 +ATOM 1950 CD PRO A 340 -9.343 98.541 101.376 1.00 22.57 +ATOM 1951 N VAL A 341 -12.072 96.601 104.725 1.00 20.32 +ATOM 1952 CA VAL A 341 -13.000 96.891 105.817 1.00 20.07 +ATOM 1953 C VAL A 341 -12.180 96.688 107.108 1.00 20.95 +ATOM 1954 O VAL A 341 -11.934 95.563 107.543 1.00 20.69 +ATOM 1955 CB VAL A 341 -14.208 95.918 105.802 1.00 19.87 +ATOM 1956 CG1 VAL A 341 -15.096 96.201 106.987 1.00 17.95 +ATOM 1957 CG2 VAL A 341 -15.008 96.040 104.503 1.00 18.12 +ATOM 1958 N SER A 342 -11.724 97.791 107.683 1.00 21.46 +ATOM 1959 CA SER A 342 -10.889 97.771 108.879 1.00 23.76 +ATOM 1960 C SER A 342 -11.461 97.173 110.180 1.00 24.99 +ATOM 1961 O SER A 342 -10.680 96.775 111.053 1.00 25.80 +ATOM 1962 CB SER A 342 -10.441 99.186 109.190 1.00 23.66 +ATOM 1963 OG SER A 342 -11.453 99.857 109.914 1.00 24.17 +ATOM 1964 N SER A 344 -12.785 97.144 110.344 1.00 25.31 +ATOM 1965 CA SER A 344 -13.343 96.630 111.580 1.00 26.76 +ATOM 1966 C SER A 344 -13.127 95.165 111.768 1.00 25.62 +ATOM 1967 O SER A 344 -13.709 94.363 111.056 1.00 22.72 +ATOM 1968 CB SER A 344 -14.843 96.958 111.707 1.00 28.25 +ATOM 1969 OG SER A 344 -15.642 96.112 110.895 1.00 34.42 +ATOM 1970 N ASN A 345 -12.272 94.827 112.725 1.00 24.63 +ATOM 1971 CA ASN A 345 -12.010 93.440 113.031 1.00 26.30 +ATOM 1972 C ASN A 345 -11.193 92.610 112.076 1.00 26.07 +ATOM 1973 O ASN A 345 -11.021 91.447 112.356 1.00 26.92 +ATOM 1974 CB ASN A 345 -13.327 92.712 113.280 1.00 27.37 +ATOM 1975 CG ASN A 345 -13.370 92.101 114.639 1.00 29.29 +ATOM 1976 OD1 ASN A 345 -12.356 91.595 115.124 1.00 32.43 +ATOM 1977 ND2 ASN A 345 -14.521 92.155 115.282 1.00 27.75 +ATOM 1978 N GLY A 345A -10.656 93.168 110.996 1.00 26.48 +ATOM 1979 CA GLY A 345A -9.904 92.326 110.091 1.00 27.64 +ATOM 1980 C GLY A 345A -8.426 92.280 110.352 1.00 26.92 +ATOM 1981 O GLY A 345A -7.693 91.841 109.483 1.00 27.05 +ATOM 1982 N ALA A 346 -7.993 92.716 111.533 1.00 27.31 +ATOM 1983 CA ALA A 346 -6.567 92.725 111.879 1.00 26.98 +ATOM 1984 C ALA A 346 -5.889 91.351 111.907 1.00 27.96 +ATOM 1985 O ALA A 346 -4.690 91.255 112.161 1.00 31.45 +ATOM 1986 CB ALA A 346 -6.349 93.415 113.209 1.00 27.80 +ATOM 1987 N TYR A 347 -6.648 90.289 111.666 1.00 25.91 +ATOM 1988 CA TYR A 347 -6.098 88.931 111.628 1.00 22.57 +ATOM 1989 C TYR A 347 -6.851 88.261 110.479 1.00 21.14 +ATOM 1990 O TYR A 347 -7.089 88.897 109.446 1.00 23.08 +ATOM 1991 CB TYR A 347 -6.344 88.232 112.979 1.00 23.55 +ATOM 1992 CG TYR A 347 -5.843 86.797 113.137 1.00 24.55 +ATOM 1993 CD1 TYR A 347 -4.536 86.422 112.781 1.00 24.67 +ATOM 1994 CD2 TYR A 347 -6.668 85.823 113.703 1.00 23.67 +ATOM 1995 CE1 TYR A 347 -4.078 85.103 112.995 1.00 22.45 +ATOM 1996 CE2 TYR A 347 -6.219 84.520 113.918 1.00 22.09 +ATOM 1997 CZ TYR A 347 -4.936 84.167 113.564 1.00 22.91 +ATOM 1998 OH TYR A 347 -4.544 82.866 113.762 1.00 23.36 +ATOM 1999 N GLY A 348 -7.248 87.008 110.641 1.00 18.66 +ATOM 2000 CA GLY A 348 -7.969 86.351 109.570 1.00 16.24 +ATOM 2001 C GLY A 348 -7.743 84.856 109.490 1.00 16.40 +ATOM 2002 O GLY A 348 -7.236 84.213 110.418 1.00 15.85 +ATOM 2003 N VAL A 349 -8.129 84.304 108.354 1.00 15.70 +ATOM 2004 CA VAL A 349 -7.990 82.894 108.107 1.00 15.37 +ATOM 2005 C VAL A 349 -7.968 82.736 106.593 1.00 14.98 +ATOM 2006 O VAL A 349 -8.472 83.587 105.874 1.00 15.16 +ATOM 2007 CB VAL A 349 -9.180 82.133 108.727 1.00 15.48 +ATOM 2008 CG1 VAL A 349 -10.460 82.428 107.973 1.00 13.16 +ATOM 2009 CG2 VAL A 349 -8.886 80.660 108.744 1.00 16.69 +ATOM 2010 N LYS A 350 -7.372 81.660 106.102 1.00 14.87 +ATOM 2011 CA LYS A 350 -7.323 81.457 104.667 1.00 14.99 +ATOM 2012 C LYS A 350 -8.708 81.065 104.170 1.00 15.62 +ATOM 2013 O LYS A 350 -9.403 80.265 104.805 1.00 15.88 +ATOM 2014 CB LYS A 350 -6.310 80.377 104.313 1.00 15.03 +ATOM 2015 CG LYS A 350 -6.288 80.008 102.846 1.00 13.81 +ATOM 2016 CD LYS A 350 -5.276 78.915 102.593 1.00 13.09 +ATOM 2017 CE LYS A 350 -5.420 78.312 101.194 1.00 13.49 +ATOM 2018 NZ LYS A 350 -5.164 79.285 100.097 1.00 10.76 +ATOM 2019 N GLY A 351 -9.104 81.655 103.045 1.00 14.40 +ATOM 2020 CA GLY A 351 -10.404 81.377 102.469 1.00 14.36 +ATOM 2021 C GLY A 351 -10.390 81.474 100.955 1.00 15.18 +ATOM 2022 O GLY A 351 -9.333 81.552 100.337 1.00 14.26 +ATOM 2023 N PHE A 352 -11.571 81.490 100.353 1.00 15.37 +ATOM 2024 CA PHE A 352 -11.672 81.549 98.904 1.00 14.45 +ATOM 2025 C PHE A 352 -13.049 82.045 98.481 1.00 14.92 +ATOM 2026 O PHE A 352 -13.913 82.290 99.322 1.00 14.65 +ATOM 2027 CB PHE A 352 -11.484 80.156 98.322 1.00 13.16 +ATOM 2028 CG PHE A 352 -12.622 79.246 98.622 1.00 13.14 +ATOM 2029 CD1 PHE A 352 -12.709 78.609 99.854 1.00 12.11 +ATOM 2030 CD2 PHE A 352 -13.668 79.106 97.714 1.00 13.32 +ATOM 2031 CE1 PHE A 352 -13.822 77.853 100.185 1.00 12.19 +ATOM 2032 CE2 PHE A 352 -14.789 78.348 98.039 1.00 13.05 +ATOM 2033 CZ PHE A 352 -14.865 77.722 99.279 1.00 12.22 +ATOM 2034 N SER A 353 -13.239 82.160 97.167 1.00 15.55 +ATOM 2035 CA SER A 353 -14.500 82.584 96.574 1.00 16.04 +ATOM 2036 C SER A 353 -14.481 82.390 95.073 1.00 16.73 +ATOM 2037 O SER A 353 -13.426 82.464 94.449 1.00 16.21 +ATOM 2038 CB SER A 353 -14.789 84.052 96.878 1.00 16.73 +ATOM 2039 OG SER A 353 -15.147 84.223 98.235 1.00 19.17 +ATOM 2040 N PHE A 354 -15.657 82.135 94.503 1.00 16.68 +ATOM 2041 CA PHE A 354 -15.799 81.951 93.065 1.00 16.50 +ATOM 2042 C PHE A 354 -16.686 83.039 92.499 1.00 18.00 +ATOM 2043 O PHE A 354 -17.836 83.222 92.924 1.00 19.37 +ATOM 2044 CB PHE A 354 -16.399 80.589 92.742 1.00 16.15 +ATOM 2045 CG PHE A 354 -15.484 79.451 93.048 1.00 15.31 +ATOM 2046 CD1 PHE A 354 -15.750 78.593 94.108 1.00 14.31 +ATOM 2047 CD2 PHE A 354 -14.344 79.245 92.288 1.00 14.79 +ATOM 2048 CE1 PHE A 354 -14.893 77.549 94.404 1.00 14.20 +ATOM 2049 CE2 PHE A 354 -13.475 78.197 92.581 1.00 15.71 +ATOM 2050 CZ PHE A 354 -13.753 77.347 93.642 1.00 14.99 +ATOM 2051 N LYS A 355 -16.141 83.765 91.532 1.00 18.07 +ATOM 2052 CA LYS A 355 -16.856 84.859 90.901 1.00 17.35 +ATOM 2053 C LYS A 355 -17.516 84.415 89.610 1.00 17.36 +ATOM 2054 O LYS A 355 -16.887 83.776 88.768 1.00 17.69 +ATOM 2055 CB LYS A 355 -15.885 86.018 90.631 1.00 16.42 +ATOM 2056 CG LYS A 355 -16.346 87.037 89.595 1.00 15.11 +ATOM 2057 CD LYS A 355 -15.317 88.149 89.452 1.00 14.22 +ATOM 2058 CE LYS A 355 -15.320 88.755 88.049 1.00 16.29 +ATOM 2059 NZ LYS A 355 -16.575 89.460 87.673 1.00 13.77 +ATOM 2060 N TYR A 356 -18.799 84.740 89.484 1.00 17.79 +ATOM 2061 CA TYR A 356 -19.584 84.447 88.287 1.00 17.63 +ATOM 2062 C TYR A 356 -20.235 85.777 87.922 1.00 18.41 +ATOM 2063 O TYR A 356 -21.187 86.209 88.588 1.00 18.74 +ATOM 2064 CB TYR A 356 -20.675 83.400 88.564 1.00 15.88 +ATOM 2065 CG TYR A 356 -20.183 81.976 88.738 1.00 13.91 +ATOM 2066 CD1 TYR A 356 -19.750 81.513 89.978 1.00 10.69 +ATOM 2067 CD2 TYR A 356 -20.183 81.081 87.660 1.00 12.71 +ATOM 2068 CE1 TYR A 356 -19.335 80.198 90.149 1.00 10.82 +ATOM 2069 CE2 TYR A 356 -19.769 79.765 87.820 1.00 12.65 +ATOM 2070 CZ TYR A 356 -19.350 79.327 89.068 1.00 12.90 +ATOM 2071 OH TYR A 356 -18.978 78.014 89.243 1.00 14.03 +ATOM 2072 N GLY A 357 -19.724 86.434 86.882 1.00 19.36 +ATOM 2073 CA GLY A 357 -20.276 87.725 86.509 1.00 20.05 +ATOM 2074 C GLY A 357 -20.053 88.635 87.707 1.00 21.09 +ATOM 2075 O GLY A 357 -18.955 88.659 88.261 1.00 21.46 +ATOM 2076 N ASN A 358 -21.079 89.368 88.124 1.00 20.80 +ATOM 2077 CA ASN A 358 -20.940 90.238 89.278 1.00 22.54 +ATOM 2078 C ASN A 358 -21.378 89.538 90.568 1.00 22.99 +ATOM 2079 O ASN A 358 -21.531 90.171 91.607 1.00 23.58 +ATOM 2080 CB ASN A 358 -21.735 91.536 89.073 1.00 25.01 +ATOM 2081 CG ASN A 358 -21.042 92.498 88.111 1.00 26.82 +ATOM 2082 OD1 ASN A 358 -19.871 92.838 88.297 1.00 28.22 +ATOM 2083 ND2 ASN A 358 -21.761 92.945 87.085 1.00 27.32 +ATOM 2084 N GLY A 359 -21.555 88.225 90.511 1.00 22.06 +ATOM 2085 CA GLY A 359 -21.963 87.505 91.701 1.00 22.30 +ATOM 2086 C GLY A 359 -20.807 86.703 92.266 1.00 23.21 +ATOM 2087 O GLY A 359 -19.774 86.555 91.604 1.00 23.36 +ATOM 2088 N VAL A 360 -20.979 86.173 93.475 1.00 21.86 +ATOM 2089 CA VAL A 360 -19.924 85.405 94.114 1.00 21.99 +ATOM 2090 C VAL A 360 -20.412 84.341 95.073 1.00 20.80 +ATOM 2091 O VAL A 360 -21.414 84.522 95.763 1.00 20.56 +ATOM 2092 CB VAL A 360 -18.971 86.317 94.917 1.00 22.95 +ATOM 2093 CG1 VAL A 360 -18.205 87.205 93.986 1.00 24.78 +ATOM 2094 CG2 VAL A 360 -19.767 87.155 95.908 1.00 22.26 +ATOM 2095 N TRP A 361 -19.684 83.229 95.107 1.00 19.54 +ATOM 2096 CA TRP A 361 -19.991 82.131 96.010 1.00 18.88 +ATOM 2097 C TRP A 361 -18.974 82.279 97.116 1.00 19.04 +ATOM 2098 O TRP A 361 -17.767 82.110 96.896 1.00 18.81 +ATOM 2099 CB TRP A 361 -19.806 80.768 95.337 1.00 18.21 +ATOM 2100 CG TRP A 361 -21.062 80.161 94.794 1.00 17.52 +ATOM 2101 CD1 TRP A 361 -21.414 80.043 93.480 1.00 16.94 +ATOM 2102 CD2 TRP A 361 -22.124 79.560 95.550 1.00 17.62 +ATOM 2103 NE1 TRP A 361 -22.626 79.402 93.368 1.00 18.16 +ATOM 2104 CE2 TRP A 361 -23.085 79.092 94.624 1.00 16.82 +ATOM 2105 CE3 TRP A 361 -22.355 79.366 96.921 1.00 16.66 +ATOM 2106 CZ2 TRP A 361 -24.260 78.446 95.019 1.00 16.40 +ATOM 2107 CZ3 TRP A 361 -23.526 78.723 97.319 1.00 16.40 +ATOM 2108 CH2 TRP A 361 -24.463 78.269 96.367 1.00 17.66 +ATOM 2109 N ILE A 362 -19.465 82.607 98.302 1.00 18.01 +ATOM 2110 CA ILE A 362 -18.609 82.803 99.450 1.00 17.31 +ATOM 2111 C ILE A 362 -18.573 81.591 100.374 1.00 17.78 +ATOM 2112 O ILE A 362 -19.602 80.965 100.652 1.00 17.57 +ATOM 2113 CB ILE A 362 -19.085 84.019 100.273 1.00 18.22 +ATOM 2114 CG1 ILE A 362 -19.014 85.282 99.414 1.00 18.46 +ATOM 2115 CG2 ILE A 362 -18.245 84.166 101.550 1.00 16.51 +ATOM 2116 CD1 ILE A 362 -19.620 86.499 100.085 1.00 18.07 +ATOM 2117 N GLY A 363 -17.370 81.268 100.831 1.00 16.15 +ATOM 2118 CA GLY A 363 -17.188 80.185 101.769 1.00 16.14 +ATOM 2119 C GLY A 363 -16.712 80.914 103.012 1.00 17.41 +ATOM 2120 O GLY A 363 -15.858 81.798 102.912 1.00 16.46 +ATOM 2121 N ARG A 364 -17.259 80.589 104.178 1.00 16.71 +ATOM 2122 CA ARG A 364 -16.833 81.281 105.394 1.00 17.26 +ATOM 2123 C ARG A 364 -17.226 80.521 106.646 1.00 17.00 +ATOM 2124 O ARG A 364 -18.003 79.566 106.586 1.00 18.76 +ATOM 2125 CB ARG A 364 -17.432 82.699 105.450 1.00 16.21 +ATOM 2126 CG ARG A 364 -18.921 82.775 105.849 1.00 16.52 +ATOM 2127 CD ARG A 364 -19.416 84.229 105.928 1.00 15.76 +ATOM 2128 NE ARG A 364 -20.720 84.374 106.579 1.00 14.66 +ATOM 2129 CZ ARG A 364 -21.350 85.535 106.751 1.00 13.48 +ATOM 2130 NH1 ARG A 364 -22.529 85.572 107.350 1.00 14.00 +ATOM 2131 NH2 ARG A 364 -20.810 86.666 106.321 1.00 14.41 +ATOM 2132 N THR A 365 -16.680 80.939 107.779 1.00 16.03 +ATOM 2133 CA THR A 365 -17.007 80.300 109.044 1.00 17.30 +ATOM 2134 C THR A 365 -18.397 80.783 109.470 1.00 18.28 +ATOM 2135 O THR A 365 -18.897 81.776 108.945 1.00 18.88 +ATOM 2136 CB THR A 365 -15.998 80.689 110.143 1.00 17.53 +ATOM 2137 OG1 THR A 365 -16.223 82.049 110.543 1.00 16.36 +ATOM 2138 CG2 THR A 365 -14.575 80.529 109.635 1.00 16.05 +ATOM 2139 N LYS A 366 -19.037 80.091 110.404 1.00 18.58 +ATOM 2140 CA LYS A 366 -20.348 80.550 110.847 1.00 20.02 +ATOM 2141 C LYS A 366 -20.165 81.584 111.965 1.00 20.57 +ATOM 2142 O LYS A 366 -20.937 82.537 112.079 1.00 18.75 +ATOM 2143 CB LYS A 366 -21.194 79.372 111.315 1.00 18.77 +ATOM 2144 CG LYS A 366 -21.414 78.362 110.208 1.00 19.49 +ATOM 2145 CD LYS A 366 -22.274 77.202 110.654 1.00 18.15 +ATOM 2146 CE LYS A 366 -23.719 77.473 110.345 1.00 17.50 +ATOM 2147 NZ LYS A 366 -23.896 77.682 108.893 1.00 16.39 +ATOM 2148 N SER A 367 -19.114 81.397 112.759 1.00 20.98 +ATOM 2149 CA SER A 367 -18.784 82.299 113.860 1.00 22.08 +ATOM 2150 C SER A 367 -17.952 83.507 113.380 1.00 22.63 +ATOM 2151 O SER A 367 -17.135 83.386 112.468 1.00 21.90 +ATOM 2152 CB SER A 367 -18.007 81.530 114.924 1.00 21.15 +ATOM 2153 OG SER A 367 -17.290 82.420 115.755 1.00 21.94 +ATOM 2154 N THR A 368 -18.162 84.665 114.001 1.00 23.94 +ATOM 2155 CA THR A 368 -17.437 85.882 113.630 1.00 25.04 +ATOM 2156 C THR A 368 -16.163 86.104 114.442 1.00 25.04 +ATOM 2157 O THR A 368 -15.361 86.964 114.082 1.00 26.11 +ATOM 2158 CB THR A 368 -18.297 87.131 113.832 1.00 26.77 +ATOM 2159 OG1 THR A 368 -19.474 87.041 113.020 1.00 20.00 +ATOM 2160 CG2 THR A 368 -17.523 88.380 113.440 1.00 20.00 +ATOM 2161 N ASN A 369 -15.977 85.339 115.521 1.00 24.44 +ATOM 2162 CA ASN A 369 -14.793 85.479 116.380 1.00 25.41 +ATOM 2163 C ASN A 369 -13.765 84.360 116.276 1.00 23.88 +ATOM 2164 O ASN A 369 -12.564 84.612 116.291 1.00 23.12 +ATOM 2165 CB ASN A 369 -15.204 85.591 117.843 1.00 29.16 +ATOM 2166 CG ASN A 369 -16.244 86.646 118.063 1.00 34.71 +ATOM 2167 OD1 ASN A 369 -16.052 87.806 117.686 1.00 37.48 +ATOM 2168 ND2 ASN A 369 -17.367 86.259 118.674 1.00 37.22 +ATOM 2169 N SER A 370 -14.234 83.123 116.205 1.00 22.46 +ATOM 2170 CA SER A 370 -13.324 81.999 116.112 1.00 21.00 +ATOM 2171 C SER A 370 -13.631 81.137 114.906 1.00 20.02 +ATOM 2172 O SER A 370 -14.705 81.231 114.318 1.00 18.40 +ATOM 2173 CB SER A 370 -13.389 81.152 117.389 1.00 21.86 +ATOM 2174 OG SER A 370 -14.710 80.701 117.648 1.00 23.12 +ATOM 2175 N ARG A 371 -12.669 80.299 114.547 1.00 19.56 +ATOM 2176 CA ARG A 371 -12.810 79.400 113.413 1.00 20.43 +ATOM 2177 C ARG A 371 -13.759 78.268 113.777 1.00 19.31 +ATOM 2178 O ARG A 371 -13.341 77.144 114.027 1.00 19.12 +ATOM 2179 CB ARG A 371 -11.430 78.863 113.010 1.00 21.01 +ATOM 2180 CG ARG A 371 -10.497 79.989 112.569 1.00 20.86 +ATOM 2181 CD ARG A 371 -9.024 79.597 112.481 1.00 19.50 +ATOM 2182 NE ARG A 371 -8.222 80.763 112.104 1.00 20.75 +ATOM 2183 CZ ARG A 371 -6.934 80.732 111.770 1.00 20.82 +ATOM 2184 NH1 ARG A 371 -6.306 81.856 111.441 1.00 18.53 +ATOM 2185 NH2 ARG A 371 -6.276 79.583 111.764 1.00 20.25 +ATOM 2186 N SER A 372 -15.046 78.595 113.798 1.00 19.77 +ATOM 2187 CA SER A 372 -16.097 77.648 114.139 1.00 19.47 +ATOM 2188 C SER A 372 -17.141 77.622 113.028 1.00 19.51 +ATOM 2189 O SER A 372 -17.637 78.668 112.608 1.00 19.90 +ATOM 2190 CB SER A 372 -16.766 78.057 115.461 1.00 19.23 +ATOM 2191 OG SER A 372 -15.811 78.299 116.481 1.00 17.84 +ATOM 2192 N GLY A 373 -17.470 76.420 112.563 1.00 20.20 +ATOM 2193 CA GLY A 373 -18.451 76.255 111.500 1.00 18.97 +ATOM 2194 C GLY A 373 -18.023 76.754 110.129 1.00 18.45 +ATOM 2195 O GLY A 373 -17.066 77.525 110.001 1.00 17.82 +ATOM 2196 N PHE A 374 -18.735 76.308 109.097 1.00 17.25 +ATOM 2197 CA PHE A 374 -18.453 76.728 107.732 1.00 17.01 +ATOM 2198 C PHE A 374 -19.753 76.709 106.944 1.00 18.23 +ATOM 2199 O PHE A 374 -20.679 75.974 107.289 1.00 19.08 +ATOM 2200 CB PHE A 374 -17.445 75.800 107.060 1.00 14.96 +ATOM 2201 CG PHE A 374 -16.757 76.421 105.873 1.00 13.34 +ATOM 2202 CD1 PHE A 374 -15.686 77.293 106.053 1.00 12.93 +ATOM 2203 CD2 PHE A 374 -17.178 76.145 104.578 1.00 11.41 +ATOM 2204 CE1 PHE A 374 -15.043 77.881 104.961 1.00 10.74 +ATOM 2205 CE2 PHE A 374 -16.540 76.730 103.481 1.00 12.26 +ATOM 2206 CZ PHE A 374 -15.472 77.598 103.675 1.00 11.36 +ATOM 2207 N GLU A 375 -19.818 77.513 105.886 1.00 17.29 +ATOM 2208 CA GLU A 375 -21.020 77.599 105.070 1.00 17.11 +ATOM 2209 C GLU A 375 -20.731 78.258 103.727 1.00 16.87 +ATOM 2210 O GLU A 375 -19.817 79.071 103.607 1.00 16.61 +ATOM 2211 CB GLU A 375 -22.093 78.414 105.810 1.00 18.02 +ATOM 2212 CG GLU A 375 -21.591 79.774 106.307 1.00 20.11 +ATOM 2213 CD GLU A 375 -22.650 80.579 107.071 1.00 23.46 +ATOM 2214 OE1 GLU A 375 -23.403 79.971 107.863 1.00 26.01 +ATOM 2215 OE2 GLU A 375 -22.723 81.822 106.899 1.00 22.82 +ATOM 2216 N MET A 376 -21.512 77.889 102.718 1.00 16.51 +ATOM 2217 CA MET A 376 -21.386 78.466 101.386 1.00 17.27 +ATOM 2218 C MET A 376 -22.552 79.447 101.205 1.00 17.58 +ATOM 2219 O MET A 376 -23.679 79.158 101.610 1.00 16.79 +ATOM 2220 CB MET A 376 -21.448 77.372 100.316 1.00 16.90 +ATOM 2221 CG MET A 376 -20.255 76.424 100.317 1.00 17.16 +ATOM 2222 SD MET A 376 -18.682 77.303 100.204 1.00 19.89 +ATOM 2223 CE MET A 376 -18.813 78.054 98.585 1.00 17.28 +ATOM 2224 N ILE A 377 -22.279 80.607 100.612 1.00 17.28 +ATOM 2225 CA ILE A 377 -23.316 81.611 100.401 1.00 16.99 +ATOM 2226 C ILE A 377 -23.293 82.184 98.986 1.00 18.02 +ATOM 2227 O ILE A 377 -22.231 82.504 98.444 1.00 17.17 +ATOM 2228 CB ILE A 377 -23.165 82.779 101.396 1.00 16.83 +ATOM 2229 CG1 ILE A 377 -23.392 82.287 102.825 1.00 16.16 +ATOM 2230 CG2 ILE A 377 -24.151 83.894 101.050 1.00 18.81 +ATOM 2231 CD1 ILE A 377 -23.141 83.341 103.874 1.00 13.34 +ATOM 2232 N TRP A 378 -24.469 82.305 98.382 1.00 18.45 +ATOM 2233 CA TRP A 378 -24.555 82.861 97.044 1.00 20.48 +ATOM 2234 C TRP A 378 -25.119 84.275 97.104 1.00 21.94 +ATOM 2235 O TRP A 378 -26.285 84.491 97.459 1.00 21.36 +ATOM 2236 CB TRP A 378 -25.430 81.998 96.138 1.00 21.42 +ATOM 2237 CG TRP A 378 -25.725 82.649 94.793 1.00 23.28 +ATOM 2238 CD1 TRP A 378 -26.956 82.961 94.281 1.00 22.77 +ATOM 2239 CD2 TRP A 378 -24.768 83.055 93.802 1.00 23.00 +ATOM 2240 NE1 TRP A 378 -26.823 83.532 93.035 1.00 22.79 +ATOM 2241 CE2 TRP A 378 -25.493 83.601 92.718 1.00 22.54 +ATOM 2242 CE3 TRP A 378 -23.371 83.009 93.726 1.00 22.97 +ATOM 2243 CZ2 TRP A 378 -24.869 84.097 91.572 1.00 23.09 +ATOM 2244 CZ3 TRP A 378 -22.748 83.501 92.586 1.00 24.01 +ATOM 2245 CH2 TRP A 378 -23.499 84.039 91.522 1.00 22.75 +ATOM 2246 N ASP A 379 -24.262 85.234 96.777 1.00 23.03 +ATOM 2247 CA ASP A 379 -24.643 86.634 96.757 1.00 25.10 +ATOM 2248 C ASP A 379 -24.522 87.115 95.315 1.00 25.99 +ATOM 2249 O ASP A 379 -23.435 87.498 94.874 1.00 26.66 +ATOM 2250 CB ASP A 379 -23.717 87.466 97.656 1.00 22.53 +ATOM 2251 CG ASP A 379 -24.152 88.918 97.748 1.00 22.46 +ATOM 2252 OD1 ASP A 379 -24.725 89.432 96.765 1.00 20.39 +ATOM 2253 OD2 ASP A 379 -23.918 89.553 98.799 1.00 22.74 +ATOM 2254 N PRO A 380 -25.625 87.069 94.549 1.00 27.82 +ATOM 2255 CA PRO A 380 -25.507 87.539 93.164 1.00 28.66 +ATOM 2256 C PRO A 380 -25.094 88.994 93.257 1.00 29.52 +ATOM 2257 O PRO A 380 -25.316 89.629 94.284 1.00 30.88 +ATOM 2258 CB PRO A 380 -26.920 87.357 92.614 1.00 28.53 +ATOM 2259 CG PRO A 380 -27.790 87.573 93.827 1.00 27.91 +ATOM 2260 CD PRO A 380 -27.033 86.811 94.907 1.00 28.73 +ATOM 2261 N ASN A 381 -24.471 89.531 92.223 1.00 31.17 +ATOM 2262 CA ASN A 381 -24.070 90.937 92.300 1.00 33.92 +ATOM 2263 C ASN A 381 -23.488 91.277 93.702 1.00 32.09 +ATOM 2264 O ASN A 381 -23.840 92.293 94.299 1.00 32.39 +ATOM 2265 CB ASN A 381 -25.293 91.827 92.005 1.00 37.66 +ATOM 2266 CG ASN A 381 -26.079 91.369 90.755 1.00 41.64 +ATOM 2267 OD1 ASN A 381 -25.584 91.454 89.620 1.00 41.48 +ATOM 2268 ND2 ASN A 381 -27.311 90.879 90.971 1.00 41.73 +ATOM 2269 N GLY A 382 -22.612 90.414 94.219 1.00 30.94 +ATOM 2270 CA GLY A 382 -22.005 90.634 95.529 1.00 27.65 +ATOM 2271 C GLY A 382 -20.504 90.895 95.445 1.00 26.05 +ATOM 2272 O GLY A 382 -19.836 91.230 96.431 1.00 23.55 +ATOM 2273 N TRP A 383 -19.970 90.734 94.244 1.00 24.16 +ATOM 2274 CA TRP A 383 -18.559 90.964 93.997 1.00 23.00 +ATOM 2275 C TRP A 383 -18.319 92.451 93.827 1.00 22.56 +ATOM 2276 O TRP A 383 -17.254 92.963 94.155 1.00 22.09 +ATOM 2277 CB TRP A 383 -18.150 90.231 92.722 1.00 22.40 +ATOM 2278 CG TRP A 383 -16.741 90.455 92.284 1.00 21.43 +ATOM 2279 CD1 TRP A 383 -16.274 91.473 91.506 1.00 20.45 +ATOM 2280 CD2 TRP A 383 -15.618 89.614 92.563 1.00 21.19 +ATOM 2281 NE1 TRP A 383 -14.929 91.314 91.280 1.00 21.67 +ATOM 2282 CE2 TRP A 383 -14.501 90.180 91.920 1.00 20.79 +ATOM 2283 CE3 TRP A 383 -15.447 88.432 93.297 1.00 21.63 +ATOM 2284 CZ2 TRP A 383 -13.231 89.606 91.984 1.00 21.65 +ATOM 2285 CZ3 TRP A 383 -14.182 87.859 93.360 1.00 20.44 +ATOM 2286 CH2 TRP A 383 -13.093 88.448 92.709 1.00 20.69 +ATOM 2287 N THR A 384 -19.333 93.140 93.318 1.00 21.94 +ATOM 2288 CA THR A 384 -19.236 94.565 93.055 1.00 22.23 +ATOM 2289 C THR A 384 -20.159 95.440 93.899 1.00 22.32 +ATOM 2290 O THR A 384 -19.947 96.641 93.991 1.00 22.24 +ATOM 2291 CB THR A 384 -19.558 94.847 91.579 1.00 21.59 +ATOM 2292 OG1 THR A 384 -20.754 94.143 91.231 1.00 20.16 +ATOM 2293 CG2 THR A 384 -18.421 94.402 90.671 1.00 19.60 +ATOM 2294 N GLU A 385 -21.181 94.851 94.506 1.00 23.62 +ATOM 2295 CA GLU A 385 -22.115 95.644 95.292 1.00 25.01 +ATOM 2296 C GLU A 385 -21.858 95.563 96.781 1.00 26.30 +ATOM 2297 O GLU A 385 -21.159 94.672 97.260 1.00 26.55 +ATOM 2298 CB GLU A 385 -23.562 95.232 94.999 1.00 25.35 +ATOM 2299 CG GLU A 385 -24.023 95.463 93.556 1.00 27.40 +ATOM 2300 CD GLU A 385 -23.856 96.914 93.080 1.00 30.80 +ATOM 2301 OE1 GLU A 385 -24.180 97.847 93.853 1.00 29.91 +ATOM 2302 OE2 GLU A 385 -23.413 97.117 91.921 1.00 31.33 +ATOM 2303 N THR A 386 -22.453 96.502 97.508 1.00 27.74 +ATOM 2304 CA THR A 386 -22.289 96.590 98.947 1.00 29.05 +ATOM 2305 C THR A 386 -23.589 96.456 99.735 1.00 30.25 +ATOM 2306 O THR A 386 -24.239 97.451 100.056 1.00 34.71 +ATOM 2307 CB THR A 386 -21.655 97.928 99.322 1.00 29.05 +ATOM 2308 OG1 THR A 386 -20.395 98.062 98.656 1.00 27.18 +ATOM 2309 CG2 THR A 386 -21.457 98.010 100.821 1.00 29.32 +ATOM 2310 N ASP A 387 -23.983 95.230 100.024 1.00 29.28 +ATOM 2311 CA ASP A 387 -25.172 94.985 100.816 1.00 28.96 +ATOM 2312 C ASP A 387 -24.963 93.630 101.430 1.00 28.64 +ATOM 2313 O ASP A 387 -24.129 92.852 100.960 1.00 28.71 +ATOM 2314 CB ASP A 387 -26.468 95.008 99.983 1.00 29.47 +ATOM 2315 CG ASP A 387 -26.395 94.147 98.731 1.00 29.65 +ATOM 2316 OD1 ASP A 387 -25.874 94.642 97.712 1.00 30.59 +ATOM 2317 OD2 ASP A 387 -26.853 92.979 98.760 1.00 30.66 +ATOM 2318 N SER A 388 -25.702 93.360 102.495 1.00 27.98 +ATOM 2319 CA SER A 388 -25.588 92.098 103.195 1.00 27.22 +ATOM 2320 C SER A 388 -26.644 91.074 102.768 1.00 27.02 +ATOM 2321 O SER A 388 -26.740 90.004 103.367 1.00 27.70 +ATOM 2322 CB SER A 388 -25.681 92.352 104.704 1.00 27.92 +ATOM 2323 OG SER A 388 -26.754 93.233 105.015 1.00 27.45 +ATOM 2324 N SER A 389 -27.426 91.382 101.736 1.00 25.64 +ATOM 2325 CA SER A 389 -28.467 90.451 101.307 1.00 25.38 +ATOM 2326 C SER A 389 -27.934 89.419 100.333 1.00 25.36 +ATOM 2327 O SER A 389 -27.038 89.706 99.528 1.00 24.91 +ATOM 2328 CB SER A 389 -29.629 91.194 100.664 1.00 23.52 +ATOM 2329 OG SER A 389 -29.244 91.698 99.408 1.00 24.74 +ATOM 2330 N PHE A 390 -28.508 88.220 100.410 1.00 26.20 +ATOM 2331 CA PHE A 390 -28.098 87.098 99.566 1.00 25.73 +ATOM 2332 C PHE A 390 -29.245 86.106 99.311 1.00 24.88 +ATOM 2333 O PHE A 390 -30.221 86.028 100.071 1.00 23.45 +ATOM 2334 CB PHE A 390 -26.911 86.376 100.217 1.00 24.88 +ATOM 2335 CG PHE A 390 -27.226 85.785 101.564 1.00 23.57 +ATOM 2336 CD1 PHE A 390 -27.718 84.486 101.674 1.00 24.15 +ATOM 2337 CD2 PHE A 390 -27.039 86.529 102.723 1.00 25.15 +ATOM 2338 CE1 PHE A 390 -28.018 83.930 102.924 1.00 24.96 +ATOM 2339 CE2 PHE A 390 -27.334 85.984 103.984 1.00 26.73 +ATOM 2340 CZ PHE A 390 -27.826 84.677 104.081 1.00 24.97 +ATOM 2341 N SER A 391 -29.085 85.326 98.249 1.00 23.74 +ATOM 2342 CA SER A 391 -30.091 84.367 97.822 1.00 23.38 +ATOM 2343 C SER A 391 -30.016 82.958 98.429 1.00 23.12 +ATOM 2344 O SER A 391 -31.024 82.427 98.907 1.00 22.06 +ATOM 2345 CB SER A 391 -30.026 84.268 96.303 1.00 22.43 +ATOM 2346 OG SER A 391 -29.789 85.550 95.754 1.00 21.66 +ATOM 2347 N VAL A 392 -28.830 82.354 98.409 1.00 21.42 +ATOM 2348 CA VAL A 392 -28.683 81.001 98.925 1.00 20.22 +ATOM 2349 C VAL A 392 -27.637 80.794 100.010 1.00 19.40 +ATOM 2350 O VAL A 392 -26.591 81.439 100.018 1.00 19.56 +ATOM 2351 CB VAL A 392 -28.352 80.023 97.781 1.00 21.10 +ATOM 2352 CG1 VAL A 392 -28.441 78.588 98.286 1.00 18.94 +ATOM 2353 CG2 VAL A 392 -29.299 80.253 96.605 1.00 20.21 +ATOM 2354 N LYS A 394 -27.929 79.881 100.927 1.00 18.02 +ATOM 2355 CA LYS A 394 -26.998 79.549 101.999 1.00 17.24 +ATOM 2356 C LYS A 394 -27.033 78.041 102.230 1.00 16.32 +ATOM 2357 O LYS A 394 -28.103 77.467 102.457 1.00 15.40 +ATOM 2358 CB LYS A 394 -27.370 80.253 103.299 1.00 17.19 +ATOM 2359 CG LYS A 394 -26.420 79.937 104.451 1.00 18.22 +ATOM 2360 CD LYS A 394 -27.149 79.953 105.788 1.00 19.98 +ATOM 2361 CE LYS A 394 -26.251 80.424 106.912 1.00 23.00 +ATOM 2362 NZ LYS A 394 -25.883 81.867 106.789 1.00 23.25 +ATOM 2363 N GLN A 395 -25.867 77.406 102.155 1.00 13.81 +ATOM 2364 CA GLN A 395 -25.763 75.974 102.370 1.00 14.24 +ATOM 2365 C GLN A 395 -24.806 75.675 103.526 1.00 16.17 +ATOM 2366 O GLN A 395 -23.635 76.071 103.503 1.00 17.26 +ATOM 2367 CB GLN A 395 -25.280 75.271 101.098 1.00 13.66 +ATOM 2368 CG GLN A 395 -25.152 73.744 101.254 1.00 15.01 +ATOM 2369 CD GLN A 395 -24.640 73.043 99.996 1.00 16.19 +ATOM 2370 OE1 GLN A 395 -24.460 71.823 99.979 1.00 14.84 +ATOM 2371 NE2 GLN A 395 -24.404 73.813 98.942 1.00 16.90 +ATOM 2372 N ASP A 396 -25.310 74.987 104.544 1.00 14.76 +ATOM 2373 CA ASP A 396 -24.484 74.639 105.687 1.00 16.00 +ATOM 2374 C ASP A 396 -23.492 73.511 105.373 1.00 14.21 +ATOM 2375 O ASP A 396 -23.843 72.539 104.709 1.00 12.90 +ATOM 2376 CB ASP A 396 -25.366 74.222 106.875 1.00 16.22 +ATOM 2377 CG ASP A 396 -26.249 75.352 107.377 1.00 19.23 +ATOM 2378 OD1 ASP A 396 -25.751 76.490 107.522 1.00 20.39 +ATOM 2379 OD2 ASP A 396 -27.445 75.103 107.643 1.00 21.70 +ATOM 2380 N ILE A 397 -22.255 73.656 105.851 1.00 13.45 +ATOM 2381 CA ILE A 397 -21.218 72.634 105.672 1.00 13.78 +ATOM 2382 C ILE A 397 -20.717 72.137 107.047 1.00 14.51 +ATOM 2383 O ILE A 397 -20.451 70.943 107.227 1.00 14.47 +ATOM 2384 CB ILE A 397 -20.024 73.150 104.802 1.00 12.58 +ATOM 2385 CG1 ILE A 397 -20.328 72.952 103.312 1.00 15.62 +ATOM 2386 CG2 ILE A 397 -18.764 72.332 105.069 1.00 12.38 +ATOM 2387 CD1 ILE A 397 -21.444 73.776 102.772 1.00 15.01 +ATOM 2388 N VAL A 398 -20.594 73.046 108.016 1.00 14.52 +ATOM 2389 CA VAL A 398 -20.164 72.671 109.370 1.00 14.74 +ATOM 2390 C VAL A 398 -20.878 73.519 110.431 1.00 16.54 +ATOM 2391 O VAL A 398 -20.809 74.750 110.404 1.00 17.28 +ATOM 2392 CB VAL A 398 -18.647 72.827 109.554 1.00 13.20 +ATOM 2393 CG1 VAL A 398 -18.256 72.429 110.957 1.00 12.01 +ATOM 2394 CG2 VAL A 398 -17.908 71.965 108.548 1.00 13.46 +ATOM 2395 N ALA A 399 -21.570 72.850 111.353 1.00 17.31 +ATOM 2396 CA ALA A 399 -22.307 73.517 112.428 1.00 17.17 +ATOM 2397 C ALA A 399 -21.398 74.456 113.212 1.00 17.20 +ATOM 2398 O ALA A 399 -20.196 74.218 113.302 1.00 16.43 +ATOM 2399 CB ALA A 399 -22.925 72.477 113.363 1.00 14.81 +ATOM 2400 N ILE A 400 -21.979 75.523 113.765 1.00 18.91 +ATOM 2401 CA ILE A 400 -21.226 76.518 114.544 1.00 20.97 +ATOM 2402 C ILE A 400 -20.646 75.893 115.804 1.00 19.83 +ATOM 2403 O ILE A 400 -19.727 76.439 116.412 1.00 19.41 +ATOM 2404 CB ILE A 400 -22.115 77.689 115.035 1.00 23.87 +ATOM 2405 CG1 ILE A 400 -23.182 78.022 113.992 1.00 28.82 +ATOM 2406 CG2 ILE A 400 -21.250 78.934 115.288 1.00 23.79 +ATOM 2407 CD1 ILE A 400 -24.363 78.859 114.551 1.00 29.99 +ATOM 2408 N THR A 401 -21.198 74.749 116.190 1.00 18.56 +ATOM 2409 CA THR A 401 -20.767 74.070 117.391 1.00 18.92 +ATOM 2410 C THR A 401 -19.490 73.294 117.193 1.00 17.90 +ATOM 2411 O THR A 401 -18.941 72.747 118.139 1.00 18.07 +ATOM 2412 CB THR A 401 -21.857 73.112 117.883 1.00 20.78 +ATOM 2413 OG1 THR A 401 -22.275 72.277 116.798 1.00 20.47 +ATOM 2414 CG2 THR A 401 -23.053 73.895 118.407 1.00 20.29 +ATOM 2415 N ASP A 402 -19.001 73.256 115.965 1.00 17.82 +ATOM 2416 CA ASP A 402 -17.785 72.513 115.689 1.00 17.45 +ATOM 2417 C ASP A 402 -16.689 73.316 115.023 1.00 16.37 +ATOM 2418 O ASP A 402 -16.954 74.279 114.305 1.00 17.47 +ATOM 2419 CB ASP A 402 -18.139 71.285 114.870 1.00 17.96 +ATOM 2420 CG ASP A 402 -18.921 70.279 115.681 1.00 20.07 +ATOM 2421 OD1 ASP A 402 -18.271 69.460 116.370 1.00 20.54 +ATOM 2422 OD2 ASP A 402 -20.178 70.323 115.653 1.00 19.90 +ATOM 2423 N TRP A 403 -15.453 72.908 115.279 1.00 14.88 +ATOM 2424 CA TRP A 403 -14.293 73.586 114.737 1.00 15.72 +ATOM 2425 C TRP A 403 -14.077 73.386 113.241 1.00 17.76 +ATOM 2426 O TRP A 403 -14.202 72.271 112.706 1.00 18.36 +ATOM 2427 CB TRP A 403 -13.029 73.145 115.478 1.00 16.15 +ATOM 2428 CG TRP A 403 -13.113 73.308 116.964 1.00 18.77 +ATOM 2429 CD1 TRP A 403 -13.287 72.320 117.887 1.00 17.90 +ATOM 2430 CD2 TRP A 403 -13.094 74.543 117.696 1.00 19.96 +ATOM 2431 NE1 TRP A 403 -13.382 72.860 119.150 1.00 20.05 +ATOM 2432 CE2 TRP A 403 -13.267 74.221 119.063 1.00 19.72 +ATOM 2433 CE3 TRP A 403 -12.946 75.890 117.330 1.00 19.41 +ATOM 2434 CZ2 TRP A 403 -13.302 75.197 120.068 1.00 19.59 +ATOM 2435 CZ3 TRP A 403 -12.980 76.863 118.333 1.00 19.84 +ATOM 2436 CH2 TRP A 403 -13.157 76.508 119.685 1.00 18.77 +ATOM 2437 N SER A 404 -13.765 74.488 112.570 1.00 16.29 +ATOM 2438 CA SER A 404 -13.456 74.456 111.149 1.00 15.92 +ATOM 2439 C SER A 404 -12.042 75.030 111.084 1.00 14.65 +ATOM 2440 O SER A 404 -11.235 74.763 111.967 1.00 13.58 +ATOM 2441 CB SER A 404 -14.453 75.295 110.329 1.00 15.61 +ATOM 2442 OG SER A 404 -14.533 76.636 110.779 1.00 17.60 +ATOM 2443 N GLY A 405 -11.738 75.818 110.063 1.00 13.68 +ATOM 2444 CA GLY A 405 -10.402 76.374 109.956 1.00 13.17 +ATOM 2445 C GLY A 405 -10.127 76.855 108.552 1.00 12.57 +ATOM 2446 O GLY A 405 -10.981 77.489 107.940 1.00 13.33 +ATOM 2447 N TYR A 406 -8.941 76.567 108.032 1.00 11.64 +ATOM 2448 CA TYR A 406 -8.609 76.989 106.672 1.00 12.73 +ATOM 2449 C TYR A 406 -9.568 76.375 105.670 1.00 12.91 +ATOM 2450 O TYR A 406 -10.262 75.416 105.969 1.00 15.00 +ATOM 2451 CB TYR A 406 -7.188 76.562 106.297 1.00 10.81 +ATOM 2452 CG TYR A 406 -6.108 77.538 106.686 1.00 10.16 +ATOM 2453 CD1 TYR A 406 -6.315 78.474 107.692 1.00 9.17 +ATOM 2454 CD2 TYR A 406 -4.862 77.493 106.076 1.00 7.79 +ATOM 2455 CE1 TYR A 406 -5.307 79.334 108.080 1.00 10.25 +ATOM 2456 CE2 TYR A 406 -3.859 78.340 106.452 1.00 9.23 +ATOM 2457 CZ TYR A 406 -4.082 79.261 107.458 1.00 11.75 +ATOM 2458 OH TYR A 406 -3.066 80.096 107.856 1.00 12.88 +ATOM 2459 N SER A 407 -9.599 76.940 104.475 1.00 12.45 +ATOM 2460 CA SER A 407 -10.436 76.427 103.404 1.00 10.91 +ATOM 2461 C SER A 407 -9.875 77.017 102.125 1.00 11.11 +ATOM 2462 O SER A 407 -9.354 78.135 102.121 1.00 9.51 +ATOM 2463 CB SER A 407 -11.909 76.832 103.599 1.00 10.81 +ATOM 2464 OG SER A 407 -12.123 78.213 103.400 1.00 9.55 +ATOM 2465 N GLY A 408 -9.955 76.262 101.041 1.00 11.44 +ATOM 2466 CA GLY A 408 -9.430 76.777 99.796 1.00 13.14 +ATOM 2467 C GLY A 408 -10.141 76.191 98.610 1.00 15.28 +ATOM 2468 O GLY A 408 -10.921 75.247 98.743 1.00 17.44 +ATOM 2469 N SER A 409 -9.865 76.748 97.442 1.00 14.70 +ATOM 2470 CA SER A 409 -10.479 76.271 96.216 1.00 15.35 +ATOM 2471 C SER A 409 -9.550 75.332 95.452 1.00 15.64 +ATOM 2472 O SER A 409 -8.335 75.360 95.631 1.00 15.12 +ATOM 2473 CB SER A 409 -10.801 77.456 95.301 1.00 14.56 +ATOM 2474 OG SER A 409 -9.605 77.991 94.744 1.00 10.37 +ATOM 2475 N PHE A 410 -10.147 74.493 94.614 1.00 16.23 +ATOM 2476 CA PHE A 410 -9.408 73.603 93.721 1.00 17.60 +ATOM 2477 C PHE A 410 -10.324 73.282 92.540 1.00 18.25 +ATOM 2478 O PHE A 410 -11.550 73.399 92.639 1.00 17.63 +ATOM 2479 CB PHE A 410 -8.883 72.329 94.419 1.00 16.84 +ATOM 2480 CG PHE A 410 -9.931 71.308 94.751 1.00 17.97 +ATOM 2481 CD1 PHE A 410 -10.762 71.474 95.848 1.00 17.97 +ATOM 2482 CD2 PHE A 410 -10.025 70.131 94.011 1.00 18.42 +ATOM 2483 CE1 PHE A 410 -11.666 70.478 96.214 1.00 19.80 +ATOM 2484 CE2 PHE A 410 -10.931 69.123 94.369 1.00 18.77 +ATOM 2485 CZ PHE A 410 -11.750 69.295 95.471 1.00 17.73 +ATOM 2486 N VAL A 411 -9.741 72.898 91.415 1.00 17.62 +ATOM 2487 CA VAL A 411 -10.556 72.645 90.239 1.00 18.74 +ATOM 2488 C VAL A 411 -10.321 71.311 89.554 1.00 18.53 +ATOM 2489 O VAL A 411 -9.369 70.597 89.846 1.00 19.24 +ATOM 2490 CB VAL A 411 -10.340 73.761 89.183 1.00 19.92 +ATOM 2491 CG1 VAL A 411 -11.263 73.553 88.031 1.00 23.04 +ATOM 2492 CG2 VAL A 411 -10.597 75.113 89.781 1.00 20.72 +ATOM 2493 N GLN A 412 -11.220 70.990 88.636 1.00 18.06 +ATOM 2494 CA GLN A 412 -11.140 69.771 87.857 1.00 17.12 +ATOM 2495 C GLN A 412 -11.349 70.224 86.419 1.00 16.45 +ATOM 2496 O GLN A 412 -12.427 70.692 86.046 1.00 15.56 +ATOM 2497 CB GLN A 412 -12.227 68.781 88.300 1.00 16.77 +ATOM 2498 CG GLN A 412 -12.121 68.392 89.764 1.00 13.79 +ATOM 2499 CD GLN A 412 -12.946 67.171 90.128 1.00 13.89 +ATOM 2500 OE1 GLN A 412 -14.156 67.132 89.921 1.00 14.13 +ATOM 2501 NE2 GLN A 412 -12.287 66.170 90.690 1.00 15.23 +ATOM 2502 N HIS A 412A -10.291 70.113 85.629 1.00 16.40 +ATOM 2503 CA HIS A 412A -10.308 70.521 84.231 1.00 15.99 +ATOM 2504 C HIS A 412A -10.986 69.520 83.325 1.00 16.42 +ATOM 2505 O HIS A 412A -11.158 68.360 83.684 1.00 16.50 +ATOM 2506 CB HIS A 412A -8.883 70.706 83.720 1.00 17.61 +ATOM 2507 CG HIS A 412A -8.197 71.925 84.240 1.00 17.94 +ATOM 2508 ND1 HIS A 412A -8.143 73.104 83.529 1.00 18.22 +ATOM 2509 CD2 HIS A 412A -7.511 72.145 85.385 1.00 18.35 +ATOM 2510 CE1 HIS A 412A -7.451 73.994 84.213 1.00 19.17 +ATOM 2511 NE2 HIS A 412A -7.055 73.437 85.344 1.00 18.08 +ATOM 2512 N PRO A 412B -11.381 69.969 82.123 1.00 17.93 +ATOM 2513 CA PRO A 412B -12.040 69.140 81.110 1.00 17.79 +ATOM 2514 C PRO A 412B -11.238 67.879 80.768 1.00 18.05 +ATOM 2515 O PRO A 412B -11.812 66.823 80.523 1.00 19.06 +ATOM 2516 CB PRO A 412B -12.153 70.090 79.925 1.00 17.54 +ATOM 2517 CG PRO A 412B -12.438 71.395 80.601 1.00 17.41 +ATOM 2518 CD PRO A 412B -11.457 71.399 81.754 1.00 18.17 +ATOM 2519 N GLU A 412C -9.915 67.970 80.753 1.00 18.33 +ATOM 2520 CA GLU A 412C -9.134 66.784 80.424 1.00 19.37 +ATOM 2521 C GLU A 412C -9.243 65.703 81.509 1.00 19.87 +ATOM 2522 O GLU A 412C -8.815 64.566 81.313 1.00 21.87 +ATOM 2523 CB GLU A 412C -7.657 67.137 80.152 1.00 19.14 +ATOM 2524 CG GLU A 412C -7.226 68.570 80.466 1.00 21.55 +ATOM 2525 CD GLU A 412C -7.558 69.574 79.372 1.00 18.96 +ATOM 2526 OE1 GLU A 412C -7.199 69.336 78.209 1.00 20.85 +ATOM 2527 OE2 GLU A 412C -8.161 70.617 79.682 1.00 20.20 +ATOM 2528 N LEU A 412D -9.828 66.048 82.650 1.00 20.69 +ATOM 2529 CA LEU A 412D -9.996 65.083 83.740 1.00 20.41 +ATOM 2530 C LEU A 412D -11.436 64.628 83.815 1.00 21.07 +ATOM 2531 O LEU A 412D -11.724 63.444 83.979 1.00 21.74 +ATOM 2532 CB LEU A 412D -9.637 65.703 85.098 1.00 17.55 +ATOM 2533 CG LEU A 412D -10.171 64.925 86.316 1.00 15.64 +ATOM 2534 CD1 LEU A 412D -9.537 63.540 86.367 1.00 15.65 +ATOM 2535 CD2 LEU A 412D -9.875 65.672 87.597 1.00 13.66 +ATOM 2536 N THR A 413 -12.328 65.599 83.688 1.00 21.89 +ATOM 2537 CA THR A 413 -13.757 65.384 83.790 1.00 22.76 +ATOM 2538 C THR A 413 -14.501 65.005 82.512 1.00 22.32 +ATOM 2539 O THR A 413 -15.520 64.313 82.559 1.00 21.74 +ATOM 2540 CB THR A 413 -14.407 66.633 84.353 1.00 23.48 +ATOM 2541 OG1 THR A 413 -13.732 67.021 85.557 1.00 25.39 +ATOM 2542 CG2 THR A 413 -15.847 66.364 84.661 1.00 26.10 +ATOM 2543 N GLY A 414 -14.000 65.457 81.373 1.00 22.25 +ATOM 2544 CA GLY A 414 -14.676 65.164 80.127 1.00 21.45 +ATOM 2545 C GLY A 414 -15.663 66.276 79.821 1.00 22.37 +ATOM 2546 O GLY A 414 -16.144 66.387 78.697 1.00 24.79 +ATOM 2547 N LEU A 415 -15.977 67.094 80.822 1.00 21.25 +ATOM 2548 CA LEU A 415 -16.892 68.221 80.647 1.00 20.65 +ATOM 2549 C LEU A 415 -16.321 69.234 79.656 1.00 22.40 +ATOM 2550 O LEU A 415 -15.223 69.053 79.118 1.00 22.21 +ATOM 2551 CB LEU A 415 -17.111 68.930 81.984 1.00 19.36 +ATOM 2552 CG LEU A 415 -18.151 68.426 82.987 1.00 18.30 +ATOM 2553 CD1 LEU A 415 -18.392 66.948 82.824 1.00 18.64 +ATOM 2554 CD2 LEU A 415 -17.681 68.765 84.384 1.00 16.92 +ATOM 2555 N ASP A 416 -17.066 70.313 79.429 1.00 23.81 +ATOM 2556 CA ASP A 416 -16.623 71.370 78.518 1.00 24.02 +ATOM 2557 C ASP A 416 -16.451 72.668 79.301 1.00 22.68 +ATOM 2558 O ASP A 416 -16.460 73.752 78.729 1.00 24.29 +ATOM 2559 CB ASP A 416 -17.646 71.579 77.396 1.00 25.56 +ATOM 2560 CG ASP A 416 -18.930 72.215 77.893 1.00 28.28 +ATOM 2561 OD1 ASP A 416 -19.144 72.208 79.129 1.00 30.71 +ATOM 2562 OD2 ASP A 416 -19.728 72.711 77.055 1.00 28.65 +ATOM 2563 N CYS A 417 -16.311 72.552 80.614 1.00 20.80 +ATOM 2564 CA CYS A 417 -16.134 73.718 81.468 1.00 19.85 +ATOM 2565 C CYS A 417 -15.263 73.358 82.662 1.00 17.29 +ATOM 2566 O CYS A 417 -15.181 72.206 83.048 1.00 17.73 +ATOM 2567 CB CYS A 417 -17.495 74.230 81.950 1.00 22.51 +ATOM 2568 SG CYS A 417 -18.496 72.905 82.690 1.00 26.03 +ATOM 2569 N ILE A 418 -14.593 74.347 83.232 1.00 16.47 +ATOM 2570 CA ILE A 418 -13.746 74.125 84.400 1.00 15.50 +ATOM 2571 C ILE A 418 -14.634 74.063 85.641 1.00 15.12 +ATOM 2572 O ILE A 418 -15.294 75.033 85.970 1.00 14.80 +ATOM 2573 CB ILE A 418 -12.693 75.264 84.516 1.00 14.75 +ATOM 2574 CG1 ILE A 418 -11.606 75.032 83.464 1.00 14.84 +ATOM 2575 CG2 ILE A 418 -12.095 75.323 85.900 1.00 11.25 +ATOM 2576 CD1 ILE A 418 -10.604 76.135 83.347 1.00 14.02 +ATOM 2577 N ARG A 419 -14.648 72.909 86.310 1.00 15.24 +ATOM 2578 CA ARG A 419 -15.469 72.690 87.501 1.00 15.80 +ATOM 2579 C ARG A 419 -14.899 73.205 88.829 1.00 16.44 +ATOM 2580 O ARG A 419 -13.746 72.955 89.174 1.00 16.92 +ATOM 2581 CB ARG A 419 -15.795 71.196 87.652 1.00 16.38 +ATOM 2582 CG ARG A 419 -16.128 70.793 89.094 1.00 19.47 +ATOM 2583 CD ARG A 419 -16.603 69.345 89.244 1.00 22.54 +ATOM 2584 NE ARG A 419 -17.921 69.141 88.636 1.00 25.19 +ATOM 2585 CZ ARG A 419 -18.587 67.990 88.652 1.00 24.31 +ATOM 2586 NH1 ARG A 419 -18.068 66.926 89.246 1.00 24.90 +ATOM 2587 NH2 ARG A 419 -19.773 67.905 88.068 1.00 24.21 +ATOM 2588 N PRO A 420 -15.721 73.926 89.601 1.00 16.66 +ATOM 2589 CA PRO A 420 -15.282 74.461 90.892 1.00 16.21 +ATOM 2590 C PRO A 420 -15.587 73.506 92.060 1.00 17.90 +ATOM 2591 O PRO A 420 -16.676 72.925 92.133 1.00 17.25 +ATOM 2592 CB PRO A 420 -16.073 75.757 91.000 1.00 14.07 +ATOM 2593 CG PRO A 420 -17.374 75.368 90.412 1.00 14.66 +ATOM 2594 CD PRO A 420 -16.990 74.550 89.182 1.00 15.42 +ATOM 2595 N CYS A 421 -14.613 73.344 92.954 1.00 17.63 +ATOM 2596 CA CYS A 421 -14.753 72.501 94.142 1.00 18.08 +ATOM 2597 C CYS A 421 -14.037 73.271 95.263 1.00 16.87 +ATOM 2598 O CYS A 421 -13.494 74.345 95.028 1.00 18.19 +ATOM 2599 CB CYS A 421 -14.059 71.138 93.953 1.00 18.63 +ATOM 2600 SG CYS A 421 -14.586 70.039 92.583 1.00 20.28 +ATOM 2601 N PHE A 422 -14.043 72.742 96.477 1.00 14.73 +ATOM 2602 CA PHE A 422 -13.343 73.393 97.572 1.00 14.56 +ATOM 2603 C PHE A 422 -13.139 72.437 98.738 1.00 14.45 +ATOM 2604 O PHE A 422 -13.814 71.407 98.840 1.00 13.45 +ATOM 2605 CB PHE A 422 -14.081 74.670 98.026 1.00 15.41 +ATOM 2606 CG PHE A 422 -15.369 74.423 98.774 1.00 15.57 +ATOM 2607 CD1 PHE A 422 -15.362 74.220 100.153 1.00 15.26 +ATOM 2608 CD2 PHE A 422 -16.593 74.416 98.103 1.00 13.75 +ATOM 2609 CE1 PHE A 422 -16.554 74.017 100.859 1.00 14.67 +ATOM 2610 CE2 PHE A 422 -17.784 74.212 98.797 1.00 14.48 +ATOM 2611 CZ PHE A 422 -17.764 74.013 100.181 1.00 13.51 +ATOM 2612 N TRP A 423 -12.191 72.776 99.606 1.00 13.20 +ATOM 2613 CA TRP A 423 -11.894 71.952 100.767 1.00 12.72 +ATOM 2614 C TRP A 423 -11.930 72.786 102.040 1.00 11.72 +ATOM 2615 O TRP A 423 -11.844 74.015 101.987 1.00 11.28 +ATOM 2616 CB TRP A 423 -10.510 71.317 100.613 1.00 12.78 +ATOM 2617 CG TRP A 423 -9.416 72.312 100.333 1.00 14.32 +ATOM 2618 CD1 TRP A 423 -8.890 72.638 99.112 1.00 15.32 +ATOM 2619 CD2 TRP A 423 -8.742 73.129 101.287 1.00 14.05 +ATOM 2620 NE1 TRP A 423 -7.930 73.606 99.250 1.00 14.84 +ATOM 2621 CE2 TRP A 423 -7.818 73.928 100.574 1.00 14.98 +ATOM 2622 CE3 TRP A 423 -8.829 73.270 102.675 1.00 14.70 +ATOM 2623 CZ2 TRP A 423 -6.985 74.856 101.207 1.00 15.24 +ATOM 2624 CZ3 TRP A 423 -7.998 74.197 103.306 1.00 15.27 +ATOM 2625 CH2 TRP A 423 -7.090 74.976 102.570 1.00 14.80 +ATOM 2626 N VAL A 424 -12.064 72.112 103.180 1.00 10.74 +ATOM 2627 CA VAL A 424 -12.076 72.790 104.471 1.00 9.47 +ATOM 2628 C VAL A 424 -11.211 72.044 105.488 1.00 11.56 +ATOM 2629 O VAL A 424 -11.367 70.836 105.677 1.00 12.87 +ATOM 2630 CB VAL A 424 -13.493 72.898 105.050 1.00 7.55 +ATOM 2631 CG1 VAL A 424 -13.485 73.829 106.247 1.00 5.96 +ATOM 2632 CG2 VAL A 424 -14.457 73.404 104.002 1.00 7.69 +ATOM 2633 N GLU A 425 -10.284 72.765 106.119 1.00 12.35 +ATOM 2634 CA GLU A 425 -9.412 72.198 107.147 1.00 13.23 +ATOM 2635 C GLU A 425 -10.136 72.259 108.495 1.00 13.80 +ATOM 2636 O GLU A 425 -10.606 73.321 108.904 1.00 13.97 +ATOM 2637 CB GLU A 425 -8.109 72.998 107.256 1.00 13.56 +ATOM 2638 CG GLU A 425 -7.363 72.758 108.575 1.00 14.32 +ATOM 2639 CD GLU A 425 -6.112 73.614 108.726 1.00 15.61 +ATOM 2640 OE1 GLU A 425 -6.222 74.859 108.718 1.00 12.81 +ATOM 2641 OE2 GLU A 425 -5.014 73.035 108.858 1.00 14.33 +ATOM 2642 N LEU A 426 -10.239 71.121 109.173 1.00 13.66 +ATOM 2643 CA LEU A 426 -10.894 71.063 110.476 1.00 14.17 +ATOM 2644 C LEU A 426 -9.794 70.959 111.538 1.00 15.04 +ATOM 2645 O LEU A 426 -9.314 69.866 111.848 1.00 13.31 +ATOM 2646 CB LEU A 426 -11.821 69.847 110.528 1.00 13.92 +ATOM 2647 CG LEU A 426 -12.736 69.752 109.301 1.00 13.26 +ATOM 2648 CD1 LEU A 426 -13.362 68.381 109.212 1.00 13.25 +ATOM 2649 CD2 LEU A 426 -13.802 70.824 109.372 1.00 13.54 +ATOM 2650 N ILE A 427 -9.403 72.113 112.079 1.00 15.51 +ATOM 2651 CA ILE A 427 -8.339 72.215 113.081 1.00 16.95 +ATOM 2652 C ILE A 427 -8.735 71.803 114.495 1.00 17.50 +ATOM 2653 O ILE A 427 -9.696 72.325 115.043 1.00 17.68 +ATOM 2654 CB ILE A 427 -7.803 73.665 113.161 1.00 17.16 +ATOM 2655 CG1 ILE A 427 -7.234 74.094 111.808 1.00 18.23 +ATOM 2656 CG2 ILE A 427 -6.733 73.770 114.241 1.00 17.02 +ATOM 2657 CD1 ILE A 427 -6.877 75.568 111.743 1.00 17.04 +ATOM 2658 N ARG A 428 -7.979 70.881 115.087 1.00 18.57 +ATOM 2659 CA ARG A 428 -8.247 70.430 116.451 1.00 19.49 +ATOM 2660 C ARG A 428 -7.029 70.681 117.322 1.00 20.02 +ATOM 2661 O ARG A 428 -5.906 70.719 116.825 1.00 21.59 +ATOM 2662 CB ARG A 428 -8.583 68.933 116.488 1.00 19.83 +ATOM 2663 CG ARG A 428 -9.887 68.556 115.799 1.00 20.88 +ATOM 2664 CD ARG A 428 -11.037 69.420 116.286 1.00 20.54 +ATOM 2665 NE ARG A 428 -11.339 69.250 117.706 1.00 20.84 +ATOM 2666 CZ ARG A 428 -12.009 68.222 118.220 1.00 21.63 +ATOM 2667 NH1 ARG A 428 -12.237 68.165 119.528 1.00 22.16 +ATOM 2668 NH2 ARG A 428 -12.450 67.248 117.432 1.00 21.63 +ATOM 2669 N GLY A 429 -7.257 70.846 118.622 1.00 20.80 +ATOM 2670 CA GLY A 429 -6.165 71.080 119.555 1.00 20.92 +ATOM 2671 C GLY A 429 -5.983 72.535 119.945 1.00 21.46 +ATOM 2672 O GLY A 429 -6.957 73.259 120.173 1.00 20.84 +ATOM 2673 N ARG A 430 -4.724 72.957 120.021 1.00 22.07 +ATOM 2674 CA ARG A 430 -4.363 74.328 120.372 1.00 22.87 +ATOM 2675 C ARG A 430 -4.605 75.320 119.223 1.00 22.55 +ATOM 2676 O ARG A 430 -4.511 74.972 118.044 1.00 22.68 +ATOM 2677 CB ARG A 430 -2.894 74.366 120.813 1.00 23.97 +ATOM 2678 CG ARG A 430 -2.686 73.854 122.244 1.00 29.02 +ATOM 2679 CD ARG A 430 -1.312 73.202 122.415 1.00 33.61 +ATOM 2680 NE ARG A 430 -0.276 74.110 122.919 1.00 36.92 +ATOM 2681 CZ ARG A 430 1.000 74.073 122.533 1.00 37.89 +ATOM 2682 NH1 ARG A 430 1.404 73.176 121.631 1.00 35.82 +ATOM 2683 NH2 ARG A 430 1.875 74.928 123.053 1.00 36.99 +ATOM 2684 N PRO A 431 -4.892 76.585 119.558 1.00 22.86 +ATOM 2685 CA PRO A 431 -4.990 77.105 120.928 1.00 22.23 +ATOM 2686 C PRO A 431 -6.364 76.995 121.610 1.00 22.86 +ATOM 2687 O PRO A 431 -6.480 77.198 122.822 1.00 23.87 +ATOM 2688 CB PRO A 431 -4.552 78.552 120.758 1.00 20.89 +ATOM 2689 CG PRO A 431 -5.182 78.910 119.451 1.00 22.04 +ATOM 2690 CD PRO A 431 -4.946 77.683 118.572 1.00 21.80 +ATOM 2691 N LYS A 432 -7.400 76.669 120.847 1.00 22.95 +ATOM 2692 CA LYS A 432 -8.747 76.575 121.406 1.00 22.38 +ATOM 2693 C LYS A 432 -9.021 75.419 122.367 1.00 21.76 +ATOM 2694 O LYS A 432 -9.938 75.491 123.178 1.00 21.53 +ATOM 2695 CB LYS A 432 -9.778 76.525 120.275 1.00 21.04 +ATOM 2696 CG LYS A 432 -10.033 77.870 119.627 1.00 21.71 +ATOM 2697 CD LYS A 432 -10.394 78.903 120.691 1.00 23.27 +ATOM 2698 CE LYS A 432 -10.628 80.283 120.103 1.00 23.31 +ATOM 2699 NZ LYS A 432 -10.421 81.343 121.157 1.00 25.54 +ATOM 2700 N GLU A 433 -8.235 74.356 122.280 1.00 21.85 +ATOM 2701 CA GLU A 433 -8.454 73.193 123.133 1.00 19.94 +ATOM 2702 C GLU A 433 -7.212 72.832 123.931 1.00 18.82 +ATOM 2703 O GLU A 433 -6.089 72.971 123.449 1.00 15.10 +ATOM 2704 CB GLU A 433 -8.899 72.005 122.270 1.00 19.78 +ATOM 2705 CG GLU A 433 -10.189 72.251 121.482 1.00 20.21 +ATOM 2706 CD GLU A 433 -10.537 71.095 120.567 1.00 21.04 +ATOM 2707 OE1 GLU A 433 -9.912 70.992 119.491 1.00 20.83 +ATOM 2708 OE2 GLU A 433 -11.417 70.280 120.930 1.00 21.39 +ATOM 2709 N SER A 435 -7.435 72.348 125.149 1.00 19.64 +ATOM 2710 CA SER A 435 -6.345 71.994 126.040 1.00 20.89 +ATOM 2711 C SER A 435 -5.700 70.663 125.716 1.00 19.82 +ATOM 2712 O SER A 435 -6.069 69.620 126.255 1.00 19.84 +ATOM 2713 CB SER A 435 -6.820 72.000 127.497 1.00 22.86 +ATOM 2714 OG SER A 435 -7.688 70.913 127.749 1.00 29.23 +ATOM 2715 N THR A 436 -4.714 70.721 124.832 1.00 18.29 +ATOM 2716 CA THR A 436 -3.964 69.548 124.418 1.00 16.92 +ATOM 2717 C THR A 436 -2.548 70.064 124.251 1.00 16.71 +ATOM 2718 O THR A 436 -2.309 71.249 124.453 1.00 16.35 +ATOM 2719 CB THR A 436 -4.489 68.981 123.073 1.00 15.30 +ATOM 2720 OG1 THR A 436 -4.570 70.034 122.110 1.00 16.16 +ATOM 2721 CG2 THR A 436 -5.863 68.375 123.252 1.00 14.06 +ATOM 2722 N ILE A 437 -1.607 69.193 123.909 1.00 16.51 +ATOM 2723 CA ILE A 437 -0.234 69.641 123.724 1.00 16.13 +ATOM 2724 C ILE A 437 0.047 69.752 122.235 1.00 17.06 +ATOM 2725 O ILE A 437 1.160 70.093 121.838 1.00 16.26 +ATOM 2726 CB ILE A 437 0.806 68.641 124.315 1.00 16.53 +ATOM 2727 CG1 ILE A 437 0.811 67.343 123.495 1.00 16.01 +ATOM 2728 CG2 ILE A 437 0.499 68.354 125.774 1.00 14.58 +ATOM 2729 CD1 ILE A 437 1.848 66.329 123.954 1.00 15.11 +ATOM 2730 N TRP A 438 -0.967 69.477 121.416 1.00 16.65 +ATOM 2731 CA TRP A 438 -0.795 69.494 119.964 1.00 17.11 +ATOM 2732 C TRP A 438 -1.835 70.258 119.147 1.00 17.03 +ATOM 2733 O TRP A 438 -2.830 70.761 119.671 1.00 17.40 +ATOM 2734 CB TRP A 438 -0.769 68.053 119.449 1.00 15.54 +ATOM 2735 CG TRP A 438 -1.963 67.267 119.913 1.00 14.22 +ATOM 2736 CD1 TRP A 438 -2.130 66.675 121.131 1.00 12.52 +ATOM 2737 CD2 TRP A 438 -3.191 67.062 119.199 1.00 14.87 +ATOM 2738 NE1 TRP A 438 -3.383 66.119 121.226 1.00 10.82 +ATOM 2739 CE2 TRP A 438 -4.058 66.342 120.056 1.00 12.80 +ATOM 2740 CE3 TRP A 438 -3.647 67.419 117.919 1.00 14.00 +ATOM 2741 CZ2 TRP A 438 -5.351 65.973 119.677 1.00 11.51 +ATOM 2742 CZ3 TRP A 438 -4.944 67.048 117.543 1.00 13.22 +ATOM 2743 CH2 TRP A 438 -5.775 66.335 118.420 1.00 11.52 +ATOM 2744 N THR A 439 -1.577 70.310 117.842 1.00 16.49 +ATOM 2745 CA THR A 439 -2.457 70.945 116.871 1.00 15.92 +ATOM 2746 C THR A 439 -2.370 70.194 115.542 1.00 16.58 +ATOM 2747 O THR A 439 -1.281 70.001 115.009 1.00 16.91 +ATOM 2748 CB THR A 439 -2.061 72.391 116.595 1.00 15.29 +ATOM 2749 OG1 THR A 439 -2.208 73.173 117.780 1.00 14.39 +ATOM 2750 CG2 THR A 439 -2.940 72.957 115.513 1.00 14.97 +ATOM 2751 N SER A 440 -3.512 69.761 115.015 1.00 17.15 +ATOM 2752 CA SER A 440 -3.543 69.068 113.725 1.00 16.55 +ATOM 2753 C SER A 440 -4.903 69.311 113.090 1.00 16.11 +ATOM 2754 O SER A 440 -5.774 69.914 113.714 1.00 16.84 +ATOM 2755 CB SER A 440 -3.303 67.563 113.893 1.00 17.56 +ATOM 2756 OG SER A 440 -3.054 66.951 112.636 1.00 18.05 +ATOM 2757 N GLY A 441 -5.087 68.847 111.857 1.00 15.74 +ATOM 2758 CA GLY A 441 -6.354 69.057 111.189 1.00 14.51 +ATOM 2759 C GLY A 441 -6.837 67.930 110.300 1.00 14.63 +ATOM 2760 O GLY A 441 -6.060 67.101 109.846 1.00 12.90 +ATOM 2761 N SER A 442 -8.147 67.912 110.071 1.00 15.67 +ATOM 2762 CA SER A 442 -8.807 66.928 109.218 1.00 16.36 +ATOM 2763 C SER A 442 -9.310 67.699 108.016 1.00 14.33 +ATOM 2764 O SER A 442 -9.290 68.924 108.033 1.00 14.66 +ATOM 2765 CB SER A 442 -10.009 66.306 109.943 1.00 18.14 +ATOM 2766 OG SER A 442 -9.772 64.940 110.224 1.00 24.18 +ATOM 2767 N SER A 443 -9.776 66.995 106.988 1.00 12.79 +ATOM 2768 CA SER A 443 -10.300 67.666 105.806 1.00 12.42 +ATOM 2769 C SER A 443 -11.604 67.075 105.276 1.00 14.26 +ATOM 2770 O SER A 443 -11.935 65.922 105.538 1.00 14.93 +ATOM 2771 CB SER A 443 -9.254 67.670 104.681 1.00 11.71 +ATOM 2772 OG SER A 443 -9.099 66.396 104.077 1.00 10.69 +ATOM 2773 N ILE A 444 -12.351 67.907 104.552 1.00 15.33 +ATOM 2774 CA ILE A 444 -13.594 67.524 103.891 1.00 13.96 +ATOM 2775 C ILE A 444 -13.604 68.382 102.635 1.00 15.25 +ATOM 2776 O ILE A 444 -12.998 69.455 102.624 1.00 15.91 +ATOM 2777 CB ILE A 444 -14.860 67.834 104.730 1.00 12.56 +ATOM 2778 CG1 ILE A 444 -14.825 69.272 105.239 1.00 12.23 +ATOM 2779 CG2 ILE A 444 -14.995 66.829 105.850 1.00 11.99 +ATOM 2780 CD1 ILE A 444 -16.086 69.684 105.966 1.00 12.55 +ATOM 2781 N SER A 445 -14.254 67.917 101.570 1.00 15.96 +ATOM 2782 CA SER A 445 -14.299 68.700 100.341 1.00 16.51 +ATOM 2783 C SER A 445 -15.623 68.566 99.582 1.00 18.06 +ATOM 2784 O SER A 445 -16.384 67.611 99.783 1.00 17.89 +ATOM 2785 CB SER A 445 -13.147 68.309 99.427 1.00 17.67 +ATOM 2786 OG SER A 445 -13.340 67.007 98.910 1.00 21.51 +ATOM 2787 N PHE A 446 -15.889 69.536 98.706 1.00 18.43 +ATOM 2788 CA PHE A 446 -17.115 69.557 97.926 1.00 18.23 +ATOM 2789 C PHE A 446 -16.860 70.000 96.493 1.00 18.40 +ATOM 2790 O PHE A 446 -15.799 70.534 96.177 1.00 17.43 +ATOM 2791 CB PHE A 446 -18.124 70.508 98.574 1.00 18.88 +ATOM 2792 CG PHE A 446 -18.498 70.133 99.971 1.00 17.68 +ATOM 2793 CD1 PHE A 446 -17.626 70.357 101.027 1.00 17.01 +ATOM 2794 CD2 PHE A 446 -19.712 69.513 100.229 1.00 18.27 +ATOM 2795 CE1 PHE A 446 -17.958 69.963 102.319 1.00 16.33 +ATOM 2796 CE2 PHE A 446 -20.047 69.119 101.521 1.00 16.84 +ATOM 2797 CZ PHE A 446 -19.165 69.345 102.562 1.00 13.17 +ATOM 2798 N CYS A 447 -17.844 69.777 95.629 1.00 19.22 +ATOM 2799 CA CYS A 447 -17.729 70.174 94.233 1.00 20.65 +ATOM 2800 C CYS A 447 -19.001 70.833 93.694 1.00 21.95 +ATOM 2801 O CYS A 447 -20.100 70.558 94.178 1.00 22.24 +ATOM 2802 CB CYS A 447 -17.361 68.970 93.376 1.00 20.85 +ATOM 2803 SG CYS A 447 -15.603 68.492 93.482 1.00 23.69 +ATOM 2804 N GLY A 448 -18.822 71.693 92.689 1.00 22.32 +ATOM 2805 CA GLY A 448 -19.903 72.420 92.050 1.00 22.44 +ATOM 2806 C GLY A 448 -21.251 71.736 91.936 1.00 24.32 +ATOM 2807 O GLY A 448 -22.078 71.855 92.833 1.00 27.25 +ATOM 2808 N VAL A 449 -21.516 71.065 90.825 1.00 23.82 +ATOM 2809 CA VAL A 449 -22.793 70.360 90.669 1.00 23.45 +ATOM 2810 C VAL A 449 -24.037 71.179 90.296 1.00 23.14 +ATOM 2811 O VAL A 449 -24.286 72.247 90.846 1.00 22.19 +ATOM 2812 CB VAL A 449 -23.093 69.522 91.956 1.00 22.32 +ATOM 2813 CG1 VAL A 449 -24.546 69.139 92.041 1.00 21.37 +ATOM 2814 CG2 VAL A 449 -22.236 68.267 91.943 1.00 23.62 +ATOM 2815 N ASN A 450 -24.811 70.642 89.351 1.00 24.63 +ATOM 2816 CA ASN A 450 -26.057 71.250 88.881 1.00 26.27 +ATOM 2817 C ASN A 450 -27.240 70.718 89.649 1.00 25.72 +ATOM 2818 O ASN A 450 -28.127 71.472 90.040 1.00 28.17 +ATOM 2819 CB ASN A 450 -26.310 70.941 87.414 1.00 28.71 +ATOM 2820 CG ASN A 450 -25.764 71.997 86.511 1.00 31.27 +ATOM 2821 OD1 ASN A 450 -25.735 73.180 86.877 1.00 30.52 +ATOM 2822 ND2 ASN A 450 -25.345 71.595 85.308 1.00 32.76 +ATOM 2823 N SER A 451 -27.261 69.404 89.830 1.00 25.34 +ATOM 2824 CA SER A 451 -28.325 68.721 90.555 1.00 24.21 +ATOM 2825 C SER A 451 -28.446 69.326 91.959 1.00 23.33 +ATOM 2826 O SER A 451 -27.673 70.217 92.309 1.00 20.44 +ATOM 2827 CB SER A 451 -27.976 67.241 90.613 1.00 24.75 +ATOM 2828 OG SER A 451 -26.584 67.081 90.398 1.00 22.39 +ATOM 2829 N ASP A 452 -29.385 68.864 92.781 1.00 24.52 +ATOM 2830 CA ASP A 452 -29.457 69.501 94.085 1.00 25.60 +ATOM 2831 C ASP A 452 -28.484 68.974 95.107 1.00 23.71 +ATOM 2832 O ASP A 452 -27.736 68.024 94.879 1.00 21.53 +ATOM 2833 CB ASP A 452 -30.870 69.498 94.674 1.00 29.81 +ATOM 2834 CG ASP A 452 -31.086 70.655 95.694 1.00 34.40 +ATOM 2835 OD1 ASP A 452 -30.427 71.714 95.553 1.00 34.39 +ATOM 2836 OD2 ASP A 452 -31.929 70.518 96.620 1.00 37.38 +ATOM 2837 N THR A 453 -28.507 69.623 96.254 1.00 21.56 +ATOM 2838 CA THR A 453 -27.596 69.293 97.312 1.00 20.12 +ATOM 2839 C THR A 453 -28.351 69.479 98.602 1.00 19.04 +ATOM 2840 O THR A 453 -29.571 69.592 98.591 1.00 18.50 +ATOM 2841 CB THR A 453 -26.409 70.259 97.247 1.00 20.80 +ATOM 2842 OG1 THR A 453 -26.887 71.599 97.420 1.00 21.54 +ATOM 2843 CG2 THR A 453 -25.732 70.170 95.885 1.00 18.62 +ATOM 2844 N VAL A 454 -27.627 69.499 99.710 1.00 18.23 +ATOM 2845 CA VAL A 454 -28.244 69.706 101.004 1.00 18.43 +ATOM 2846 C VAL A 454 -27.229 70.232 101.986 1.00 19.22 +ATOM 2847 O VAL A 454 -26.025 69.986 101.854 1.00 18.55 +ATOM 2848 CB VAL A 454 -28.853 68.411 101.595 1.00 18.44 +ATOM 2849 CG1 VAL A 454 -30.122 68.057 100.848 1.00 21.61 +ATOM 2850 CG2 VAL A 454 -27.839 67.272 101.538 1.00 14.78 +ATOM 2851 N GLY A 455 -27.733 70.972 102.966 1.00 18.91 +ATOM 2852 CA GLY A 455 -26.880 71.518 103.994 1.00 18.96 +ATOM 2853 C GLY A 455 -26.915 70.540 105.148 1.00 19.42 +ATOM 2854 O GLY A 455 -27.929 69.874 105.381 1.00 18.73 +ATOM 2855 N TRP A 456 -25.802 70.449 105.861 1.00 17.78 +ATOM 2856 CA TRP A 456 -25.694 69.556 106.990 1.00 17.54 +ATOM 2857 C TRP A 456 -24.397 69.896 107.718 1.00 18.28 +ATOM 2858 O TRP A 456 -23.840 70.982 107.539 1.00 18.27 +ATOM 2859 CB TRP A 456 -25.686 68.101 106.500 1.00 18.79 +ATOM 2860 CG TRP A 456 -26.125 67.110 107.551 1.00 18.78 +ATOM 2861 CD1 TRP A 456 -27.077 67.308 108.513 1.00 17.66 +ATOM 2862 CD2 TRP A 456 -25.652 65.768 107.728 1.00 18.76 +ATOM 2863 NE1 TRP A 456 -27.225 66.178 109.278 1.00 17.65 +ATOM 2864 CE2 TRP A 456 -26.363 65.216 108.822 1.00 18.65 +ATOM 2865 CE3 TRP A 456 -24.697 64.979 107.075 1.00 18.78 +ATOM 2866 CZ2 TRP A 456 -26.149 63.912 109.276 1.00 16.61 +ATOM 2867 CZ3 TRP A 456 -24.485 63.681 107.526 1.00 19.24 +ATOM 2868 CH2 TRP A 456 -25.210 63.164 108.619 1.00 19.12 +ATOM 2869 N SER A 457 -23.916 68.986 108.552 1.00 16.49 +ATOM 2870 CA SER A 457 -22.674 69.248 109.257 1.00 16.24 +ATOM 2871 C SER A 457 -21.753 68.033 109.248 1.00 15.80 +ATOM 2872 O SER A 457 -22.083 66.994 109.814 1.00 16.67 +ATOM 2873 CB SER A 457 -22.961 69.677 110.695 1.00 14.76 +ATOM 2874 OG SER A 457 -21.768 69.722 111.449 1.00 13.41 +ATOM 2875 N TRP A 458 -20.609 68.176 108.586 1.00 14.23 +ATOM 2876 CA TRP A 458 -19.602 67.124 108.499 1.00 12.86 +ATOM 2877 C TRP A 458 -18.357 67.582 109.248 1.00 13.50 +ATOM 2878 O TRP A 458 -17.375 67.984 108.631 1.00 14.82 +ATOM 2879 CB TRP A 458 -19.217 66.870 107.046 1.00 12.37 +ATOM 2880 CG TRP A 458 -20.275 66.217 106.227 1.00 14.80 +ATOM 2881 CD1 TRP A 458 -20.520 64.877 106.109 1.00 13.56 +ATOM 2882 CD2 TRP A 458 -21.239 66.875 105.399 1.00 14.52 +ATOM 2883 NE1 TRP A 458 -21.572 64.663 105.256 1.00 13.89 +ATOM 2884 CE2 TRP A 458 -22.034 65.873 104.807 1.00 14.44 +ATOM 2885 CE3 TRP A 458 -21.508 68.217 105.099 1.00 13.40 +ATOM 2886 CZ2 TRP A 458 -23.084 66.171 103.932 1.00 15.35 +ATOM 2887 CZ3 TRP A 458 -22.549 68.511 104.229 1.00 12.96 +ATOM 2888 CH2 TRP A 458 -23.321 67.495 103.657 1.00 13.29 +ATOM 2889 N PRO A 459 -18.377 67.526 110.590 1.00 15.50 +ATOM 2890 CA PRO A 459 -17.222 67.951 111.382 1.00 14.90 +ATOM 2891 C PRO A 459 -16.161 66.859 111.571 1.00 17.22 +ATOM 2892 O PRO A 459 -16.344 65.705 111.177 1.00 16.91 +ATOM 2893 CB PRO A 459 -17.861 68.357 112.700 1.00 12.86 +ATOM 2894 CG PRO A 459 -18.880 67.290 112.868 1.00 12.22 +ATOM 2895 CD PRO A 459 -19.486 67.126 111.476 1.00 13.77 +ATOM 2896 N ASP A 460 -15.056 67.248 112.195 1.00 19.12 +ATOM 2897 CA ASP A 460 -13.951 66.344 112.476 1.00 19.62 +ATOM 2898 C ASP A 460 -14.391 65.095 113.256 1.00 19.69 +ATOM 2899 O ASP A 460 -14.047 63.970 112.893 1.00 19.43 +ATOM 2900 CB ASP A 460 -12.894 67.103 113.258 1.00 21.07 +ATOM 2901 CG ASP A 460 -11.822 66.205 113.788 1.00 23.71 +ATOM 2902 OD1 ASP A 460 -11.971 65.738 114.937 1.00 24.86 +ATOM 2903 OD2 ASP A 460 -10.843 65.957 113.046 1.00 25.18 +ATOM 2904 N GLY A 461 -15.142 65.300 114.333 1.00 19.51 +ATOM 2905 CA GLY A 461 -15.628 64.177 115.121 1.00 19.10 +ATOM 2906 C GLY A 461 -14.680 63.532 116.121 1.00 18.15 +ATOM 2907 O GLY A 461 -15.031 62.530 116.742 1.00 17.41 +ATOM 2908 N ALA A 462 -13.479 64.074 116.283 1.00 18.19 +ATOM 2909 CA ALA A 462 -12.541 63.492 117.240 1.00 19.82 +ATOM 2910 C ALA A 462 -12.880 63.991 118.639 1.00 19.93 +ATOM 2911 O ALA A 462 -13.247 65.151 118.802 1.00 19.86 +ATOM 2912 CB ALA A 462 -11.113 63.883 116.887 1.00 18.12 +ATOM 2913 N GLU A 463 -12.786 63.126 119.644 1.00 20.96 +ATOM 2914 CA GLU A 463 -13.067 63.583 120.999 1.00 23.67 +ATOM 2915 C GLU A 463 -11.773 63.826 121.764 1.00 21.83 +ATOM 2916 O GLU A 463 -10.982 62.919 121.977 1.00 20.44 +ATOM 2917 CB GLU A 463 -13.974 62.602 121.769 1.00 27.31 +ATOM 2918 CG GLU A 463 -13.414 61.225 122.048 1.00 32.61 +ATOM 2919 CD GLU A 463 -14.128 60.545 123.224 1.00 36.61 +ATOM 2920 OE1 GLU A 463 -13.908 60.974 124.388 1.00 35.27 +ATOM 2921 OE2 GLU A 463 -14.916 59.590 122.977 1.00 37.46 +ATOM 2922 N LEU A 464 -11.554 65.078 122.147 1.00 22.07 +ATOM 2923 CA LEU A 464 -10.355 65.455 122.890 1.00 21.11 +ATOM 2924 C LEU A 464 -10.642 65.518 124.393 1.00 21.98 +ATOM 2925 O LEU A 464 -11.803 65.628 124.811 1.00 22.06 +ATOM 2926 CB LEU A 464 -9.842 66.808 122.388 1.00 19.05 +ATOM 2927 CG LEU A 464 -9.395 66.819 120.924 1.00 16.37 +ATOM 2928 CD1 LEU A 464 -8.837 68.157 120.522 1.00 13.48 +ATOM 2929 CD2 LEU A 464 -8.347 65.774 120.761 1.00 16.54 +ATOM 2930 N PRO A 465 -9.590 65.427 125.227 1.00 22.07 +ATOM 2931 CA PRO A 465 -8.182 65.280 124.824 1.00 21.69 +ATOM 2932 C PRO A 465 -7.825 63.834 124.495 1.00 21.97 +ATOM 2933 O PRO A 465 -8.625 62.929 124.746 1.00 22.78 +ATOM 2934 CB PRO A 465 -7.428 65.792 126.041 1.00 21.58 +ATOM 2935 CG PRO A 465 -8.308 65.328 127.172 1.00 21.76 +ATOM 2936 CD PRO A 465 -9.697 65.676 126.677 1.00 20.56 +ATOM 2937 N PHE A 466 -6.638 63.625 123.923 1.00 20.78 +ATOM 2938 CA PHE A 466 -6.177 62.277 123.577 1.00 20.66 +ATOM 2939 C PHE A 466 -5.329 61.748 124.717 1.00 20.33 +ATOM 2940 O PHE A 466 -5.068 62.476 125.676 1.00 20.50 +ATOM 2941 CB PHE A 466 -5.341 62.295 122.290 1.00 19.26 +ATOM 2942 CG PHE A 466 -6.156 62.193 121.026 1.00 17.15 +ATOM 2943 CD1 PHE A 466 -7.508 62.532 121.016 1.00 15.68 +ATOM 2944 CD2 PHE A 466 -5.556 61.793 119.829 1.00 15.88 +ATOM 2945 CE1 PHE A 466 -8.253 62.476 119.832 1.00 14.68 +ATOM 2946 CE2 PHE A 466 -6.289 61.733 118.639 1.00 12.39 +ATOM 2947 CZ PHE A 466 -7.638 62.075 118.642 1.00 14.17 +ATOM 2948 N THR A 467 -4.896 60.489 124.611 1.00 21.13 +ATOM 2949 CA THR A 467 -4.057 59.865 125.644 1.00 20.95 +ATOM 2950 C THR A 467 -2.867 60.794 125.895 1.00 22.64 +ATOM 2951 O THR A 467 -2.182 60.696 126.915 1.00 22.22 +ATOM 2952 CB THR A 467 -3.578 58.464 125.201 1.00 19.82 +ATOM 2953 OG1 THR A 467 -4.718 57.641 124.944 1.00 19.26 +ATOM 2954 CG2 THR A 467 -2.751 57.794 126.290 1.00 18.81 +ATOM 2955 N ILE A 468 -2.674 61.710 124.943 1.00 24.65 +ATOM 2956 CA ILE A 468 -1.654 62.756 124.946 1.00 25.17 +ATOM 2957 C ILE A 468 -0.314 62.319 124.383 1.00 27.82 +ATOM 2958 O ILE A 468 0.029 62.799 123.267 1.00 28.32 +ATOM 2959 CB ILE A 468 -1.464 63.356 126.354 1.00 22.13 +ATOM 2960 CG1 ILE A 468 -2.663 64.255 126.711 1.00 21.59 +ATOM 2961 CG2 ILE A 468 -0.182 64.134 126.403 1.00 21.66 +ATOM 2962 CD1 ILE A 468 -2.739 64.663 128.207 1.00 16.55 +TER 2963 ILE A 468 +ATOM 23705 C1 G39 B 500 -3.037 80.824 111.119 1.00 25.76 +ATOM 23706 O1A G39 B 500 -3.596 81.952 111.239 1.00 25.68 +ATOM 23707 O1B G39 B 500 -3.554 79.790 111.655 1.00 25.94 +ATOM 23708 C2 G39 B 500 -1.811 80.746 110.359 1.00 25.07 +ATOM 23709 C3 G39 B 500 -1.010 79.338 110.137 1.00 25.17 +ATOM 23710 C4 G39 B 500 0.112 79.327 109.004 1.00 24.24 +ATOM 23711 C5 G39 B 500 0.945 80.601 109.144 1.00 23.29 +ATOM 23712 N5 G39 B 500 1.987 80.533 108.049 1.00 24.46 +ATOM 23713 C10 G39 B 500 3.297 80.674 108.332 1.00 23.08 +ATOM 23714 O10 G39 B 500 3.766 80.873 109.491 1.00 23.57 +ATOM 23715 C11 G39 B 500 4.243 80.586 107.191 1.00 20.33 +ATOM 23716 C6 G39 B 500 -0.003 81.869 108.959 1.00 24.45 +ATOM 23717 C7 G39 B 500 -1.270 81.929 109.770 1.00 24.63 +ATOM 23718 O7 G39 B 500 0.846 83.091 109.139 1.00 23.32 +ATOM 23719 C8 G39 B 500 1.210 84.046 108.059 1.00 25.45 +ATOM 23720 C9 G39 B 500 0.051 84.703 107.259 1.00 26.89 +ATOM 23721 C81 G39 B 500 2.091 85.080 108.734 1.00 24.61 +ATOM 23722 C82 G39 B 500 3.462 84.549 109.008 1.00 22.43 +ATOM 23723 C91 G39 B 500 -1.010 85.458 108.077 1.00 26.50 +ATOM 23724 N4 G39 B 500 0.933 78.130 109.177 1.00 23.72 +END diff --git a/examples/thirdparty/prodigy/data/prot-prot.pdb b/examples/thirdparty/prodigy/data/prot-prot.pdb new file mode 100644 index 000000000..de5b6ec29 --- /dev/null +++ b/examples/thirdparty/prodigy/data/prot-prot.pdb @@ -0,0 +1,3686 @@ +HEADER TRANSFERASE 18-SEP-00 1GGR +TITLE COMPLEX OF ENZYME IIAGLC AND THE HISTIDINE-CONTAINING +TITLE 2 PHOSPHOCARRIER PROTEIN HPR FROM ESCHERICHIA COLI NMR, +TITLE 3 RESTRAINED REGULARIZED MEAN STRUCTURE +COMPND MOL_ID: 1; +COMPND 2 MOLECULE: PTS SYSTEM, GLUCOSE-SPECIFIC IIA COMPONENT; +COMPND 3 CHAIN: A; +COMPND 4 SYNONYM: EIIA-GLC, PHOSPHOTRANSFERASE ENZYME II, A +COMPND 5 COMPONENT; +COMPND 6 EC: 2.7.1.69; +COMPND 7 ENGINEERED: YES; +COMPND 8 MOL_ID: 2; +COMPND 9 MOLECULE: PHOSPHOCARRIER PROTEIN HPR; +COMPND 10 CHAIN: B; +COMPND 11 SYNONYM: HISTIDINE-CONTAINING PROTEIN; +COMPND 12 ENGINEERED: YES +SOURCE MOL_ID: 1; +SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; +SOURCE 3 ORGANISM_COMMON: BACTERIA; +SOURCE 4 STRAIN: GI698; +SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; +SOURCE 6 EXPRESSION_SYSTEM_COMMON: BACTERIA; +SOURCE 7 MOL_ID: 2; +SOURCE 8 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; +SOURCE 9 ORGANISM_COMMON: BACTERIA; +SOURCE 10 STRAIN: GI698; +SOURCE 11 EXPRESSION_SYSTEM: ESCHERICHIA COLI; +SOURCE 12 EXPRESSION_SYSTEM_COMMON: BACTERIA +KEYWDS PHOSPHOTRANSFERASE, TRANSFERASE, KINASE, SUGAR TRANSPORT, +KEYWDS 2 COMPLEX (TRANSFERASE/PHOSPHOCARRIER) +EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE +AUTHOR G.M.CLORE,G.WANG +REVDAT 1 15-NOV-00 1GGR 0 +DBREF 1GGR A 1 168 SWS P08837 PTGA_ECOLI 1 168 +DBREF 1GGR B 301 385 SWS P07006 PTHP_ECOLI 1 85 +SEQRES 1 A 168 GLY LEU PHE ASP LYS LEU LYS SER LEU VAL SER ASP ASP +SEQRES 2 A 168 LYS LYS ASP THR GLY THR ILE GLU ILE ILE ALA PRO LEU +SEQRES 3 A 168 SER GLY GLU ILE VAL ASN ILE GLU ASP VAL PRO ASP VAL +SEQRES 4 A 168 VAL PHE ALA GLU LYS ILE VAL GLY ASP GLY ILE ALA ILE +SEQRES 5 A 168 LYS PRO THR GLY ASN LYS MET VAL ALA PRO VAL ASP GLY +SEQRES 6 A 168 THR ILE GLY LYS ILE PHE GLU THR ASN HIS ALA PHE SER +SEQRES 7 A 168 ILE GLU SER ASP SER GLY VAL GLU LEU PHE VAL HIS PHE +SEQRES 8 A 168 GLY ILE ASP THR VAL GLU LEU LYS GLY GLU GLY PHE LYS +SEQRES 9 A 168 ARG ILE ALA GLU GLU GLY GLN ARG VAL LYS VAL GLY ASP +SEQRES 10 A 168 THR VAL ILE GLU PHE ASP LEU PRO LEU LEU GLU GLU LYS +SEQRES 11 A 168 ALA LYS SER THR LEU THR PRO VAL VAL ILE SER ASN MET +SEQRES 12 A 168 ASP GLU ILE LYS GLU LEU ILE LYS LEU SER GLY SER VAL +SEQRES 13 A 168 THR VAL GLY GLU THR PRO VAL ILE ARG ILE LYS LYS +SEQRES 1 B 85 MET PHE GLN GLN GLU VAL THR ILE THR ALA PRO ASN GLY +SEQRES 2 B 85 LEU HIS THR ARG PRO ALA ALA GLN PHE VAL LYS GLU ALA +SEQRES 3 B 85 LYS GLY PHE THR SER GLU ILE THR VAL THR SER ASN GLY +SEQRES 4 B 85 LYS SER ALA SER ALA LYS SER LEU PHE LYS LEU GLN THR +SEQRES 5 B 85 LEU GLY LEU THR GLN GLY THR VAL VAL THR ILE SER ALA +SEQRES 6 B 85 GLU GLY GLU ASP GLU GLN LYS ALA VAL GLU HIS LEU VAL +SEQRES 7 B 85 LYS LEU MET ALA GLU LEU GLU +HET PO3 200 4 +HETNAM PO3 PHOSPHITE ION +FORMUL 3 PO3 O3 P1 3- +HELIX 1 1 ASN A 32 VAL A 36 5 5 +HELIX 2 2 ASP A 38 GLU A 43 1 6 +HELIX 3 3 ASP A 94 LYS A 99 5 6 +HELIX 4 4 ASP A 123 ALA A 131 1 9 +HELIX 5 5 ASN A 142 ILE A 146 5 5 +HELIX 6 6 HIS B 315 LYS B 327 1 13 +HELIX 7 7 SER B 346 GLN B 351 1 6 +HELIX 8 8 ASP B 369 LEU B 384 1 16 +SHEET 1 A 3 ILE A 20 ILE A 23 0 +SHEET 2 A 3 PRO A 162 LYS A 167 -1 N VAL A 163 O ILE A 22 +SHEET 3 A 3 GLU A 148 LYS A 151 -1 O GLU A 148 N LYS A 167 +SHEET 1 B 8 ARG A 112 VAL A 113 0 +SHEET 2 B 8 GLY A 65 ILE A 70 -1 O GLY A 65 N VAL A 113 +SHEET 3 B 8 ALA A 76 SER A 81 -1 O SER A 78 N GLY A 68 +SHEET 4 B 8 GLU A 86 HIS A 90 -1 N LEU A 87 O ILE A 79 +SHEET 5 B 8 THR A 136 ILE A 140 -1 O PRO A 137 N HIS A 90 +SHEET 6 B 8 ASP A 48 PRO A 54 -1 O ASP A 48 N ILE A 140 +SHEET 7 B 8 GLY A 28 VAL A 31 -1 O GLU A 29 N LYS A 53 +SHEET 8 B 8 SER A 155 VAL A 156 -1 N VAL A 156 O GLY A 28 +SHEET 1 C 3 LYS A 58 VAL A 60 0 +SHEET 2 C 3 THR A 118 PHE A 122 -1 N VAL A 119 O MET A 59 +SHEET 3 C 3 PHE A 103 ARG A 105 -1 O LYS A 104 N GLU A 121 +SHEET 1 D 4 PHE B 302 THR B 307 0 +SHEET 2 D 4 VAL B 360 GLU B 366 -1 N VAL B 361 O VAL B 306 +SHEET 3 D 4 GLU B 332 SER B 337 -1 O GLU B 332 N GLU B 366 +SHEET 4 D 4 LYS B 340 SER B 343 -1 O LYS B 340 N SER B 337 +CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 +ORIGX1 1.000000 0.000000 0.000000 0.00000 +ORIGX2 0.000000 1.000000 0.000000 0.00000 +ORIGX3 0.000000 0.000000 1.000000 0.00000 +SCALE1 1.000000 0.000000 0.000000 0.00000 +SCALE2 0.000000 1.000000 0.000000 0.00000 +SCALE3 0.000000 0.000000 1.000000 0.00000 +REMARK model 1 +ATOM 1 N THR A 19 51.382 49.015 12.266 1.00 0.15 A +ATOM 2 CA THR A 19 51.464 47.969 13.285 1.00 0.14 A +ATOM 3 C THR A 19 50.687 48.310 14.540 1.00 0.13 A +ATOM 4 O THR A 19 50.904 49.317 15.188 1.00 0.13 A +ATOM 5 CB THR A 19 52.915 47.521 13.637 1.00 0.13 A +ATOM 6 OG1 THR A 19 52.992 46.104 13.665 1.00 0.13 A +ATOM 7 CG2 THR A 19 53.358 48.069 15.002 1.00 0.13 A +ATOM 8 HA THR A 19 50.923 47.107 12.926 1.00 0.13 A +ATOM 9 HB THR A 19 53.588 47.896 12.881 1.00 0.14 A +ATOM 10 HG1 THR A 19 53.378 45.846 14.507 1.00 0.12 A +ATOM 11 1HG2 THR A 19 53.166 49.130 15.042 1.00 0.14 A +ATOM 12 2HG2 THR A 19 54.413 47.892 15.134 1.00 0.13 A +ATOM 13 3HG2 THR A 19 52.807 47.570 15.786 1.00 0.12 A +ATOM 14 N ILE A 20 49.771 47.410 14.891 1.00 0.12 A +ATOM 15 CA ILE A 20 49.010 47.580 16.076 1.00 0.12 A +ATOM 16 C ILE A 20 49.479 46.624 17.158 1.00 0.11 A +ATOM 17 O ILE A 20 49.608 45.428 16.967 1.00 0.10 A +ATOM 18 CB ILE A 20 47.541 47.355 15.789 1.00 0.12 A +ATOM 19 CG1 ILE A 20 47.124 48.242 14.572 1.00 0.13 A +ATOM 20 CG2 ILE A 20 46.684 47.697 17.013 1.00 0.11 A +ATOM 21 CD1 ILE A 20 46.614 47.391 13.409 1.00 0.13 A +ATOM 22 H ILE A 20 49.624 46.623 14.326 1.00 0.12 A +ATOM 23 HA ILE A 20 49.150 48.583 16.451 1.00 0.12 A +ATOM 24 HB ILE A 20 47.395 46.391 15.588 1.00 0.11 A +ATOM 25 1HG1 ILE A 20 46.340 48.920 14.868 1.00 0.13 A +ATOM 26 2HG1 ILE A 20 47.969 48.819 14.228 1.00 0.13 A +ATOM 27 1HG2 ILE A 20 46.783 48.744 17.248 1.00 0.12 A +ATOM 28 2HG2 ILE A 20 47.003 47.102 17.855 1.00 0.10 A +ATOM 29 3HG2 ILE A 20 45.648 47.475 16.790 1.00 0.11 A +ATOM 30 1HD1 ILE A 20 46.287 48.026 12.613 1.00 0.14 A +ATOM 31 2HD1 ILE A 20 45.792 46.811 13.736 1.00 0.13 A +ATOM 32 3HD1 ILE A 20 47.404 46.757 13.049 1.00 0.13 A +ATOM 33 N GLU A 21 49.697 47.189 18.314 1.00 0.10 A +ATOM 34 CA GLU A 21 50.078 46.438 19.494 1.00 0.10 A +ATOM 35 C GLU A 21 48.864 46.222 20.401 1.00 0.09 A +ATOM 36 O GLU A 21 48.211 47.155 20.833 1.00 0.09 A +ATOM 37 CB GLU A 21 51.156 47.156 20.303 1.00 0.10 A +ATOM 38 CG GLU A 21 52.561 46.600 20.010 1.00 0.10 A +ATOM 39 CD GLU A 21 53.641 47.575 20.497 1.00 0.11 A +ATOM 40 OE1 GLU A 21 53.427 48.234 21.507 1.00 0.11 A +ATOM 41 OE2 GLU A 21 54.669 47.650 19.836 1.00 0.12 A +ATOM 42 H GLU A 21 49.566 48.157 18.394 1.00 0.11 A +ATOM 43 HA GLU A 21 50.456 45.474 19.187 1.00 0.09 A +ATOM 44 1HB GLU A 21 51.140 48.204 20.049 1.00 0.11 A +ATOM 45 2HB GLU A 21 50.958 47.051 21.363 1.00 0.10 A +ATOM 46 1HG GLU A 21 52.684 45.657 20.517 1.00 0.10 A +ATOM 47 2HG GLU A 21 52.677 46.451 18.951 1.00 0.10 A +ATOM 48 N ILE A 22 48.608 44.981 20.708 1.00 0.08 A +ATOM 49 CA ILE A 22 47.531 44.605 21.626 1.00 0.07 A +ATOM 50 C ILE A 22 48.175 44.467 22.989 1.00 0.07 A +ATOM 51 O ILE A 22 49.129 43.730 23.172 1.00 0.06 A +ATOM 52 CB ILE A 22 46.798 43.298 21.232 1.00 0.07 A +ATOM 53 CG1 ILE A 22 46.411 43.262 19.744 1.00 0.07 A +ATOM 54 CG2 ILE A 22 45.569 43.084 22.117 1.00 0.06 A +ATOM 55 CD1 ILE A 22 45.253 44.213 19.451 1.00 0.08 A +ATOM 56 H ILE A 22 49.163 44.275 20.317 1.00 0.08 A +ATOM 57 HA ILE A 22 46.807 45.406 21.646 1.00 0.07 A +ATOM 58 HB ILE A 22 47.473 42.481 21.431 1.00 0.06 A +ATOM 59 1HG1 ILE A 22 47.265 43.544 19.149 1.00 0.08 A +ATOM 60 2HG1 ILE A 22 46.117 42.254 19.485 1.00 0.07 A +ATOM 61 1HG2 ILE A 22 44.884 43.906 21.994 1.00 0.06 A +ATOM 62 2HG2 ILE A 22 45.879 43.021 23.150 1.00 0.05 A +ATOM 63 3HG2 ILE A 22 45.081 42.162 21.833 1.00 0.06 A +ATOM 64 1HD1 ILE A 22 44.992 44.141 18.406 1.00 0.09 A +ATOM 65 2HD1 ILE A 22 45.551 45.223 19.679 1.00 0.08 A +ATOM 66 3HD1 ILE A 22 44.396 43.944 20.050 1.00 0.08 A +ATOM 67 N ILE A 23 47.674 45.200 23.936 1.00 0.07 A +ATOM 68 CA ILE A 23 48.214 45.187 25.257 1.00 0.06 A +ATOM 69 C ILE A 23 47.524 44.180 26.133 1.00 0.05 A +ATOM 70 O ILE A 23 46.365 43.887 25.994 1.00 0.05 A +ATOM 71 CB ILE A 23 48.244 46.597 25.858 1.00 0.07 A +ATOM 72 CG1 ILE A 23 48.863 47.564 24.839 1.00 0.08 A +ATOM 73 CG2 ILE A 23 49.061 46.606 27.152 1.00 0.08 A +ATOM 74 CD1 ILE A 23 50.332 47.223 24.576 1.00 0.09 A +ATOM 75 H ILE A 23 46.910 45.780 23.732 1.00 0.07 A +ATOM 76 HA ILE A 23 49.222 44.798 25.223 1.00 0.07 A +ATOM 77 HB ILE A 23 47.234 46.910 26.078 1.00 0.07 A +ATOM 78 1HG1 ILE A 23 48.316 47.493 23.910 1.00 0.08 A +ATOM 79 2HG1 ILE A 23 48.794 48.570 25.212 1.00 0.09 A +ATOM 80 1HG2 ILE A 23 49.214 47.627 27.472 1.00 0.08 A +ATOM 81 2HG2 ILE A 23 50.019 46.141 26.974 1.00 0.08 A +ATOM 82 3HG2 ILE A 23 48.533 46.062 27.919 1.00 0.07 A +ATOM 83 1HD1 ILE A 23 50.386 46.363 23.939 1.00 0.08 A +ATOM 84 2HD1 ILE A 23 50.843 47.022 25.503 1.00 0.09 A +ATOM 85 3HD1 ILE A 23 50.805 48.057 24.086 1.00 0.10 A +ATOM 86 N ALA A 24 48.283 43.611 27.034 1.00 0.05 A +ATOM 87 CA ALA A 24 47.709 42.611 27.878 1.00 0.05 A +ATOM 88 C ALA A 24 46.519 43.065 28.708 1.00 0.04 A +ATOM 89 O ALA A 24 46.580 44.043 29.435 1.00 0.05 A +ATOM 90 CB ALA A 24 48.786 42.193 28.879 1.00 0.05 A +ATOM 91 H ALA A 24 49.223 43.872 27.129 1.00 0.06 A +ATOM 92 HA ALA A 24 47.403 41.760 27.287 1.00 0.04 A +ATOM 93 1HB ALA A 24 49.615 41.763 28.342 1.00 0.05 A +ATOM 94 2HB ALA A 24 48.380 41.462 29.565 1.00 0.05 A +ATOM 95 3HB ALA A 24 49.123 43.058 29.431 1.00 0.06 A +ATOM 96 N PRO A 25 45.399 42.414 28.524 1.00 0.04 A +ATOM 97 CA PRO A 25 44.171 42.792 29.225 1.00 0.04 A +ATOM 98 C PRO A 25 44.198 42.324 30.711 1.00 0.04 A +ATOM 99 O PRO A 25 43.497 42.859 31.546 1.00 0.04 A +ATOM 100 CB PRO A 25 43.034 42.136 28.433 1.00 0.03 A +ATOM 101 CG PRO A 25 43.668 41.077 27.566 1.00 0.03 A +ATOM 102 CD PRO A 25 45.127 41.454 27.409 1.00 0.03 A +ATOM 103 HA PRO A 25 44.056 43.865 29.233 1.00 0.04 A +ATOM 104 1HB PRO A 25 42.321 41.680 29.111 1.00 0.03 A +ATOM 105 2HB PRO A 25 42.532 42.871 27.819 1.00 0.04 A +ATOM 106 1HG PRO A 25 43.596 40.106 28.034 1.00 0.03 A +ATOM 107 2HG PRO A 25 43.187 41.050 26.591 1.00 0.04 A +ATOM 108 1HD PRO A 25 45.757 40.589 27.432 1.00 0.03 A +ATOM 109 2HD PRO A 25 45.251 41.982 26.462 1.00 0.04 A +ATOM 110 N LEU A 26 45.039 41.362 31.023 1.00 0.04 A +ATOM 111 CA LEU A 26 45.258 40.877 32.399 1.00 0.05 A +ATOM 112 C LEU A 26 46.724 40.422 32.577 1.00 0.05 A +ATOM 113 O LEU A 26 47.431 40.153 31.624 1.00 0.05 A +ATOM 114 CB LEU A 26 44.284 39.798 33.045 1.00 0.05 A +ATOM 115 CG LEU A 26 43.438 38.919 32.089 1.00 0.04 A +ATOM 116 CD1 LEU A 26 44.229 38.417 30.898 1.00 0.04 A +ATOM 117 CD2 LEU A 26 42.899 37.696 32.874 1.00 0.05 A +ATOM 118 H LEU A 26 45.575 40.961 30.308 1.00 0.04 A +ATOM 119 HA LEU A 26 45.222 41.745 33.039 1.00 0.05 A +ATOM 120 1HB LEU A 26 44.874 39.134 33.658 1.00 0.05 A +ATOM 121 2HB LEU A 26 43.599 40.324 33.702 1.00 0.05 A +ATOM 122 HG LEU A 26 42.616 39.483 31.733 1.00 0.04 A +ATOM 123 1HD1 LEU A 26 43.679 37.609 30.428 1.00 0.04 A +ATOM 124 2HD1 LEU A 26 45.189 38.057 31.226 1.00 0.05 A +ATOM 125 3HD1 LEU A 26 44.355 39.218 30.192 1.00 0.04 A +ATOM 126 1HD2 LEU A 26 42.000 37.337 32.408 1.00 0.05 A +ATOM 127 2HD2 LEU A 26 42.681 37.971 33.897 1.00 0.06 A +ATOM 128 3HD2 LEU A 26 43.638 36.911 32.862 1.00 0.06 A +ATOM 129 N SER A 27 47.172 40.328 33.834 1.00 0.06 A +ATOM 130 CA SER A 27 48.525 39.860 34.118 1.00 0.07 A +ATOM 131 C SER A 27 48.590 38.363 34.115 1.00 0.07 A +ATOM 132 O SER A 27 47.653 37.682 34.484 1.00 0.07 A +ATOM 133 CB SER A 27 49.037 40.332 35.469 1.00 0.08 A +ATOM 134 OG SER A 27 49.037 41.751 35.525 1.00 0.08 A +ATOM 135 H SER A 27 46.570 40.538 34.578 1.00 0.06 A +ATOM 136 HA SER A 27 49.188 40.230 33.349 1.00 0.07 A +ATOM 137 1HB SER A 27 48.400 39.947 36.248 1.00 0.08 A +ATOM 138 2HB SER A 27 50.042 39.959 35.616 1.00 0.09 A +ATOM 139 HG SER A 27 49.820 42.026 36.012 1.00 0.09 A +ATOM 140 N GLY A 28 49.717 37.836 33.717 1.00 0.08 A +ATOM 141 CA GLY A 28 49.856 36.412 33.714 1.00 0.08 A +ATOM 142 C GLY A 28 50.928 35.974 32.741 1.00 0.08 A +ATOM 143 O GLY A 28 51.862 36.691 32.426 1.00 0.08 A +ATOM 144 H GLY A 28 50.457 38.414 33.433 1.00 0.08 A +ATOM 145 1HA GLY A 28 50.136 36.077 34.702 1.00 0.09 A +ATOM 146 2HA GLY A 28 48.916 35.960 33.435 1.00 0.08 A +ATOM 147 N GLU A 29 50.783 34.763 32.308 1.00 0.08 A +ATOM 148 CA GLU A 29 51.720 34.110 31.417 1.00 0.09 A +ATOM 149 C GLU A 29 51.052 33.780 30.117 1.00 0.08 A +ATOM 150 O GLU A 29 49.942 33.287 30.091 1.00 0.08 A +ATOM 151 CB GLU A 29 52.330 32.838 32.078 1.00 0.10 A +ATOM 152 CG GLU A 29 53.877 32.953 32.241 1.00 0.11 A +ATOM 153 CD GLU A 29 54.571 31.908 31.374 1.00 0.11 A +ATOM 154 OE1 GLU A 29 54.250 30.741 31.546 1.00 0.12 A +ATOM 155 OE2 GLU A 29 55.393 32.287 30.552 1.00 0.11 A +ATOM 156 H GLU A 29 50.004 34.254 32.612 1.00 0.09 A +ATOM 157 HA GLU A 29 52.517 34.799 31.176 1.00 0.09 A +ATOM 158 1HB GLU A 29 51.882 32.714 33.055 1.00 0.10 A +ATOM 159 2HB GLU A 29 52.090 31.966 31.480 1.00 0.10 A +ATOM 160 1HG GLU A 29 54.223 33.932 31.955 1.00 0.10 A +ATOM 161 2HG GLU A 29 54.142 32.778 33.273 1.00 0.11 A +ATOM 162 N ILE A 30 51.718 34.059 29.015 1.00 0.08 A +ATOM 163 CA ILE A 30 51.087 33.766 27.768 1.00 0.07 A +ATOM 164 C ILE A 30 51.099 32.268 27.509 1.00 0.08 A +ATOM 165 O ILE A 30 52.035 31.557 27.813 1.00 0.09 A +ATOM 166 CB ILE A 30 51.692 34.547 26.609 1.00 0.07 A +ATOM 167 CG1 ILE A 30 51.330 36.020 26.804 1.00 0.06 A +ATOM 168 CG2 ILE A 30 51.132 34.032 25.275 1.00 0.07 A +ATOM 169 CD1 ILE A 30 51.972 36.885 25.722 1.00 0.06 A +ATOM 170 H ILE A 30 52.610 34.462 29.048 1.00 0.08 A +ATOM 171 HA ILE A 30 50.039 34.014 27.843 1.00 0.07 A +ATOM 172 HB ILE A 30 52.766 34.433 26.617 1.00 0.07 A +ATOM 173 1HG1 ILE A 30 50.257 36.128 26.758 1.00 0.06 A +ATOM 174 2HG1 ILE A 30 51.680 36.344 27.772 1.00 0.07 A +ATOM 175 1HG2 ILE A 30 50.057 33.973 25.338 1.00 0.06 A +ATOM 176 2HG2 ILE A 30 51.534 33.050 25.070 1.00 0.07 A +ATOM 177 3HG2 ILE A 30 51.411 34.703 24.478 1.00 0.06 A +ATOM 178 1HD1 ILE A 30 51.676 36.525 24.748 1.00 0.06 A +ATOM 179 2HD1 ILE A 30 53.046 36.843 25.814 1.00 0.07 A +ATOM 180 3HD1 ILE A 30 51.642 37.901 25.842 1.00 0.06 A +ATOM 181 N VAL A 31 50.007 31.804 26.952 1.00 0.08 A +ATOM 182 CA VAL A 31 49.820 30.401 26.658 1.00 0.09 A +ATOM 183 C VAL A 31 49.295 30.264 25.218 1.00 0.09 A +ATOM 184 O VAL A 31 48.700 31.177 24.679 1.00 0.08 A +ATOM 185 CB VAL A 31 48.846 29.829 27.687 1.00 0.09 A +ATOM 186 CG1 VAL A 31 48.242 28.510 27.205 1.00 0.10 A +ATOM 187 CG2 VAL A 31 49.548 29.614 29.025 1.00 0.10 A +ATOM 188 H VAL A 31 49.288 32.430 26.726 1.00 0.07 A +ATOM 189 HA VAL A 31 50.766 29.883 26.721 1.00 0.09 A +ATOM 190 HB VAL A 31 48.045 30.541 27.833 1.00 0.09 A +ATOM 191 1HG1 VAL A 31 47.644 28.687 26.323 1.00 0.10 A +ATOM 192 2HG1 VAL A 31 47.614 28.103 27.981 1.00 0.11 A +ATOM 193 3HG1 VAL A 31 49.031 27.814 26.973 1.00 0.11 A +ATOM 194 1HG2 VAL A 31 49.961 30.551 29.368 1.00 0.09 A +ATOM 195 2HG2 VAL A 31 50.338 28.889 28.910 1.00 0.10 A +ATOM 196 3HG2 VAL A 31 48.829 29.253 29.749 1.00 0.10 A +ATOM 197 N ASN A 32 49.517 29.120 24.605 1.00 0.09 A +ATOM 198 CA ASN A 32 49.037 28.878 23.238 1.00 0.10 A +ATOM 199 C ASN A 32 47.549 28.716 23.211 1.00 0.10 A +ATOM 200 O ASN A 32 46.967 28.050 24.047 1.00 0.10 A +ATOM 201 CB ASN A 32 49.563 27.579 22.571 1.00 0.11 A +ATOM 202 CG ASN A 32 51.071 27.562 22.387 1.00 0.11 A +ATOM 203 OD1 ASN A 32 51.680 26.500 22.400 1.00 0.11 A +ATOM 204 ND2 ASN A 32 51.695 28.684 22.193 1.00 0.10 A +ATOM 205 H ASN A 32 49.997 28.406 25.074 1.00 0.10 A +ATOM 206 HA ASN A 32 49.339 29.714 22.626 1.00 0.09 A +ATOM 207 1HB ASN A 32 49.281 26.740 23.179 1.00 0.11 A +ATOM 208 2HB ASN A 32 49.101 27.487 21.623 1.00 0.11 A +ATOM 209 1HD2 ASN A 32 51.189 29.523 22.175 1.00 0.09 A +ATOM 210 2HD2 ASN A 32 52.663 28.692 22.052 1.00 0.10 A +ATOM 211 N ILE A 33 46.921 29.294 22.238 1.00 0.10 A +ATOM 212 CA ILE A 33 45.491 29.170 22.170 1.00 0.10 A +ATOM 213 C ILE A 33 45.147 27.742 21.863 1.00 0.11 A +ATOM 214 O ILE A 33 44.070 27.266 22.185 1.00 0.12 A +ATOM 215 CB ILE A 33 44.833 30.207 21.226 1.00 0.10 A +ATOM 216 CG1 ILE A 33 43.340 30.333 21.601 1.00 0.10 A +ATOM 217 CG2 ILE A 33 44.983 29.790 19.753 1.00 0.10 A +ATOM 218 CD1 ILE A 33 42.789 31.682 21.188 1.00 0.09 A +ATOM 219 H ILE A 33 47.413 29.817 21.571 1.00 0.09 A +ATOM 220 HA ILE A 33 45.087 29.304 23.161 1.00 0.10 A +ATOM 221 HB ILE A 33 45.322 31.162 21.366 1.00 0.09 A +ATOM 222 1HG1 ILE A 33 42.780 29.557 21.112 1.00 0.11 A +ATOM 223 2HG1 ILE A 33 43.218 30.236 22.670 1.00 0.10 A +ATOM 224 1HG2 ILE A 33 44.173 29.135 19.473 1.00 0.11 A +ATOM 225 2HG2 ILE A 33 45.924 29.280 19.614 1.00 0.10 A +ATOM 226 3HG2 ILE A 33 44.961 30.674 19.128 1.00 0.10 A +ATOM 227 1HD1 ILE A 33 42.747 31.748 20.112 1.00 0.10 A +ATOM 228 2HD1 ILE A 33 43.419 32.465 21.581 1.00 0.08 A +ATOM 229 3HD1 ILE A 33 41.799 31.775 21.599 1.00 0.09 A +ATOM 230 N GLU A 34 46.048 27.032 21.271 1.00 0.12 A +ATOM 231 CA GLU A 34 45.754 25.673 20.965 1.00 0.13 A +ATOM 232 C GLU A 34 45.783 24.833 22.210 1.00 0.13 A +ATOM 233 O GLU A 34 45.287 23.721 22.201 1.00 0.14 A +ATOM 234 CB GLU A 34 46.584 25.088 19.807 1.00 0.13 A +ATOM 235 CG GLU A 34 48.023 25.596 19.810 1.00 0.13 A +ATOM 236 CD GLU A 34 48.106 26.983 19.159 1.00 0.12 A +ATOM 237 OE1 GLU A 34 47.335 27.241 18.249 1.00 0.12 A +ATOM 238 OE2 GLU A 34 48.956 27.756 19.566 1.00 0.11 A +ATOM 239 H GLU A 34 46.905 27.437 21.023 1.00 0.11 A +ATOM 240 HA GLU A 34 44.709 25.605 20.699 1.00 0.13 A +ATOM 241 1HB GLU A 34 46.598 24.011 19.897 1.00 0.14 A +ATOM 242 2HB GLU A 34 46.115 25.351 18.870 1.00 0.13 A +ATOM 243 1HG GLU A 34 48.377 25.638 20.819 1.00 0.12 A +ATOM 244 2HG GLU A 34 48.639 24.910 19.247 1.00 0.13 A +ATOM 245 N ASP A 35 46.322 25.341 23.287 1.00 0.13 A +ATOM 246 CA ASP A 35 46.372 24.560 24.500 1.00 0.13 A +ATOM 247 C ASP A 35 45.216 24.829 25.447 1.00 0.13 A +ATOM 248 O ASP A 35 45.229 24.396 26.586 1.00 0.14 A +ATOM 249 CB ASP A 35 47.701 24.694 25.230 1.00 0.13 A +ATOM 250 CG ASP A 35 48.870 24.444 24.279 1.00 0.13 A +ATOM 251 OD1 ASP A 35 48.631 23.898 23.215 1.00 0.13 A +ATOM 252 OD2 ASP A 35 49.988 24.807 24.629 1.00 0.13 A +ATOM 253 H ASP A 35 46.711 26.239 23.263 1.00 0.12 A +ATOM 254 HA ASP A 35 46.220 23.521 24.247 1.00 0.14 A +ATOM 255 1HB ASP A 35 47.779 25.687 25.645 1.00 0.12 A +ATOM 256 2HB ASP A 35 47.736 23.970 26.032 1.00 0.14 A +ATOM 257 N VAL A 36 44.221 25.503 24.981 1.00 0.13 A +ATOM 258 CA VAL A 36 43.039 25.810 25.801 1.00 0.13 A +ATOM 259 C VAL A 36 42.030 24.651 25.721 1.00 0.14 A +ATOM 260 O VAL A 36 41.819 24.076 24.669 1.00 0.15 A +ATOM 261 CB VAL A 36 42.350 27.104 25.340 1.00 0.12 A +ATOM 262 CG1 VAL A 36 40.876 27.140 25.723 1.00 0.12 A +ATOM 263 CG2 VAL A 36 43.056 28.339 25.913 1.00 0.11 A +ATOM 264 H VAL A 36 44.261 25.837 24.060 1.00 0.13 A +ATOM 265 HA VAL A 36 43.347 25.925 26.830 1.00 0.13 A +ATOM 266 HB VAL A 36 42.418 27.153 24.262 1.00 0.12 A +ATOM 267 1HG1 VAL A 36 40.513 28.152 25.637 1.00 0.12 A +ATOM 268 2HG1 VAL A 36 40.762 26.789 26.731 1.00 0.13 A +ATOM 269 3HG1 VAL A 36 40.317 26.503 25.056 1.00 0.13 A +ATOM 270 1HG2 VAL A 36 42.689 29.222 25.408 1.00 0.10 A +ATOM 271 2HG2 VAL A 36 44.120 28.253 25.757 1.00 0.11 A +ATOM 272 3HG2 VAL A 36 42.847 28.418 26.969 1.00 0.11 A +ATOM 273 N PRO A 37 41.556 24.207 26.863 1.00 0.15 A +ATOM 274 CA PRO A 37 40.691 23.029 26.956 1.00 0.16 A +ATOM 275 C PRO A 37 39.301 23.299 26.377 1.00 0.16 A +ATOM 276 O PRO A 37 38.285 22.999 26.981 1.00 0.16 A +ATOM 277 CB PRO A 37 40.585 22.740 28.471 1.00 0.16 A +ATOM 278 CG PRO A 37 41.360 23.779 29.226 1.00 0.15 A +ATOM 279 CD PRO A 37 42.043 24.660 28.210 1.00 0.14 A +ATOM 280 HA PRO A 37 41.132 22.191 26.438 1.00 0.16 A +ATOM 281 1HB PRO A 37 39.551 22.765 28.794 1.00 0.16 A +ATOM 282 2HB PRO A 37 40.989 21.758 28.680 1.00 0.17 A +ATOM 283 1HG PRO A 37 40.699 24.378 29.843 1.00 0.15 A +ATOM 284 2HG PRO A 37 42.105 23.302 29.862 1.00 0.15 A +ATOM 285 1HD PRO A 37 41.841 25.698 28.395 1.00 0.13 A +ATOM 286 2HD PRO A 37 43.120 24.469 28.271 1.00 0.14 A +ATOM 287 N ASP A 38 39.245 23.864 25.218 1.00 0.16 A +ATOM 288 CA ASP A 38 37.962 24.146 24.610 1.00 0.16 A +ATOM 289 C ASP A 38 38.145 24.095 23.103 1.00 0.16 A +ATOM 290 O ASP A 38 38.884 24.871 22.531 1.00 0.15 A +ATOM 291 CB ASP A 38 37.414 25.506 25.059 1.00 0.15 A +ATOM 292 CG ASP A 38 35.978 25.667 24.558 1.00 0.17 A +ATOM 293 OD1 ASP A 38 35.556 24.849 23.757 1.00 0.22 A +ATOM 294 OD2 ASP A 38 35.322 26.601 24.987 1.00 0.18 A +ATOM 295 H ASP A 38 40.072 24.105 24.751 1.00 0.15 A +ATOM 296 HA ASP A 38 37.263 23.373 24.893 1.00 0.17 A +ATOM 297 1HB ASP A 38 37.428 25.561 26.138 1.00 0.15 A +ATOM 298 2HB ASP A 38 38.025 26.294 24.651 1.00 0.14 A +ATOM 299 N VAL A 39 37.501 23.164 22.447 1.00 0.17 A +ATOM 300 CA VAL A 39 37.679 23.064 21.011 1.00 0.17 A +ATOM 301 C VAL A 39 37.250 24.328 20.309 1.00 0.17 A +ATOM 302 O VAL A 39 37.896 24.717 19.352 1.00 0.16 A +ATOM 303 CB VAL A 39 37.057 21.845 20.323 1.00 0.19 A +ATOM 304 CG1 VAL A 39 37.626 20.565 20.939 1.00 0.19 A +ATOM 305 CG2 VAL A 39 35.539 21.871 20.517 1.00 0.19 A +ATOM 306 H VAL A 39 36.919 22.533 22.921 1.00 0.18 A +ATOM 307 HA VAL A 39 38.740 23.044 20.814 1.00 0.17 A +ATOM 308 HB VAL A 39 37.288 21.870 19.268 1.00 0.19 A +ATOM 309 1HG1 VAL A 39 37.023 19.722 20.637 1.00 1.03 A +ATOM 310 2HG1 VAL A 39 37.615 20.649 22.015 1.00 1.02 A +ATOM 311 3HG1 VAL A 39 38.641 20.423 20.598 1.00 1.04 A +ATOM 312 1HG2 VAL A 39 35.095 21.038 19.991 1.00 1.01 A +ATOM 313 2HG2 VAL A 39 35.142 22.796 20.126 1.00 1.02 A +ATOM 314 3HG2 VAL A 39 35.309 21.796 21.569 1.00 1.05 A +ATOM 315 N VAL A 40 36.211 24.997 20.712 1.00 0.17 A +ATOM 316 CA VAL A 40 35.874 26.201 19.968 1.00 0.16 A +ATOM 317 C VAL A 40 36.968 27.239 20.038 1.00 0.15 A +ATOM 318 O VAL A 40 37.196 27.944 19.070 1.00 0.15 A +ATOM 319 CB VAL A 40 34.454 26.799 20.091 1.00 0.17 A +ATOM 320 CG1 VAL A 40 33.446 25.870 19.410 1.00 0.19 A +ATOM 321 CG2 VAL A 40 34.097 26.943 21.575 1.00 0.27 A +ATOM 322 H VAL A 40 35.677 24.686 21.471 1.00 0.17 A +ATOM 323 HA VAL A 40 36.029 25.977 18.924 1.00 0.17 A +ATOM 324 HB VAL A 40 34.429 27.769 19.615 1.00 0.22 A +ATOM 325 1HG1 VAL A 40 32.451 26.274 19.523 1.00 1.06 A +ATOM 326 2HG1 VAL A 40 33.492 24.892 19.866 1.00 0.99 A +ATOM 327 3HG1 VAL A 40 33.684 25.789 18.360 1.00 1.03 A +ATOM 328 1HG2 VAL A 40 33.268 27.622 21.680 1.00 1.06 A +ATOM 329 2HG2 VAL A 40 34.948 27.330 22.116 1.00 1.06 A +ATOM 330 3HG2 VAL A 40 33.824 25.977 21.977 1.00 1.07 A +ATOM 331 N PHE A 41 37.652 27.365 21.090 1.00 0.14 A +ATOM 332 CA PHE A 41 38.695 28.359 21.124 1.00 0.13 A +ATOM 333 C PHE A 41 39.985 27.785 20.503 1.00 0.13 A +ATOM 334 O PHE A 41 40.689 28.436 19.757 1.00 0.13 A +ATOM 335 CB PHE A 41 39.002 28.721 22.577 1.00 0.12 A +ATOM 336 CG PHE A 41 37.992 29.708 23.111 1.00 0.13 A +ATOM 337 CD1 PHE A 41 38.161 31.083 22.855 1.00 0.16 A +ATOM 338 CD2 PHE A 41 36.901 29.264 23.880 1.00 0.16 A +ATOM 339 CE1 PHE A 41 37.241 32.013 23.370 1.00 0.18 A +ATOM 340 CE2 PHE A 41 35.976 30.196 24.392 1.00 0.19 A +ATOM 341 CZ PHE A 41 36.149 31.571 24.138 1.00 0.18 A +ATOM 342 H PHE A 41 37.442 26.821 21.878 1.00 0.15 A +ATOM 343 HA PHE A 41 38.369 29.241 20.595 1.00 0.13 A +ATOM 344 1HB PHE A 41 38.974 27.827 23.178 1.00 0.14 A +ATOM 345 2HB PHE A 41 39.989 29.161 22.643 1.00 0.11 A +ATOM 346 HD1 PHE A 41 38.999 31.422 22.264 1.00 0.20 A +ATOM 347 HD2 PHE A 41 36.770 28.210 24.074 1.00 0.18 A +ATOM 348 HE1 PHE A 41 37.372 33.067 23.174 1.00 0.21 A +ATOM 349 HE2 PHE A 41 35.138 29.857 24.982 1.00 0.23 A +ATOM 350 HZ PHE A 41 35.448 32.287 24.536 1.00 0.21 A +ATOM 351 N ALA A 42 40.298 26.573 20.872 1.00 0.14 A +ATOM 352 CA ALA A 42 41.505 25.895 20.427 1.00 0.14 A +ATOM 353 C ALA A 42 41.474 25.777 18.945 1.00 0.14 A +ATOM 354 O ALA A 42 42.496 25.893 18.288 1.00 0.14 A +ATOM 355 CB ALA A 42 41.653 24.529 21.098 1.00 0.15 A +ATOM 356 H ALA A 42 39.711 26.101 21.497 1.00 0.14 A +ATOM 357 HA ALA A 42 42.362 26.503 20.676 1.00 0.13 A +ATOM 358 1HB ALA A 42 40.920 23.848 20.693 1.00 0.16 A +ATOM 359 2HB ALA A 42 41.501 24.632 22.161 1.00 0.14 A +ATOM 360 3HB ALA A 42 42.644 24.142 20.911 1.00 0.15 A +ATOM 361 N GLU A 43 40.322 25.563 18.389 1.00 0.15 A +ATOM 362 CA GLU A 43 40.269 25.443 16.937 1.00 0.16 A +ATOM 363 C GLU A 43 40.012 26.815 16.290 1.00 0.15 A +ATOM 364 O GLU A 43 39.855 26.951 15.094 1.00 0.16 A +ATOM 365 CB GLU A 43 39.339 24.302 16.419 1.00 0.17 A +ATOM 366 CG GLU A 43 39.837 22.956 16.950 1.00 0.20 A +ATOM 367 CD GLU A 43 38.973 21.830 16.381 1.00 0.57 A +ATOM 368 OE1 GLU A 43 37.963 22.137 15.769 1.00 0.81 A +ATOM 369 OE2 GLU A 43 39.335 20.680 16.566 1.00 0.70 A +ATOM 370 H GLU A 43 39.514 25.479 18.937 1.00 0.15 A +ATOM 371 HA GLU A 43 41.269 25.254 16.578 1.00 0.16 A +ATOM 372 1HB GLU A 43 38.330 24.475 16.765 1.00 0.17 A +ATOM 373 2HB GLU A 43 39.352 24.289 15.339 1.00 0.20 A +ATOM 374 1HG GLU A 43 40.865 22.810 16.650 1.00 0.28 A +ATOM 375 2HG GLU A 43 39.772 22.948 18.028 1.00 0.45 A +ATOM 376 N LYS A 44 40.049 27.819 17.102 1.00 0.14 A +ATOM 377 CA LYS A 44 39.903 29.211 16.692 1.00 0.14 A +ATOM 378 C LYS A 44 38.679 29.477 15.861 1.00 0.14 A +ATOM 379 O LYS A 44 38.703 30.258 14.928 1.00 0.15 A +ATOM 380 CB LYS A 44 41.095 29.763 15.959 1.00 0.13 A +ATOM 381 CG LYS A 44 42.417 29.445 16.648 1.00 0.12 A +ATOM 382 CD LYS A 44 43.351 28.785 15.606 1.00 0.13 A +ATOM 383 CE LYS A 44 44.800 29.237 15.767 1.00 0.12 A +ATOM 384 NZ LYS A 44 45.664 28.038 15.791 1.00 0.13 A +ATOM 385 H LYS A 44 40.185 27.638 18.054 1.00 0.14 A +ATOM 386 HA LYS A 44 39.740 29.810 17.577 1.00 0.13 A +ATOM 387 1HB LYS A 44 41.074 29.338 14.968 1.00 0.14 A +ATOM 388 2HB LYS A 44 40.987 30.821 15.855 1.00 0.13 A +ATOM 389 1HG LYS A 44 42.850 30.365 17.022 1.00 0.12 A +ATOM 390 2HG LYS A 44 42.256 28.766 17.475 1.00 0.13 A +ATOM 391 1HD LYS A 44 43.292 27.717 15.719 1.00 0.14 A +ATOM 392 2HD LYS A 44 43.027 29.043 14.603 1.00 0.13 A +ATOM 393 1HE LYS A 44 45.075 29.860 14.927 1.00 0.12 A +ATOM 394 2HE LYS A 44 44.932 29.789 16.681 1.00 0.11 A +ATOM 395 1HZ LYS A 44 45.079 27.186 15.673 1.00 0.13 A +ATOM 396 2HZ LYS A 44 46.163 27.997 16.701 1.00 0.12 A +ATOM 397 3HZ LYS A 44 46.351 28.095 15.015 1.00 0.13 A +ATOM 398 N ILE A 45 37.616 28.876 16.202 1.00 0.15 A +ATOM 399 CA ILE A 45 36.414 29.103 15.479 1.00 0.16 A +ATOM 400 C ILE A 45 35.921 30.546 15.684 1.00 0.15 A +ATOM 401 O ILE A 45 35.225 31.141 14.885 1.00 0.16 A +ATOM 402 CB ILE A 45 35.422 28.160 16.114 1.00 0.17 A +ATOM 403 CG1 ILE A 45 35.958 26.707 16.089 1.00 0.17 A +ATOM 404 CG2 ILE A 45 34.076 28.235 15.372 1.00 0.17 A +ATOM 405 CD1 ILE A 45 36.604 26.339 14.741 1.00 0.17 A +ATOM 406 H ILE A 45 37.628 28.250 16.957 1.00 0.15 A +ATOM 407 HA ILE A 45 36.546 28.872 14.433 1.00 0.17 A +ATOM 408 HB ILE A 45 35.268 28.459 17.141 1.00 0.18 A +ATOM 409 1HG1 ILE A 45 36.700 26.599 16.859 1.00 0.18 A +ATOM 410 2HG1 ILE A 45 35.140 26.028 16.284 1.00 0.17 A +ATOM 411 1HG2 ILE A 45 33.717 29.251 15.376 1.00 1.03 A +ATOM 412 2HG2 ILE A 45 33.357 27.601 15.868 1.00 1.05 A +ATOM 413 3HG2 ILE A 45 34.195 27.908 14.354 1.00 1.01 A +ATOM 414 1HD1 ILE A 45 37.569 26.813 14.664 1.00 1.04 A +ATOM 415 2HD1 ILE A 45 35.981 26.660 13.926 1.00 1.02 A +ATOM 416 3HD1 ILE A 45 36.731 25.268 14.689 1.00 1.02 A +ATOM 417 N VAL A 46 36.242 31.009 16.821 1.00 0.15 A +ATOM 418 CA VAL A 46 35.869 32.280 17.372 1.00 0.14 A +ATOM 419 C VAL A 46 36.898 33.396 17.005 1.00 0.13 A +ATOM 420 O VAL A 46 36.651 34.568 17.211 1.00 0.13 A +ATOM 421 CB VAL A 46 35.660 31.929 18.858 1.00 0.14 A +ATOM 422 CG1 VAL A 46 34.748 32.980 19.505 1.00 0.46 A +ATOM 423 CG2 VAL A 46 35.032 30.533 19.022 1.00 0.50 A +ATOM 424 H VAL A 46 36.755 30.418 17.407 1.00 0.14 A +ATOM 425 HA VAL A 46 34.960 32.651 16.924 1.00 0.15 A +ATOM 426 HB VAL A 46 36.620 31.949 19.358 1.00 0.32 A +ATOM 427 1HG1 VAL A 46 35.018 33.965 19.151 1.00 1.10 A +ATOM 428 2HG1 VAL A 46 34.861 32.942 20.578 1.00 1.12 A +ATOM 429 3HG1 VAL A 46 33.720 32.773 19.245 1.00 1.25 A +ATOM 430 1HG2 VAL A 46 34.493 30.476 19.958 1.00 1.21 A +ATOM 431 2HG2 VAL A 46 35.810 29.790 19.015 1.00 1.18 A +ATOM 432 3HG2 VAL A 46 34.360 30.349 18.209 1.00 1.14 A +ATOM 433 N GLY A 47 38.003 33.036 16.409 1.00 0.13 A +ATOM 434 CA GLY A 47 39.012 33.980 15.948 1.00 0.12 A +ATOM 435 C GLY A 47 40.353 33.495 16.376 1.00 0.12 A +ATOM 436 O GLY A 47 40.447 32.447 16.967 1.00 0.12 A +ATOM 437 H GLY A 47 38.161 32.080 16.272 1.00 0.13 A +ATOM 438 1HA GLY A 47 38.962 34.065 14.872 1.00 0.13 A +ATOM 439 2HA GLY A 47 38.835 34.947 16.393 1.00 0.12 A +ATOM 440 N ASP A 48 41.403 34.243 16.140 1.00 0.11 A +ATOM 441 CA ASP A 48 42.697 33.751 16.575 1.00 0.10 A +ATOM 442 C ASP A 48 43.373 34.676 17.581 1.00 0.09 A +ATOM 443 O ASP A 48 43.132 35.867 17.601 1.00 0.09 A +ATOM 444 CB ASP A 48 43.642 33.605 15.350 1.00 0.11 A +ATOM 445 CG ASP A 48 44.837 32.697 15.644 1.00 0.11 A +ATOM 446 OD1 ASP A 48 44.904 32.143 16.729 1.00 0.10 A +ATOM 447 OD2 ASP A 48 45.672 32.570 14.754 1.00 0.11 A +ATOM 448 H ASP A 48 41.311 35.116 15.704 1.00 0.11 A +ATOM 449 HA ASP A 48 42.574 32.788 17.049 1.00 0.11 A +ATOM 450 1HB ASP A 48 43.085 33.193 14.523 1.00 0.12 A +ATOM 451 2HB ASP A 48 44.005 34.584 15.079 1.00 0.10 A +ATOM 452 N GLY A 49 44.266 34.138 18.405 1.00 0.09 A +ATOM 453 CA GLY A 49 44.957 35.025 19.324 1.00 0.08 A +ATOM 454 C GLY A 49 45.805 34.231 20.330 1.00 0.07 A +ATOM 455 O GLY A 49 46.455 33.274 19.966 1.00 0.08 A +ATOM 456 H GLY A 49 44.471 33.181 18.376 1.00 0.09 A +ATOM 457 1HA GLY A 49 45.594 35.688 18.756 1.00 0.08 A +ATOM 458 2HA GLY A 49 44.226 35.605 19.867 1.00 0.07 A +ATOM 459 N ILE A 50 45.790 34.621 21.606 1.00 0.07 A +ATOM 460 CA ILE A 50 46.543 33.907 22.623 1.00 0.07 A +ATOM 461 C ILE A 50 45.647 33.721 23.855 1.00 0.06 A +ATOM 462 O ILE A 50 44.552 34.244 23.930 1.00 0.06 A +ATOM 463 CB ILE A 50 47.825 34.652 23.072 1.00 0.06 A +ATOM 464 CG1 ILE A 50 47.564 36.120 23.466 1.00 0.05 A +ATOM 465 CG2 ILE A 50 48.894 34.624 21.973 1.00 0.06 A +ATOM 466 CD1 ILE A 50 47.049 36.234 24.902 1.00 0.05 A +ATOM 467 H ILE A 50 45.247 35.392 21.869 1.00 0.06 A +ATOM 468 HA ILE A 50 46.827 32.943 22.227 1.00 0.07 A +ATOM 469 HB ILE A 50 48.228 34.126 23.922 1.00 0.06 A +ATOM 470 1HG1 ILE A 50 48.488 36.677 23.395 1.00 0.05 A +ATOM 471 2HG1 ILE A 50 46.847 36.541 22.791 1.00 0.05 A +ATOM 472 1HG2 ILE A 50 48.474 34.972 21.044 1.00 0.06 A +ATOM 473 2HG2 ILE A 50 49.264 33.618 21.852 1.00 0.07 A +ATOM 474 3HG2 ILE A 50 49.713 35.272 22.262 1.00 0.06 A +ATOM 475 1HD1 ILE A 50 47.187 37.248 25.253 1.00 0.04 A +ATOM 476 2HD1 ILE A 50 47.589 35.559 25.545 1.00 0.05 A +ATOM 477 3HD1 ILE A 50 46.014 35.992 24.921 1.00 0.05 A +ATOM 478 N ALA A 51 46.158 33.007 24.820 1.00 0.07 A +ATOM 479 CA ALA A 51 45.521 32.783 26.117 1.00 0.07 A +ATOM 480 C ALA A 51 46.471 33.296 27.223 1.00 0.07 A +ATOM 481 O ALA A 51 47.667 33.406 27.014 1.00 0.07 A +ATOM 482 CB ALA A 51 45.306 31.291 26.329 1.00 0.08 A +ATOM 483 H ALA A 51 47.042 32.612 24.677 1.00 0.07 A +ATOM 484 HA ALA A 51 44.567 33.291 26.142 1.00 0.07 A +ATOM 485 1HB ALA A 51 44.657 30.908 25.556 1.00 0.08 A +ATOM 486 2HB ALA A 51 44.851 31.127 27.294 1.00 0.08 A +ATOM 487 3HB ALA A 51 46.256 30.781 26.287 1.00 0.08 A +ATOM 488 N ILE A 52 45.945 33.590 28.395 1.00 0.06 A +ATOM 489 CA ILE A 52 46.733 34.039 29.523 1.00 0.07 A +ATOM 490 C ILE A 52 46.347 33.293 30.788 1.00 0.07 A +ATOM 491 O ILE A 52 45.196 33.254 31.169 1.00 0.07 A +ATOM 492 CB ILE A 52 46.555 35.520 29.810 1.00 0.06 A +ATOM 493 CG1 ILE A 52 47.171 36.333 28.659 1.00 0.05 A +ATOM 494 CG2 ILE A 52 47.243 35.906 31.130 1.00 0.06 A +ATOM 495 CD1 ILE A 52 46.589 37.750 28.622 1.00 0.04 A +ATOM 496 H ILE A 52 44.978 33.490 28.515 1.00 0.07 A +ATOM 497 HA ILE A 52 47.774 33.850 29.314 1.00 0.07 A +ATOM 498 HB ILE A 52 45.501 35.744 29.882 1.00 0.05 A +ATOM 499 1HG1 ILE A 52 48.240 36.394 28.799 1.00 0.05 A +ATOM 500 2HG1 ILE A 52 46.961 35.842 27.725 1.00 0.05 A +ATOM 501 1HG2 ILE A 52 47.402 36.974 31.157 1.00 0.06 A +ATOM 502 2HG2 ILE A 52 48.192 35.397 31.205 1.00 0.07 A +ATOM 503 3HG2 ILE A 52 46.614 35.616 31.959 1.00 0.06 A +ATOM 504 1HD1 ILE A 52 47.020 38.289 27.790 1.00 0.04 A +ATOM 505 2HD1 ILE A 52 46.822 38.264 29.542 1.00 0.04 A +ATOM 506 3HD1 ILE A 52 45.517 37.698 28.497 1.00 0.04 A +ATOM 507 N LYS A 53 47.325 32.753 31.468 1.00 0.08 A +ATOM 508 CA LYS A 53 47.073 32.119 32.746 1.00 0.09 A +ATOM 509 C LYS A 53 47.162 33.312 33.700 1.00 0.09 A +ATOM 510 O LYS A 53 48.207 33.909 33.825 1.00 0.09 A +ATOM 511 CB LYS A 53 48.064 31.002 33.081 1.00 0.10 A +ATOM 512 CG LYS A 53 47.373 29.772 33.749 1.00 0.11 A +ATOM 513 CD LYS A 53 47.317 29.902 35.288 1.00 0.12 A +ATOM 514 CE LYS A 53 46.424 28.781 35.871 1.00 0.13 A +ATOM 515 NZ LYS A 53 46.079 29.045 37.304 1.00 0.13 A +ATOM 516 H LYS A 53 48.240 32.798 31.122 1.00 0.08 A +ATOM 517 HA LYS A 53 46.078 31.699 32.728 1.00 0.09 A +ATOM 518 1HB LYS A 53 48.539 30.678 32.165 1.00 0.10 A +ATOM 519 2HB LYS A 53 48.824 31.383 33.750 1.00 0.10 A +ATOM 520 1HG LYS A 53 46.373 29.665 33.374 1.00 0.11 A +ATOM 521 2HG LYS A 53 47.934 28.883 33.498 1.00 0.12 A +ATOM 522 1HD LYS A 53 48.315 29.805 35.689 1.00 0.12 A +ATOM 523 2HD LYS A 53 46.909 30.862 35.557 1.00 0.11 A +ATOM 524 1HE LYS A 53 45.510 28.720 35.302 1.00 0.12 A +ATOM 525 2HE LYS A 53 46.948 27.840 35.803 1.00 0.13 A +ATOM 526 1HZ LYS A 53 46.485 29.950 37.606 1.00 0.13 A +ATOM 527 2HZ LYS A 53 46.460 28.276 37.897 1.00 0.14 A +ATOM 528 3HZ LYS A 53 45.044 29.076 37.410 1.00 0.13 A +ATOM 529 N PRO A 54 46.049 33.734 34.243 1.00 0.09 A +ATOM 530 CA PRO A 54 45.940 34.975 35.019 1.00 0.08 A +ATOM 531 C PRO A 54 46.634 34.889 36.403 1.00 0.09 A +ATOM 532 O PRO A 54 46.687 33.848 37.022 1.00 0.10 A +ATOM 533 CB PRO A 54 44.419 35.156 35.247 1.00 0.08 A +ATOM 534 CG PRO A 54 43.711 33.998 34.631 1.00 0.08 A +ATOM 535 CD PRO A 54 44.762 32.985 34.242 1.00 0.09 A +ATOM 536 HA PRO A 54 46.345 35.808 34.463 1.00 0.08 A +ATOM 537 1HB PRO A 54 44.201 35.199 36.311 1.00 0.08 A +ATOM 538 2HB PRO A 54 44.090 36.072 34.795 1.00 0.07 A +ATOM 539 1HG PRO A 54 43.032 33.571 35.345 1.00 0.09 A +ATOM 540 2HG PRO A 54 43.164 34.307 33.751 1.00 0.08 A +ATOM 541 1HD PRO A 54 44.801 32.176 34.973 1.00 0.10 A +ATOM 542 2HD PRO A 54 44.540 32.593 33.272 1.00 0.09 A +ATOM 543 N THR A 55 47.121 36.009 36.890 1.00 0.09 A +ATOM 544 CA THR A 55 47.759 36.093 38.212 1.00 0.10 A +ATOM 545 C THR A 55 47.322 37.366 38.926 1.00 0.10 A +ATOM 546 O THR A 55 47.803 37.649 40.005 1.00 0.11 A +ATOM 547 CB THR A 55 49.294 36.242 38.145 1.00 0.11 A +ATOM 548 OG1 THR A 55 49.622 37.403 37.398 1.00 0.10 A +ATOM 549 CG2 THR A 55 49.937 35.013 37.502 1.00 0.11 A +ATOM 550 H THR A 55 47.044 36.828 36.360 1.00 0.08 A +ATOM 551 HA THR A 55 47.527 35.193 38.763 1.00 0.11 A +ATOM 552 HB THR A 55 49.684 36.346 39.148 1.00 0.11 A +ATOM 553 HG1 THR A 55 50.127 37.988 37.968 1.00 0.10 A +ATOM 554 1HG2 THR A 55 49.428 34.772 36.583 1.00 0.10 A +ATOM 555 2HG2 THR A 55 49.873 34.178 38.183 1.00 0.12 A +ATOM 556 3HG2 THR A 55 50.977 35.225 37.294 1.00 0.11 A +ATOM 557 N GLY A 56 46.458 38.162 38.327 1.00 0.09 A +ATOM 558 CA GLY A 56 46.046 39.418 38.947 1.00 0.09 A +ATOM 559 C GLY A 56 44.604 39.428 39.471 1.00 0.09 A +ATOM 560 O GLY A 56 44.100 38.441 39.966 1.00 0.09 A +ATOM 561 H GLY A 56 46.084 37.908 37.458 1.00 0.08 A +ATOM 562 1HA GLY A 56 46.711 39.621 39.772 1.00 0.10 A +ATOM 563 2HA GLY A 56 46.136 40.202 38.211 1.00 0.09 A +ATOM 564 N ASN A 57 43.945 40.588 39.356 1.00 0.08 A +ATOM 565 CA ASN A 57 42.577 40.750 39.822 1.00 0.08 A +ATOM 566 C ASN A 57 41.778 41.630 38.920 1.00 0.08 A +ATOM 567 O ASN A 57 40.710 42.075 39.306 1.00 0.08 A +ATOM 568 CB ASN A 57 42.521 41.365 41.224 1.00 0.09 A +ATOM 569 CG ASN A 57 43.170 42.748 41.224 1.00 0.09 A +ATOM 570 OD1 ASN A 57 42.697 43.664 40.576 1.00 0.09 A +ATOM 571 ND2 ASN A 57 44.248 42.933 41.939 1.00 0.10 A +ATOM 572 H ASN A 57 44.393 41.353 38.938 1.00 0.08 A +ATOM 573 HA ASN A 57 42.099 39.783 39.846 1.00 0.09 A +ATOM 574 1HB ASN A 57 41.491 41.451 41.535 1.00 0.09 A +ATOM 575 2HB ASN A 57 43.050 40.725 41.914 1.00 0.10 A +ATOM 576 N LYS A 58 42.221 41.917 37.734 1.00 0.07 A +ATOM 577 CA LYS A 58 41.372 42.734 36.950 1.00 0.06 A +ATOM 578 C LYS A 58 41.628 42.600 35.448 1.00 0.05 A +ATOM 579 O LYS A 58 42.701 42.244 35.001 1.00 0.05 A +ATOM 580 CB LYS A 58 41.517 44.141 37.443 1.00 0.07 A +ATOM 581 CG LYS A 58 42.825 44.723 36.916 1.00 0.07 A +ATOM 582 CD LYS A 58 43.121 46.093 37.579 1.00 0.08 A +ATOM 583 CE LYS A 58 44.587 46.176 38.062 1.00 0.09 A +ATOM 584 NZ LYS A 58 45.416 46.936 37.087 1.00 0.09 A +ATOM 585 H LYS A 58 43.082 41.583 37.409 1.00 0.07 A +ATOM 586 HA LYS A 58 40.347 42.409 37.058 1.00 0.06 A +ATOM 587 1HB LYS A 58 40.687 44.734 37.085 1.00 0.07 A +ATOM 588 2HB LYS A 58 41.526 44.149 38.521 1.00 0.07 A +ATOM 589 1HG LYS A 58 43.614 44.021 37.118 1.00 0.07 A +ATOM 590 2HG LYS A 58 42.743 44.859 35.847 1.00 0.06 A +ATOM 591 1HD LYS A 58 42.941 46.880 36.859 1.00 0.08 A +ATOM 592 2HD LYS A 58 42.462 46.242 38.426 1.00 0.08 A +ATOM 593 1HE LYS A 58 44.619 46.679 39.012 1.00 0.09 A +ATOM 594 2HE LYS A 58 45.003 45.188 38.179 1.00 0.08 A +ATOM 595 1HZ LYS A 58 45.473 46.412 36.191 1.00 0.08 A +ATOM 596 2HZ LYS A 58 46.372 47.056 37.480 1.00 0.09 A +ATOM 597 3HZ LYS A 58 44.989 47.868 36.918 1.00 0.09 A +ATOM 598 N MET A 59 40.589 42.903 34.674 1.00 0.05 A +ATOM 599 CA MET A 59 40.652 42.860 33.238 1.00 0.04 A +ATOM 600 C MET A 59 40.472 44.289 32.682 1.00 0.05 A +ATOM 601 O MET A 59 39.477 44.941 32.942 1.00 0.05 A +ATOM 602 CB MET A 59 39.550 41.917 32.785 1.00 0.04 A +ATOM 603 CG MET A 59 40.023 40.839 31.827 1.00 0.04 A +ATOM 604 SD MET A 59 38.785 39.504 31.625 1.00 0.05 A +ATOM 605 CE MET A 59 37.878 39.625 33.193 1.00 0.06 A +ATOM 606 H MET A 59 39.758 43.201 35.096 1.00 0.05 A +ATOM 607 HA MET A 59 41.615 42.490 32.918 1.00 0.04 A +ATOM 608 1HB MET A 59 39.176 41.480 33.665 1.00 0.05 A +ATOM 609 2HB MET A 59 38.757 42.485 32.314 1.00 0.05 A +ATOM 610 1HG MET A 59 40.204 41.289 30.863 1.00 0.04 A +ATOM 611 2HG MET A 59 40.924 40.429 32.204 1.00 0.04 A +ATOM 612 1HE MET A 59 37.336 40.559 33.217 1.00 0.05 A +ATOM 613 2HE MET A 59 38.568 39.578 34.019 1.00 0.06 A +ATOM 614 3HE MET A 59 37.185 38.811 33.277 1.00 0.06 A +ATOM 615 N VAL A 60 41.451 44.782 31.927 1.00 0.05 A +ATOM 616 CA VAL A 60 41.380 46.121 31.378 1.00 0.05 A +ATOM 617 C VAL A 60 41.289 46.084 29.877 1.00 0.05 A +ATOM 618 O VAL A 60 41.393 45.055 29.237 1.00 0.05 A +ATOM 619 CB VAL A 60 42.591 46.937 31.700 1.00 0.06 A +ATOM 620 CG1 VAL A 60 42.961 46.748 33.170 1.00 0.06 A +ATOM 621 CG2 VAL A 60 43.758 46.432 30.833 1.00 0.06 A +ATOM 622 H VAL A 60 42.244 44.234 31.751 1.00 0.04 A +ATOM 623 HA VAL A 60 40.511 46.616 31.784 1.00 0.06 A +ATOM 624 HB VAL A 60 42.401 47.968 31.497 1.00 0.07 A +ATOM 625 1HG1 VAL A 60 42.129 47.025 33.794 1.00 0.06 A +ATOM 626 2HG1 VAL A 60 43.815 47.366 33.406 1.00 0.07 A +ATOM 627 3HG1 VAL A 60 43.212 45.712 33.340 1.00 0.06 A +ATOM 628 1HG2 VAL A 60 43.697 46.875 29.847 1.00 0.06 A +ATOM 629 2HG2 VAL A 60 43.686 45.361 30.747 1.00 0.05 A +ATOM 630 3HG2 VAL A 60 44.699 46.686 31.284 1.00 0.06 A +ATOM 631 N ALA A 61 41.112 47.242 29.340 1.00 0.06 A +ATOM 632 CA ALA A 61 41.017 47.412 27.883 1.00 0.07 A +ATOM 633 C ALA A 61 42.345 47.121 27.252 1.00 0.06 A +ATOM 634 O ALA A 61 43.335 47.704 27.655 1.00 0.07 A +ATOM 635 CB ALA A 61 40.618 48.853 27.559 1.00 0.08 A +ATOM 636 H ALA A 61 41.018 48.030 29.915 1.00 0.07 A +ATOM 637 HA ALA A 61 40.273 46.736 27.490 1.00 0.06 A +ATOM 638 1HB ALA A 61 40.560 48.978 26.488 1.00 0.08 A +ATOM 639 2HB ALA A 61 41.357 49.530 27.961 1.00 0.08 A +ATOM 640 3HB ALA A 61 39.655 49.067 27.999 1.00 0.08 A +ATOM 641 N PRO A 62 42.432 46.240 26.269 1.00 0.06 A +ATOM 642 CA PRO A 62 43.755 45.976 25.683 1.00 0.06 A +ATOM 643 C PRO A 62 44.066 46.999 24.574 1.00 0.07 A +ATOM 644 O PRO A 62 45.111 46.948 23.959 1.00 0.07 A +ATOM 645 CB PRO A 62 43.679 44.581 25.038 1.00 0.05 A +ATOM 646 CG PRO A 62 42.193 44.301 24.871 1.00 0.06 A +ATOM 647 CD PRO A 62 41.397 45.423 25.597 1.00 0.06 A +ATOM 648 HA PRO A 62 44.512 45.990 26.452 1.00 0.06 A +ATOM 649 1HB PRO A 62 44.184 44.567 24.081 1.00 0.06 A +ATOM 650 2HB PRO A 62 44.114 43.845 25.692 1.00 0.05 A +ATOM 651 1HG PRO A 62 41.935 44.287 23.817 1.00 0.06 A +ATOM 652 2HG PRO A 62 41.944 43.342 25.311 1.00 0.05 A +ATOM 653 1HD PRO A 62 40.860 46.022 24.876 1.00 0.07 A +ATOM 654 2HD PRO A 62 40.719 44.991 26.313 1.00 0.06 A +ATOM 655 N VAL A 63 43.138 47.896 24.302 1.00 0.08 A +ATOM 656 CA VAL A 63 43.319 48.897 23.230 1.00 0.09 A +ATOM 657 C VAL A 63 42.415 50.097 23.442 1.00 0.10 A +ATOM 658 O VAL A 63 41.448 50.042 24.178 1.00 0.10 A +ATOM 659 CB VAL A 63 43.003 48.369 21.817 1.00 0.09 A +ATOM 660 CG1 VAL A 63 43.818 47.114 21.503 1.00 0.09 A +ATOM 661 CG2 VAL A 63 41.508 48.055 21.709 1.00 0.09 A +ATOM 662 H VAL A 63 42.306 47.899 24.820 1.00 0.08 A +ATOM 663 HA VAL A 63 44.347 49.230 23.247 1.00 0.09 A +ATOM 664 HB VAL A 63 43.252 49.135 21.096 1.00 0.10 A +ATOM 665 1HG1 VAL A 63 43.698 46.865 20.457 1.00 0.09 A +ATOM 666 2HG1 VAL A 63 43.466 46.294 22.109 1.00 0.08 A +ATOM 667 3HG1 VAL A 63 44.860 47.299 21.707 1.00 0.09 A +ATOM 668 1HG2 VAL A 63 40.964 48.975 21.585 1.00 0.10 A +ATOM 669 2HG2 VAL A 63 41.174 47.560 22.606 1.00 0.09 A +ATOM 670 3HG2 VAL A 63 41.330 47.414 20.867 1.00 0.09 A +ATOM 671 N ASP A 64 42.708 51.169 22.735 1.00 0.11 A +ATOM 672 CA ASP A 64 41.847 52.343 22.767 1.00 0.12 A +ATOM 673 C ASP A 64 40.735 51.996 21.791 1.00 0.12 A +ATOM 674 O ASP A 64 40.979 51.554 20.685 1.00 0.12 A +ATOM 675 CB ASP A 64 42.570 53.649 22.472 1.00 0.13 A +ATOM 676 CG ASP A 64 43.757 53.886 23.407 1.00 0.13 A +ATOM 677 OD1 ASP A 64 43.758 53.367 24.508 1.00 0.12 A +ATOM 678 OD2 ASP A 64 44.659 54.594 22.986 1.00 0.13 A +ATOM 679 H ASP A 64 43.494 51.166 22.150 1.00 0.11 A +ATOM 680 HA ASP A 64 41.407 52.414 23.751 1.00 0.11 A +ATOM 681 1HB ASP A 64 42.936 53.621 21.457 1.00 0.13 A +ATOM 682 2HB ASP A 64 41.871 54.468 22.570 1.00 0.13 A +ATOM 683 N GLY A 65 39.517 52.108 22.234 1.00 0.12 A +ATOM 684 CA GLY A 65 38.385 51.714 21.424 1.00 0.12 A +ATOM 685 C GLY A 65 37.103 51.805 22.216 1.00 0.12 A +ATOM 686 O GLY A 65 37.014 52.544 23.179 1.00 0.12 A +ATOM 687 H GLY A 65 39.363 52.439 23.143 1.00 0.12 A +ATOM 688 1HA GLY A 65 38.305 52.376 20.575 1.00 0.13 A +ATOM 689 2HA GLY A 65 38.529 50.702 21.078 1.00 0.12 A +ATOM 690 N THR A 66 36.090 51.081 21.795 1.00 0.13 A +ATOM 691 CA THR A 66 34.809 51.167 22.473 1.00 0.13 A +ATOM 692 C THR A 66 34.346 49.805 22.951 1.00 0.12 A +ATOM 693 O THR A 66 34.398 48.843 22.209 1.00 0.12 A +ATOM 694 CB THR A 66 33.791 51.680 21.429 1.00 0.14 A +ATOM 695 OG1 THR A 66 34.241 52.927 20.930 1.00 0.15 A +ATOM 696 CG2 THR A 66 32.403 51.847 22.051 1.00 0.14 A +ATOM 697 H THR A 66 36.197 50.502 21.011 1.00 0.13 A +ATOM 698 HA THR A 66 34.872 51.855 23.303 1.00 0.13 A +ATOM 699 HB THR A 66 33.729 50.973 20.614 1.00 0.14 A +ATOM 700 HG1 THR A 66 34.729 52.761 20.121 1.00 0.15 A +ATOM 701 1HG2 THR A 66 31.764 52.379 21.359 1.00 0.15 A +ATOM 702 2HG2 THR A 66 32.482 52.406 22.970 1.00 0.14 A +ATOM 703 3HG2 THR A 66 31.980 50.874 22.253 1.00 0.14 A +ATOM 704 N ILE A 67 33.865 49.698 24.170 1.00 0.12 A +ATOM 705 CA ILE A 67 33.400 48.379 24.603 1.00 0.11 A +ATOM 706 C ILE A 67 32.165 48.060 23.817 1.00 0.12 A +ATOM 707 O ILE A 67 31.323 48.910 23.603 1.00 0.13 A +ATOM 708 CB ILE A 67 32.975 48.289 26.069 1.00 0.10 A +ATOM 709 CG1 ILE A 67 34.148 48.553 27.064 1.00 0.10 A +ATOM 710 CG2 ILE A 67 32.332 46.912 26.330 1.00 0.10 A +ATOM 711 CD1 ILE A 67 35.526 48.301 26.445 1.00 0.09 A +ATOM 712 H ILE A 67 33.816 50.472 24.768 1.00 0.12 A +ATOM 713 HA ILE A 67 34.200 47.673 24.444 1.00 0.10 A +ATOM 714 HB ILE A 67 32.209 49.040 26.234 1.00 0.11 A +ATOM 715 1HG1 ILE A 67 34.106 49.579 27.390 1.00 0.10 A +ATOM 716 2HG1 ILE A 67 34.032 47.912 27.926 1.00 0.09 A +ATOM 717 1HG2 ILE A 67 31.309 46.923 25.975 1.00 0.11 A +ATOM 718 2HG2 ILE A 67 32.340 46.701 27.386 1.00 0.10 A +ATOM 719 3HG2 ILE A 67 32.881 46.147 25.802 1.00 0.10 A +ATOM 720 1HD1 ILE A 67 35.590 47.283 26.093 1.00 0.09 A +ATOM 721 2HD1 ILE A 67 36.287 48.466 27.190 1.00 0.09 A +ATOM 722 3HD1 ILE A 67 35.677 48.984 25.623 1.00 0.10 A +ATOM 723 N GLY A 68 32.043 46.847 23.422 1.00 0.12 A +ATOM 724 CA GLY A 68 30.906 46.409 22.664 1.00 0.13 A +ATOM 725 C GLY A 68 29.880 45.657 23.465 1.00 0.13 A +ATOM 726 O GLY A 68 28.741 46.063 23.598 1.00 0.13 A +ATOM 727 H GLY A 68 32.747 46.200 23.638 1.00 0.11 A +ATOM 728 1HA GLY A 68 30.432 47.277 22.231 1.00 0.13 A +ATOM 729 2HA GLY A 68 31.253 45.757 21.876 1.00 0.13 A +ATOM 730 N LYS A 69 30.264 44.542 23.959 1.00 0.12 A +ATOM 731 CA LYS A 69 29.359 43.724 24.698 1.00 0.12 A +ATOM 732 C LYS A 69 30.026 43.072 25.879 1.00 0.11 A +ATOM 733 O LYS A 69 31.116 42.569 25.821 1.00 0.11 A +ATOM 734 CB LYS A 69 28.559 42.766 23.808 1.00 0.13 A +ATOM 735 CG LYS A 69 27.458 42.034 24.639 1.00 0.13 A +ATOM 736 CD LYS A 69 27.688 40.514 24.625 1.00 1.43 A +ATOM 737 CE LYS A 69 26.566 39.820 25.402 1.00 1.48 A +ATOM 738 NZ LYS A 69 25.251 40.133 24.770 1.00 2.16 A +ATOM 739 H LYS A 69 31.188 44.246 23.820 1.00 0.11 A +ATOM 740 HA LYS A 69 28.666 44.365 25.225 1.00 0.12 A +ATOM 741 1HB LYS A 69 28.096 43.333 23.010 1.00 0.15 A +ATOM 742 2HB LYS A 69 29.237 42.046 23.381 1.00 0.17 A +ATOM 743 1HG LYS A 69 27.472 42.375 25.661 1.00 1.01 A +ATOM 744 2HG LYS A 69 26.482 42.244 24.220 1.00 0.97 A +ATOM 745 1HD LYS A 69 27.697 40.156 23.607 1.00 2.12 A +ATOM 746 2HD LYS A 69 28.635 40.290 25.092 1.00 2.13 A +ATOM 747 1HE LYS A 69 26.727 38.753 25.389 1.00 1.66 A +ATOM 748 2HE LYS A 69 26.567 40.172 26.423 1.00 1.84 A +ATOM 749 1HZ LYS A 69 24.664 39.276 24.746 1.00 2.66 A +ATOM 750 2HZ LYS A 69 25.404 40.478 23.800 1.00 2.64 A +ATOM 751 3HZ LYS A 69 24.766 40.866 25.326 1.00 2.46 A +ATOM 752 N ILE A 70 29.287 43.116 26.978 1.00 0.11 A +ATOM 753 CA ILE A 70 29.698 42.559 28.238 1.00 0.11 A +ATOM 754 C ILE A 70 28.705 41.448 28.535 1.00 0.11 A +ATOM 755 O ILE A 70 27.504 41.651 28.511 1.00 0.12 A +ATOM 756 CB ILE A 70 29.740 43.624 29.331 1.00 0.10 A +ATOM 757 CG1 ILE A 70 30.772 44.689 28.924 1.00 0.10 A +ATOM 758 CG2 ILE A 70 30.139 42.986 30.662 1.00 0.10 A +ATOM 759 CD1 ILE A 70 30.833 45.831 29.941 1.00 0.10 A +ATOM 760 H ILE A 70 28.392 43.511 26.920 1.00 0.12 A +ATOM 761 HA ILE A 70 30.683 42.129 28.129 1.00 0.10 A +ATOM 762 HB ILE A 70 28.766 44.080 29.429 1.00 0.11 A +ATOM 763 1HG1 ILE A 70 31.744 44.229 28.854 1.00 0.09 A +ATOM 764 2HG1 ILE A 70 30.505 45.088 27.964 1.00 0.11 A +ATOM 765 1HG2 ILE A 70 30.072 43.724 31.447 1.00 0.09 A +ATOM 766 2HG2 ILE A 70 31.152 42.620 30.596 1.00 0.09 A +ATOM 767 3HG2 ILE A 70 29.473 42.166 30.884 1.00 0.10 A +ATOM 768 1HD1 ILE A 70 31.642 46.498 29.674 1.00 0.09 A +ATOM 769 2HD1 ILE A 70 31.010 45.432 30.927 1.00 0.09 A +ATOM 770 3HD1 ILE A 70 29.902 46.378 29.932 1.00 0.10 A +ATOM 771 N PHE A 71 29.203 40.266 28.772 1.00 0.11 A +ATOM 772 CA PHE A 71 28.329 39.132 29.053 1.00 0.12 A +ATOM 773 C PHE A 71 27.553 39.433 30.351 1.00 0.12 A +ATOM 774 O PHE A 71 28.035 40.082 31.258 1.00 0.11 A +ATOM 775 CB PHE A 71 29.169 37.845 29.165 1.00 0.12 A +ATOM 776 CG PHE A 71 29.326 37.209 27.797 1.00 0.12 A +ATOM 777 CD1 PHE A 71 29.833 37.965 26.723 1.00 0.14 A +ATOM 778 CD2 PHE A 71 28.957 35.863 27.596 1.00 0.18 A +ATOM 779 CE1 PHE A 71 29.972 37.377 25.450 1.00 0.15 A +ATOM 780 CE2 PHE A 71 29.097 35.276 26.324 1.00 0.21 A +ATOM 781 CZ PHE A 71 29.604 36.033 25.252 1.00 0.16 A +ATOM 782 H PHE A 71 30.173 40.135 28.757 1.00 0.10 A +ATOM 783 HA PHE A 71 27.613 39.025 28.252 1.00 0.13 A +ATOM 784 1HB PHE A 71 30.144 38.089 29.560 1.00 0.11 A +ATOM 785 2HB PHE A 71 28.677 37.150 29.831 1.00 0.12 A +ATOM 786 HD1 PHE A 71 30.117 38.996 26.875 1.00 0.19 A +ATOM 787 HD2 PHE A 71 28.567 35.282 28.417 1.00 0.24 A +ATOM 788 HE1 PHE A 71 30.358 37.957 24.627 1.00 0.18 A +ATOM 789 HE2 PHE A 71 28.815 34.245 26.172 1.00 0.28 A +ATOM 790 HZ PHE A 71 29.711 35.583 24.276 1.00 0.18 A +ATOM 791 N GLU A 72 26.340 38.977 30.395 1.00 0.13 A +ATOM 792 CA GLU A 72 25.439 39.189 31.517 1.00 0.13 A +ATOM 793 C GLU A 72 26.018 38.543 32.809 1.00 0.13 A +ATOM 794 O GLU A 72 25.596 38.839 33.909 1.00 0.13 A +ATOM 795 CB GLU A 72 23.982 38.713 31.244 1.00 0.15 A +ATOM 796 CG GLU A 72 23.351 39.613 30.181 1.00 0.15 A +ATOM 797 CD GLU A 72 21.882 39.233 29.992 1.00 0.20 A +ATOM 798 OE1 GLU A 72 21.504 38.164 30.442 1.00 0.20 A +ATOM 799 OE2 GLU A 72 21.160 40.023 29.408 1.00 0.40 A +ATOM 800 H GLU A 72 26.006 38.472 29.626 1.00 0.14 A +ATOM 801 HA GLU A 72 25.418 40.245 31.742 1.00 0.13 A +ATOM 802 1HB GLU A 72 23.996 37.692 30.892 1.00 0.18 A +ATOM 803 2HB GLU A 72 23.405 38.774 32.155 1.00 0.17 A +ATOM 804 1HG GLU A 72 23.419 40.644 30.496 1.00 0.15 A +ATOM 805 2HG GLU A 72 23.876 39.487 29.246 1.00 0.18 A +ATOM 806 N THR A 73 26.992 37.696 32.662 1.00 0.13 A +ATOM 807 CA THR A 73 27.683 37.015 33.772 1.00 0.12 A +ATOM 808 C THR A 73 28.957 37.756 34.087 1.00 0.11 A +ATOM 809 O THR A 73 29.737 37.413 34.948 1.00 0.11 A +ATOM 810 CB THR A 73 27.918 35.516 33.548 1.00 0.13 A +ATOM 811 OG1 THR A 73 28.602 35.327 32.319 1.00 0.14 A +ATOM 812 CG2 THR A 73 26.576 34.777 33.505 1.00 0.15 A +ATOM 813 H THR A 73 27.298 37.495 31.754 1.00 0.13 A +ATOM 814 HA THR A 73 27.086 37.133 34.664 1.00 0.13 A +ATOM 815 HB THR A 73 28.515 35.121 34.356 1.00 0.13 A +ATOM 816 HG1 THR A 73 27.978 35.482 31.606 1.00 0.88 A +ATOM 817 1HG2 THR A 73 26.742 33.724 33.677 1.00 1.02 A +ATOM 818 2HG2 THR A 73 26.120 34.915 32.537 1.00 1.03 A +ATOM 819 3HG2 THR A 73 25.920 35.165 34.271 1.00 1.03 A +ATOM 820 N ASN A 74 29.092 38.818 33.422 1.00 0.11 A +ATOM 821 CA ASN A 74 30.179 39.745 33.613 1.00 0.10 A +ATOM 822 C ASN A 74 31.530 39.067 33.600 1.00 0.09 A +ATOM 823 O ASN A 74 32.365 39.352 34.438 1.00 0.09 A +ATOM 824 CB ASN A 74 29.936 40.411 34.967 1.00 0.10 A +ATOM 825 CG ASN A 74 28.553 41.025 35.040 1.00 0.10 A +ATOM 826 OD1 ASN A 74 27.800 40.738 35.954 1.00 0.11 A +ATOM 827 ND2 ASN A 74 28.195 41.884 34.130 1.00 0.11 A +ATOM 828 H ASN A 74 28.404 39.049 32.766 1.00 0.11 A +ATOM 829 HA ASN A 74 30.182 40.486 32.827 1.00 0.10 A +ATOM 830 1HB ASN A 74 30.038 39.672 35.747 1.00 0.10 A +ATOM 831 2HB ASN A 74 30.674 41.186 35.115 1.00 0.09 A +ATOM 832 N HIS A 75 31.758 38.167 32.668 1.00 0.09 A +ATOM 833 CA HIS A 75 33.001 37.465 32.653 1.00 0.09 A +ATOM 834 C HIS A 75 33.742 37.541 31.293 1.00 0.08 A +ATOM 835 O HIS A 75 34.825 37.010 31.144 1.00 0.08 A +ATOM 836 CB HIS A 75 32.757 36.006 33.049 1.00 0.10 A +ATOM 837 CG HIS A 75 32.243 35.218 31.873 1.00 0.11 A +ATOM 838 ND1 HIS A 75 30.894 35.144 31.561 1.00 0.18 A +ATOM 839 CD2 HIS A 75 32.888 34.457 30.928 1.00 0.16 A +ATOM 840 CE1 HIS A 75 30.770 34.363 30.472 1.00 0.16 A +ATOM 841 NE2 HIS A 75 31.955 33.922 30.048 1.00 0.13 A +ATOM 842 H HIS A 75 31.059 37.956 32.016 1.00 0.10 A +ATOM 843 HA HIS A 75 33.684 37.922 33.355 1.00 0.08 A +ATOM 844 1HB HIS A 75 33.684 35.570 33.391 1.00 0.10 A +ATOM 845 2HB HIS A 75 32.030 35.971 33.848 1.00 0.10 A +ATOM 846 HD2 HIS A 75 33.955 34.300 30.876 1.00 0.27 A +ATOM 847 HE1 HIS A 75 29.829 34.121 30.003 1.00 0.23 A +ATOM 848 HE2 HIS A 75 32.130 33.341 29.278 1.00 0.17 A +ATOM 849 N ALA A 76 33.181 38.178 30.324 1.00 0.09 A +ATOM 850 CA ALA A 76 33.778 38.299 29.051 1.00 0.08 A +ATOM 851 C ALA A 76 33.306 39.548 28.345 1.00 0.09 A +ATOM 852 O ALA A 76 32.212 40.026 28.574 1.00 0.09 A +ATOM 853 CB ALA A 76 33.344 37.093 28.273 1.00 0.09 A +ATOM 854 H ALA A 76 32.296 38.575 30.471 1.00 0.09 A +ATOM 855 HA ALA A 76 34.854 38.318 29.142 1.00 0.08 A +ATOM 856 1HB ALA A 76 32.267 37.086 28.191 1.00 0.10 A +ATOM 857 2HB ALA A 76 33.673 36.199 28.783 1.00 0.09 A +ATOM 858 3HB ALA A 76 33.780 37.126 27.286 1.00 0.09 A +ATOM 859 N PHE A 77 34.110 40.089 27.466 1.00 0.08 A +ATOM 860 CA PHE A 77 33.667 41.265 26.769 1.00 0.08 A +ATOM 861 C PHE A 77 34.299 41.422 25.389 1.00 0.09 A +ATOM 862 O PHE A 77 35.258 40.769 25.019 1.00 0.08 A +ATOM 863 CB PHE A 77 33.925 42.500 27.619 1.00 0.08 A +ATOM 864 CG PHE A 77 35.399 42.843 27.671 1.00 0.07 A +ATOM 865 CD1 PHE A 77 35.969 43.669 26.690 1.00 0.07 A +ATOM 866 CD2 PHE A 77 36.187 42.371 28.723 1.00 0.06 A +ATOM 867 CE1 PHE A 77 37.322 44.022 26.769 1.00 0.06 A +ATOM 868 CE2 PHE A 77 37.541 42.719 28.798 1.00 0.05 A +ATOM 869 CZ PHE A 77 38.108 43.548 27.825 1.00 0.06 A +ATOM 870 H PHE A 77 34.989 39.698 27.279 1.00 0.08 A +ATOM 871 HA PHE A 77 32.610 41.186 26.569 1.00 0.09 A +ATOM 872 1HB PHE A 77 33.383 43.335 27.202 1.00 0.09 A +ATOM 873 2HB PHE A 77 33.572 42.316 28.623 1.00 0.08 A +ATOM 874 HD1 PHE A 77 35.363 44.039 25.878 1.00 0.08 A +ATOM 875 HD2 PHE A 77 35.754 41.728 29.473 1.00 0.06 A +ATOM 876 HE1 PHE A 77 37.763 44.650 26.008 1.00 0.07 A +ATOM 877 HE2 PHE A 77 38.147 42.353 29.613 1.00 0.05 A +ATOM 878 HZ PHE A 77 39.148 43.828 27.893 1.00 0.05 A +ATOM 879 N SER A 78 33.697 42.321 24.640 1.00 0.09 A +ATOM 880 CA SER A 78 34.082 42.642 23.291 1.00 0.10 A +ATOM 881 C SER A 78 34.502 44.100 23.209 1.00 0.10 A +ATOM 882 O SER A 78 33.832 44.949 23.762 1.00 0.10 A +ATOM 883 CB SER A 78 32.836 42.581 22.404 1.00 0.11 A +ATOM 884 OG SER A 78 32.516 41.228 22.141 1.00 0.11 A +ATOM 885 H SER A 78 32.942 42.810 25.028 1.00 0.10 A +ATOM 886 HA SER A 78 34.814 41.930 22.941 1.00 0.09 A +ATOM 887 1HB SER A 78 32.010 43.045 22.910 1.00 0.11 A +ATOM 888 2HB SER A 78 33.019 43.099 21.470 1.00 0.12 A +ATOM 889 HG SER A 78 33.094 40.920 21.439 1.00 0.11 A +ATOM 890 N ILE A 79 35.532 44.414 22.477 1.00 0.10 A +ATOM 891 CA ILE A 79 35.912 45.804 22.297 1.00 0.10 A +ATOM 892 C ILE A 79 36.407 45.963 20.875 1.00 0.11 A +ATOM 893 O ILE A 79 36.941 45.038 20.294 1.00 0.10 A +ATOM 894 CB ILE A 79 37.006 46.218 23.273 1.00 0.09 A +ATOM 895 CG1 ILE A 79 37.588 47.602 22.949 1.00 0.10 A +ATOM 896 CG2 ILE A 79 38.107 45.178 23.244 1.00 0.08 A +ATOM 897 CD1 ILE A 79 38.417 48.111 24.142 1.00 0.09 A +ATOM 898 H ILE A 79 36.041 43.712 22.021 1.00 0.09 A +ATOM 899 HA ILE A 79 35.046 46.428 22.457 1.00 0.10 A +ATOM 900 HB ILE A 79 36.585 46.237 24.267 1.00 0.09 A +ATOM 901 1HG1 ILE A 79 38.222 47.531 22.080 1.00 0.10 A +ATOM 902 2HG1 ILE A 79 36.783 48.294 22.757 1.00 0.10 A +ATOM 903 1HG2 ILE A 79 37.692 44.209 23.483 1.00 0.08 A +ATOM 904 2HG2 ILE A 79 38.857 45.435 23.969 1.00 0.08 A +ATOM 905 3HG2 ILE A 79 38.542 45.155 22.263 1.00 0.09 A +ATOM 906 1HD1 ILE A 79 39.125 48.855 23.803 1.00 0.09 A +ATOM 907 2HD1 ILE A 79 38.948 47.293 24.602 1.00 0.08 A +ATOM 908 3HD1 ILE A 79 37.761 48.552 24.864 1.00 0.09 A +ATOM 909 N GLU A 80 36.231 47.127 20.318 1.00 0.11 A +ATOM 910 CA GLU A 80 36.698 47.421 18.975 1.00 0.12 A +ATOM 911 C GLU A 80 37.686 48.529 19.126 1.00 0.12 A +ATOM 912 O GLU A 80 37.411 49.491 19.790 1.00 0.12 A +ATOM 913 CB GLU A 80 35.554 47.799 18.031 1.00 0.13 A +ATOM 914 CG GLU A 80 36.100 47.977 16.613 1.00 0.18 A +ATOM 915 CD GLU A 80 34.977 48.454 15.690 1.00 0.47 A +ATOM 916 OE1 GLU A 80 33.875 48.641 16.178 1.00 0.84 A +ATOM 917 OE2 GLU A 80 35.238 48.623 14.510 1.00 0.56 A +ATOM 918 H GLU A 80 35.779 47.833 20.825 1.00 0.12 A +ATOM 919 HA GLU A 80 37.198 46.549 18.582 1.00 0.12 A +ATOM 920 1HB GLU A 80 34.811 47.015 18.035 1.00 0.15 A +ATOM 921 2HB GLU A 80 35.105 48.724 18.361 1.00 0.17 A +ATOM 922 1HG GLU A 80 36.894 48.709 16.623 1.00 0.41 A +ATOM 923 2HG GLU A 80 36.483 47.034 16.253 1.00 0.52 A +ATOM 924 N SER A 81 38.846 48.400 18.559 1.00 0.12 A +ATOM 925 CA SER A 81 39.819 49.429 18.757 1.00 0.12 A +ATOM 926 C SER A 81 39.515 50.543 17.823 1.00 0.13 A +ATOM 927 O SER A 81 38.755 50.388 16.884 1.00 0.14 A +ATOM 928 CB SER A 81 41.185 48.957 18.353 1.00 0.12 A +ATOM 929 OG SER A 81 41.147 48.769 16.947 1.00 0.12 A +ATOM 930 H SER A 81 39.049 47.607 18.021 1.00 0.12 A +ATOM 931 HA SER A 81 39.835 49.706 19.801 1.00 0.12 A +ATOM 932 1HB SER A 81 41.927 49.698 18.601 1.00 0.12 A +ATOM 933 2HB SER A 81 41.420 48.028 18.832 1.00 0.11 A +ATOM 934 HG SER A 81 40.223 48.846 16.671 1.00 0.13 A +ATOM 935 N ASP A 82 40.123 51.646 18.029 1.00 0.14 A +ATOM 936 CA ASP A 82 39.894 52.747 17.111 1.00 0.15 A +ATOM 937 C ASP A 82 40.511 52.374 15.746 1.00 0.15 A +ATOM 938 O ASP A 82 40.033 52.776 14.701 1.00 0.16 A +ATOM 939 CB ASP A 82 40.434 54.112 17.606 1.00 0.15 A +ATOM 940 CG ASP A 82 39.735 54.603 18.874 1.00 0.15 A +ATOM 941 OD1 ASP A 82 38.593 54.223 19.086 1.00 0.15 A +ATOM 942 OD2 ASP A 82 40.353 55.373 19.602 1.00 0.15 A +ATOM 943 H ASP A 82 40.733 51.745 18.789 1.00 0.13 A +ATOM 944 HA ASP A 82 38.830 52.842 16.955 1.00 0.15 A +ATOM 945 1HB ASP A 82 41.490 54.017 17.803 1.00 0.15 A +ATOM 946 2HB ASP A 82 40.291 54.843 16.823 1.00 0.16 A +ATOM 947 N SER A 83 41.570 51.598 15.798 1.00 0.15 A +ATOM 948 CA SER A 83 42.317 51.125 14.651 1.00 0.15 A +ATOM 949 C SER A 83 41.526 50.095 13.833 1.00 0.15 A +ATOM 950 O SER A 83 42.036 49.508 12.896 1.00 0.15 A +ATOM 951 CB SER A 83 43.627 50.470 15.061 1.00 0.14 A +ATOM 952 OG SER A 83 43.562 50.103 16.432 1.00 0.13 A +ATOM 953 H SER A 83 41.891 51.327 16.683 1.00 0.14 A +ATOM 954 HA SER A 83 42.533 51.963 14.006 1.00 0.16 A +ATOM 955 1HB SER A 83 43.817 49.586 14.470 1.00 0.14 A +ATOM 956 2HB SER A 83 44.442 51.169 14.913 1.00 0.15 A +ATOM 957 HG SER A 83 42.838 49.485 16.540 1.00 0.13 A +ATOM 958 N GLY A 84 40.325 49.878 14.218 1.00 0.15 A +ATOM 959 CA GLY A 84 39.414 48.918 13.594 1.00 0.15 A +ATOM 960 C GLY A 84 39.603 47.429 13.946 1.00 0.14 A +ATOM 961 O GLY A 84 39.040 46.587 13.269 1.00 0.14 A +ATOM 962 H GLY A 84 39.992 50.377 14.992 1.00 0.15 A +ATOM 963 1HA GLY A 84 38.412 49.188 13.890 1.00 0.15 A +ATOM 964 2HA GLY A 84 39.517 49.026 12.525 1.00 0.16 A +ATOM 965 N VAL A 85 40.336 47.062 14.962 1.00 0.13 A +ATOM 966 CA VAL A 85 40.448 45.637 15.287 1.00 0.12 A +ATOM 967 C VAL A 85 39.368 45.219 16.331 1.00 0.12 A +ATOM 968 O VAL A 85 39.185 45.866 17.344 1.00 0.12 A +ATOM 969 CB VAL A 85 41.852 45.293 15.855 1.00 0.11 A +ATOM 970 CG1 VAL A 85 41.990 43.788 16.135 1.00 0.11 A +ATOM 971 CG2 VAL A 85 42.915 45.752 14.854 1.00 0.12 A +ATOM 972 H VAL A 85 40.797 47.735 15.504 1.00 0.13 A +ATOM 973 HA VAL A 85 40.280 45.059 14.391 1.00 0.13 A +ATOM 974 HB VAL A 85 41.984 45.829 16.787 1.00 0.11 A +ATOM 975 1HG1 VAL A 85 41.280 43.492 16.890 1.00 0.10 A +ATOM 976 2HG1 VAL A 85 42.994 43.584 16.487 1.00 0.10 A +ATOM 977 3HG1 VAL A 85 41.811 43.232 15.228 1.00 0.11 A +ATOM 978 1HG2 VAL A 85 42.469 46.343 14.070 1.00 0.13 A +ATOM 979 2HG2 VAL A 85 43.375 44.894 14.415 1.00 0.12 A +ATOM 980 3HG2 VAL A 85 43.648 46.353 15.369 1.00 0.12 A +ATOM 981 N GLU A 86 38.677 44.104 16.077 1.00 0.12 A +ATOM 982 CA GLU A 86 37.674 43.557 17.011 1.00 0.12 A +ATOM 983 C GLU A 86 38.302 42.449 17.877 1.00 0.11 A +ATOM 984 O GLU A 86 38.826 41.474 17.374 1.00 0.11 A +ATOM 985 CB GLU A 86 36.476 42.971 16.256 1.00 0.13 A +ATOM 986 CG GLU A 86 35.777 44.086 15.474 1.00 0.25 A +ATOM 987 CD GLU A 86 34.583 43.509 14.712 1.00 0.94 A +ATOM 988 OE1 GLU A 86 34.522 42.300 14.574 1.00 1.70 A +ATOM 989 OE2 GLU A 86 33.750 44.288 14.279 1.00 1.05 A +ATOM 990 H GLU A 86 38.858 43.617 15.248 1.00 0.12 A +ATOM 991 HA GLU A 86 37.330 44.346 17.661 1.00 0.12 A +ATOM 992 1HB GLU A 86 36.820 42.209 15.571 1.00 0.20 A +ATOM 993 2HB GLU A 86 35.783 42.537 16.960 1.00 0.18 A +ATOM 994 1HG GLU A 86 35.434 44.846 16.161 1.00 0.89 A +ATOM 995 2HG GLU A 86 36.472 44.523 14.772 1.00 0.93 A +ATOM 996 N LEU A 87 38.263 42.620 19.185 1.00 0.10 A +ATOM 997 CA LEU A 87 38.838 41.667 20.119 1.00 0.09 A +ATOM 998 C LEU A 87 37.765 41.055 20.993 1.00 0.09 A +ATOM 999 O LEU A 87 36.707 41.618 21.205 1.00 0.09 A +ATOM 1000 CB LEU A 87 39.801 42.345 21.125 1.00 0.08 A +ATOM 1001 CG LEU A 87 41.183 42.838 20.650 1.00 0.08 A +ATOM 1002 CD1 LEU A 87 41.826 41.874 19.689 1.00 0.08 A +ATOM 1003 CD2 LEU A 87 41.077 44.229 20.039 1.00 0.09 A +ATOM 1004 H LEU A 87 37.858 43.437 19.544 1.00 0.10 A +ATOM 1005 HA LEU A 87 39.384 40.920 19.562 1.00 0.09 A +ATOM 1006 1HB LEU A 87 39.287 43.187 21.534 1.00 0.08 A +ATOM 1007 2HB LEU A 87 39.969 41.643 21.940 1.00 0.07 A +ATOM 1008 HG LEU A 87 41.824 42.910 21.523 1.00 0.07 A +ATOM 1009 1HD1 LEU A 87 41.264 41.857 18.781 1.00 0.09 A +ATOM 1010 2HD1 LEU A 87 41.841 40.895 20.139 1.00 0.07 A +ATOM 1011 3HD1 LEU A 87 42.841 42.194 19.488 1.00 0.08 A +ATOM 1012 1HD2 LEU A 87 40.418 44.203 19.190 1.00 0.09 A +ATOM 1013 2HD2 LEU A 87 42.059 44.558 19.734 1.00 0.09 A +ATOM 1014 3HD2 LEU A 87 40.686 44.910 20.783 1.00 0.08 A +ATOM 1015 N PHE A 88 38.069 39.920 21.545 1.00 0.08 A +ATOM 1016 CA PHE A 88 37.146 39.270 22.441 1.00 0.08 A +ATOM 1017 C PHE A 88 37.920 38.580 23.573 1.00 0.08 A +ATOM 1018 O PHE A 88 38.624 37.606 23.395 1.00 0.08 A +ATOM 1019 CB PHE A 88 36.217 38.306 21.700 1.00 0.10 A +ATOM 1020 CG PHE A 88 35.195 37.751 22.665 1.00 0.11 A +ATOM 1021 CD1 PHE A 88 34.236 38.608 23.236 1.00 0.15 A +ATOM 1022 CD2 PHE A 88 35.198 36.380 22.992 1.00 0.12 A +ATOM 1023 CE1 PHE A 88 33.280 38.097 24.134 1.00 0.18 A +ATOM 1024 CE2 PHE A 88 34.241 35.868 23.889 1.00 0.15 A +ATOM 1025 CZ PHE A 88 33.282 36.727 24.460 1.00 0.18 A +ATOM 1026 H PHE A 88 38.934 39.505 21.350 1.00 0.08 A +ATOM 1027 HA PHE A 88 36.548 40.021 22.932 1.00 0.09 A +ATOM 1028 1HB PHE A 88 35.712 38.835 20.905 1.00 0.11 A +ATOM 1029 2HB PHE A 88 36.797 37.497 21.282 1.00 0.10 A +ATOM 1030 HD1 PHE A 88 34.233 39.658 22.986 1.00 0.16 A +ATOM 1031 HD2 PHE A 88 35.934 35.722 22.553 1.00 0.13 A +ATOM 1032 HE1 PHE A 88 32.546 38.756 24.572 1.00 0.22 A +ATOM 1033 HE2 PHE A 88 34.242 34.818 24.139 1.00 0.16 A +ATOM 1034 HZ PHE A 88 32.549 36.335 25.150 1.00 0.21 A +ATOM 1035 N VAL A 89 37.742 39.127 24.754 1.00 0.07 A +ATOM 1036 CA VAL A 89 38.356 38.646 25.987 1.00 0.06 A +ATOM 1037 C VAL A 89 37.377 37.849 26.818 1.00 0.07 A +ATOM 1038 O VAL A 89 36.374 38.345 27.292 1.00 0.07 A +ATOM 1039 CB VAL A 89 38.877 39.844 26.725 1.00 0.05 A +ATOM 1040 CG1 VAL A 89 39.703 39.424 27.945 1.00 0.05 A +ATOM 1041 CG2 VAL A 89 39.737 40.622 25.730 1.00 0.05 A +ATOM 1042 H VAL A 89 37.143 39.897 24.824 1.00 0.07 A +ATOM 1043 HA VAL A 89 39.168 37.971 25.757 1.00 0.06 A +ATOM 1044 HB VAL A 89 38.049 40.460 27.043 1.00 0.06 A +ATOM 1045 1HG1 VAL A 89 40.226 40.285 28.337 1.00 0.04 A +ATOM 1046 2HG1 VAL A 89 40.417 38.669 27.656 1.00 0.05 A +ATOM 1047 3HG1 VAL A 89 39.045 39.028 28.705 1.00 0.05 A +ATOM 1048 1HG2 VAL A 89 39.090 41.153 25.045 1.00 0.06 A +ATOM 1049 2HG2 VAL A 89 40.359 39.932 25.170 1.00 0.05 A +ATOM 1050 3HG2 VAL A 89 40.361 41.322 26.254 1.00 0.05 A +ATOM 1051 N HIS A 90 37.677 36.573 26.984 1.00 0.07 A +ATOM 1052 CA HIS A 90 36.797 35.720 27.737 1.00 0.08 A +ATOM 1053 C HIS A 90 37.548 35.048 28.923 1.00 0.08 A +ATOM 1054 O HIS A 90 38.296 34.127 28.744 1.00 0.08 A +ATOM 1055 CB HIS A 90 36.172 34.677 26.766 1.00 0.09 A +ATOM 1056 CG HIS A 90 35.330 33.706 27.547 1.00 0.10 A +ATOM 1057 ND1 HIS A 90 35.881 32.806 28.445 1.00 0.16 A +ATOM 1058 CD2 HIS A 90 33.975 33.483 27.576 1.00 0.16 A +ATOM 1059 CE1 HIS A 90 34.871 32.089 28.972 1.00 0.15 A +ATOM 1060 NE2 HIS A 90 33.688 32.461 28.476 1.00 0.15 A +ATOM 1061 H HIS A 90 38.489 36.207 26.573 1.00 0.07 A +ATOM 1062 HA HIS A 90 36.013 36.312 28.189 1.00 0.08 A +ATOM 1063 1HB HIS A 90 35.555 35.186 26.041 1.00 0.10 A +ATOM 1064 2HB HIS A 90 36.960 34.142 26.256 1.00 0.10 A +ATOM 1065 HD1 HIS A 90 36.832 32.709 28.658 1.00 0.22 A +ATOM 1066 HD2 HIS A 90 33.244 34.019 26.989 1.00 0.24 A +ATOM 1067 HE1 HIS A 90 35.001 31.308 29.706 1.00 0.20 A +ATOM 1068 N PHE A 91 37.322 35.505 30.162 1.00 0.08 A +ATOM 1069 CA PHE A 91 37.981 34.887 31.299 1.00 0.08 A +ATOM 1070 C PHE A 91 37.629 33.397 31.586 1.00 0.09 A +ATOM 1071 O PHE A 91 36.490 33.050 31.828 1.00 0.10 A +ATOM 1072 CB PHE A 91 37.615 35.640 32.583 1.00 0.08 A +ATOM 1073 CG PHE A 91 38.570 35.251 33.687 1.00 0.08 A +ATOM 1074 CD1 PHE A 91 38.322 34.107 34.466 1.00 0.09 A +ATOM 1075 CD2 PHE A 91 39.712 36.037 33.935 1.00 0.07 A +ATOM 1076 CE1 PHE A 91 39.217 33.746 35.493 1.00 0.09 A +ATOM 1077 CE2 PHE A 91 40.606 35.678 34.961 1.00 0.08 A +ATOM 1078 CZ PHE A 91 40.359 34.532 35.740 1.00 0.09 A +ATOM 1079 H PHE A 91 36.698 36.248 30.307 1.00 0.07 A +ATOM 1080 HA PHE A 91 39.051 34.920 31.156 1.00 0.07 A +ATOM 1081 1HB PHE A 91 37.686 36.702 32.405 1.00 0.07 A +ATOM 1082 2HB PHE A 91 36.605 35.392 32.876 1.00 0.08 A +ATOM 1083 HD1 PHE A 91 37.448 33.507 34.277 1.00 0.09 A +ATOM 1084 HD2 PHE A 91 39.900 36.916 33.338 1.00 0.07 A +ATOM 1085 HE1 PHE A 91 39.026 32.867 36.091 1.00 0.10 A +ATOM 1086 HE2 PHE A 91 41.482 36.281 35.150 1.00 0.08 A +ATOM 1087 HZ PHE A 91 41.044 34.255 36.527 1.00 0.09 A +ATOM 1088 N GLY A 92 38.652 32.527 31.637 1.00 0.09 A +ATOM 1089 CA GLY A 92 38.442 31.136 31.983 1.00 0.10 A +ATOM 1090 C GLY A 92 37.692 30.329 30.931 1.00 0.11 A +ATOM 1091 O GLY A 92 37.345 30.803 29.868 1.00 0.11 A +ATOM 1092 H GLY A 92 39.565 32.836 31.455 1.00 0.09 A +ATOM 1093 1HA GLY A 92 39.407 30.681 32.148 1.00 0.10 A +ATOM 1094 2HA GLY A 92 37.866 31.100 32.896 1.00 0.11 A +ATOM 1095 N ILE A 93 37.429 29.084 31.290 1.00 0.12 A +ATOM 1096 CA ILE A 93 36.724 28.149 30.462 1.00 0.13 A +ATOM 1097 C ILE A 93 35.432 27.729 31.165 1.00 0.14 A +ATOM 1098 O ILE A 93 35.381 27.439 32.344 1.00 0.14 A +ATOM 1099 CB ILE A 93 37.626 26.986 30.060 1.00 0.14 A +ATOM 1100 CG1 ILE A 93 38.890 27.508 29.368 1.00 0.13 A +ATOM 1101 CG2 ILE A 93 36.887 25.990 29.164 1.00 0.15 A +ATOM 1102 CD1 ILE A 93 38.541 28.334 28.130 1.00 0.12 A +ATOM 1103 H ILE A 93 37.720 28.785 32.176 1.00 0.12 A +ATOM 1104 HA ILE A 93 36.380 28.654 29.572 1.00 0.13 A +ATOM 1105 HB ILE A 93 37.913 26.465 30.955 1.00 0.14 A +ATOM 1106 1HG1 ILE A 93 39.437 28.129 30.061 1.00 0.12 A +ATOM 1107 2HG1 ILE A 93 39.505 26.672 29.076 1.00 0.13 A +ATOM 1108 1HG2 ILE A 93 36.551 26.482 28.267 1.00 0.14 A +ATOM 1109 2HG2 ILE A 93 36.037 25.591 29.700 1.00 0.15 A +ATOM 1110 3HG2 ILE A 93 37.555 25.179 28.906 1.00 0.15 A +ATOM 1111 1HD1 ILE A 93 37.736 27.863 27.587 1.00 0.13 A +ATOM 1112 2HD1 ILE A 93 39.402 28.400 27.505 1.00 0.12 A +ATOM 1113 3HD1 ILE A 93 38.251 29.324 28.419 1.00 0.12 A +ATOM 1114 N ASP A 94 34.373 27.766 30.401 1.00 0.14 A +ATOM 1115 CA ASP A 94 33.061 27.469 30.883 1.00 0.15 A +ATOM 1116 C ASP A 94 32.701 28.346 32.105 1.00 0.15 A +ATOM 1117 O ASP A 94 31.893 27.959 32.926 1.00 0.15 A +ATOM 1118 CB ASP A 94 32.843 26.015 31.315 1.00 0.16 A +ATOM 1119 CG ASP A 94 32.968 25.097 30.098 1.00 0.17 A +ATOM 1120 OD1 ASP A 94 32.946 25.608 28.990 1.00 0.17 A +ATOM 1121 OD2 ASP A 94 33.082 23.898 30.293 1.00 0.18 A +ATOM 1122 H ASP A 94 34.480 28.023 29.463 1.00 0.14 A +ATOM 1123 HA ASP A 94 32.357 27.694 30.096 1.00 0.15 A +ATOM 1124 1HB ASP A 94 33.587 25.743 32.050 1.00 0.16 A +ATOM 1125 2HB ASP A 94 31.857 25.909 31.743 1.00 0.17 A +ATOM 1126 N THR A 95 33.282 29.503 32.244 1.00 0.14 A +ATOM 1127 CA THR A 95 32.988 30.350 33.364 1.00 0.13 A +ATOM 1128 C THR A 95 31.528 30.879 33.436 1.00 0.14 A +ATOM 1129 O THR A 95 31.080 31.254 34.507 1.00 0.14 A +ATOM 1130 CB THR A 95 34.054 31.455 33.419 1.00 0.12 A +ATOM 1131 OG1 THR A 95 34.344 31.849 32.087 1.00 0.12 A +ATOM 1132 CG2 THR A 95 35.317 30.900 34.061 1.00 0.12 A +ATOM 1133 H THR A 95 33.952 29.801 31.595 1.00 0.13 A +ATOM 1134 HA THR A 95 33.011 29.773 34.277 1.00 0.14 A +ATOM 1135 HB THR A 95 33.688 32.301 33.978 1.00 0.12 A +ATOM 1136 HG1 THR A 95 35.167 32.339 32.096 1.00 0.11 A +ATOM 1137 1HG2 THR A 95 35.657 30.042 33.498 1.00 0.12 A +ATOM 1138 2HG2 THR A 95 35.107 30.606 35.077 1.00 0.12 A +ATOM 1139 3HG2 THR A 95 36.075 31.658 34.058 1.00 0.11 A +ATOM 1140 N VAL A 96 30.782 30.891 32.381 1.00 0.14 A +ATOM 1141 CA VAL A 96 29.381 31.348 32.449 1.00 0.14 A +ATOM 1142 C VAL A 96 28.626 30.511 33.479 1.00 0.15 A +ATOM 1143 O VAL A 96 27.717 30.980 34.136 1.00 0.15 A +ATOM 1144 CB VAL A 96 28.584 31.190 31.131 1.00 0.15 A +ATOM 1145 CG1 VAL A 96 28.409 29.705 30.786 1.00 0.17 A +ATOM 1146 CG2 VAL A 96 27.207 31.845 31.279 1.00 0.17 A +ATOM 1147 H VAL A 96 31.158 30.599 31.524 1.00 0.14 A +ATOM 1148 HA VAL A 96 29.383 32.393 32.720 1.00 0.14 A +ATOM 1149 HB VAL A 96 29.126 31.676 30.332 1.00 0.14 A +ATOM 1150 1HG1 VAL A 96 28.132 29.608 29.746 1.00 1.00 A +ATOM 1151 2HG1 VAL A 96 27.633 29.278 31.405 1.00 1.04 A +ATOM 1152 3HG1 VAL A 96 29.338 29.183 30.961 1.00 1.02 A +ATOM 1153 1HG2 VAL A 96 27.330 32.874 31.583 1.00 1.02 A +ATOM 1154 2HG2 VAL A 96 26.631 31.316 32.023 1.00 1.03 A +ATOM 1155 3HG2 VAL A 96 26.690 31.810 30.332 1.00 1.03 A +ATOM 1156 N GLU A 97 28.993 29.262 33.611 1.00 0.16 A +ATOM 1157 CA GLU A 97 28.307 28.401 34.562 1.00 0.17 A +ATOM 1158 C GLU A 97 28.385 28.958 36.024 1.00 0.17 A +ATOM 1159 O GLU A 97 27.562 28.608 36.847 1.00 0.17 A +ATOM 1160 CB GLU A 97 28.741 26.911 34.483 1.00 0.18 A +ATOM 1161 CG GLU A 97 28.385 26.340 33.107 1.00 0.19 A +ATOM 1162 CD GLU A 97 26.865 26.325 32.931 1.00 0.21 A +ATOM 1163 OE1 GLU A 97 26.171 26.412 33.930 1.00 0.20 A +ATOM 1164 OE2 GLU A 97 26.421 26.226 31.799 1.00 0.24 A +ATOM 1165 H GLU A 97 29.741 28.908 33.086 1.00 0.16 A +ATOM 1166 HA GLU A 97 27.247 28.458 34.369 1.00 0.17 A +ATOM 1167 1HB GLU A 97 29.808 26.839 34.637 1.00 0.18 A +ATOM 1168 2HB GLU A 97 28.229 26.347 35.248 1.00 0.18 A +ATOM 1169 1HG GLU A 97 28.831 26.954 32.338 1.00 0.21 A +ATOM 1170 2HG GLU A 97 28.764 25.332 33.027 1.00 0.19 A +ATOM 1171 N LEU A 98 29.308 29.828 36.357 1.00 0.16 A +ATOM 1172 CA LEU A 98 29.363 30.382 37.694 1.00 0.15 A +ATOM 1173 C LEU A 98 28.312 31.510 37.955 1.00 0.15 A +ATOM 1174 O LEU A 98 28.220 32.041 39.045 1.00 0.15 A +ATOM 1175 CB LEU A 98 30.741 30.978 37.954 1.00 0.15 A +ATOM 1176 CG LEU A 98 31.698 29.928 38.520 1.00 0.15 A +ATOM 1177 CD1 LEU A 98 31.504 28.595 37.792 1.00 0.16 A +ATOM 1178 CD2 LEU A 98 33.135 30.420 38.330 1.00 0.14 A +ATOM 1179 H LEU A 98 29.962 30.114 35.687 1.00 0.15 A +ATOM 1180 HA LEU A 98 29.168 29.599 38.412 1.00 0.16 A +ATOM 1181 1HB LEU A 98 31.138 31.353 37.021 1.00 0.14 A +ATOM 1182 2HB LEU A 98 30.666 31.797 38.659 1.00 0.14 A +ATOM 1183 HG LEU A 98 31.500 29.799 39.575 1.00 0.15 A +ATOM 1184 1HD1 LEU A 98 30.591 28.125 38.117 1.00 0.17 A +ATOM 1185 2HD1 LEU A 98 32.328 27.943 38.011 1.00 0.16 A +ATOM 1186 3HD1 LEU A 98 31.453 28.776 36.728 1.00 0.15 A +ATOM 1187 1HD2 LEU A 98 33.328 30.570 37.277 1.00 0.14 A +ATOM 1188 2HD2 LEU A 98 33.824 29.690 38.723 1.00 0.14 A +ATOM 1189 3HD2 LEU A 98 33.261 31.355 38.852 1.00 0.14 A +ATOM 1190 N LYS A 99 27.577 31.863 36.971 1.00 0.15 A +ATOM 1191 CA LYS A 99 26.555 32.901 37.008 1.00 0.15 A +ATOM 1192 C LYS A 99 26.975 34.234 37.619 1.00 0.14 A +ATOM 1193 O LYS A 99 26.239 34.837 38.374 1.00 0.14 A +ATOM 1194 CB LYS A 99 25.223 32.439 37.615 1.00 0.16 A +ATOM 1195 CG LYS A 99 24.651 31.293 36.776 1.00 1.40 A +ATOM 1196 CD LYS A 99 23.216 30.990 37.224 1.00 1.78 A +ATOM 1197 CE LYS A 99 23.211 30.462 38.665 1.00 2.52 A +ATOM 1198 NZ LYS A 99 23.257 31.609 39.615 1.00 3.21 A +ATOM 1199 H LYS A 99 27.716 31.406 36.116 1.00 0.15 A +ATOM 1200 HA LYS A 99 26.371 33.233 35.998 1.00 0.15 A +ATOM 1201 1HB LYS A 99 25.390 32.098 38.626 1.00 1.00 A +ATOM 1202 2HB LYS A 99 24.525 33.262 37.622 1.00 1.01 A +ATOM 1203 1HG LYS A 99 24.650 31.579 35.734 1.00 2.08 A +ATOM 1204 2HG LYS A 99 25.261 30.412 36.906 1.00 2.05 A +ATOM 1205 1HD LYS A 99 22.627 31.894 37.172 1.00 2.10 A +ATOM 1206 2HD LYS A 99 22.788 30.245 36.570 1.00 2.16 A +ATOM 1207 1HE LYS A 99 22.308 29.894 38.835 1.00 2.93 A +ATOM 1208 2HE LYS A 99 24.069 29.826 38.826 1.00 2.92 A +ATOM 1209 1HZ LYS A 99 24.115 31.544 40.197 1.00 3.61 A +ATOM 1210 2HZ LYS A 99 22.417 31.584 40.230 1.00 3.56 A +ATOM 1211 3HZ LYS A 99 23.270 32.502 39.082 1.00 3.54 A +ATOM 1212 N GLY A 100 28.118 34.736 37.243 1.00 0.13 A +ATOM 1213 CA GLY A 100 28.547 36.049 37.723 1.00 0.13 A +ATOM 1214 C GLY A 100 29.380 36.040 39.021 1.00 0.12 A +ATOM 1215 O GLY A 100 29.981 37.037 39.387 1.00 0.12 A +ATOM 1216 H GLY A 100 28.699 34.228 36.640 1.00 0.13 A +ATOM 1217 1HA GLY A 100 29.138 36.505 36.943 1.00 0.12 A +ATOM 1218 2HA GLY A 100 27.661 36.640 37.897 1.00 0.13 A +ATOM 1219 N GLU A 101 29.409 34.955 39.706 1.00 0.13 A +ATOM 1220 CA GLU A 101 30.155 34.843 40.952 1.00 0.13 A +ATOM 1221 C GLU A 101 31.670 35.057 40.741 1.00 0.12 A +ATOM 1222 O GLU A 101 32.304 34.329 40.002 1.00 0.12 A +ATOM 1223 CB GLU A 101 29.936 33.470 41.602 1.00 0.14 A +ATOM 1224 CG GLU A 101 29.601 33.592 43.122 1.00 0.15 A +ATOM 1225 CD GLU A 101 30.363 32.545 43.942 1.00 0.15 A +ATOM 1226 OE1 GLU A 101 30.358 31.390 43.543 1.00 0.16 A +ATOM 1227 OE2 GLU A 101 30.925 32.918 44.965 1.00 0.15 A +ATOM 1228 H GLU A 101 28.914 34.176 39.376 1.00 0.14 A +ATOM 1229 HA GLU A 101 29.824 35.613 41.632 1.00 0.13 A +ATOM 1230 1HB GLU A 101 29.112 32.981 41.099 1.00 0.15 A +ATOM 1231 2HB GLU A 101 30.823 32.861 41.477 1.00 0.14 A +ATOM 1232 1HG GLU A 101 29.866 34.570 43.487 1.00 0.14 A +ATOM 1233 2HG GLU A 101 28.542 33.438 43.262 1.00 0.15 A +ATOM 1234 N GLY A 102 32.242 36.057 41.425 1.00 0.12 A +ATOM 1235 CA GLY A 102 33.663 36.346 41.348 1.00 0.11 A +ATOM 1236 C GLY A 102 34.037 37.460 40.386 1.00 0.10 A +ATOM 1237 O GLY A 102 35.165 37.871 40.347 1.00 0.10 A +ATOM 1238 H GLY A 102 31.682 36.624 41.996 1.00 0.12 A +ATOM 1239 1HA GLY A 102 33.995 36.628 42.336 1.00 0.12 A +ATOM 1240 2HA GLY A 102 34.166 35.440 41.042 1.00 0.12 A +ATOM 1241 N PHE A 103 33.101 37.932 39.646 1.00 0.10 A +ATOM 1242 CA PHE A 103 33.278 39.036 38.705 1.00 0.09 A +ATOM 1243 C PHE A 103 32.430 40.259 39.120 1.00 0.09 A +ATOM 1244 O PHE A 103 31.382 40.132 39.721 1.00 0.10 A +ATOM 1245 CB PHE A 103 32.807 38.647 37.280 1.00 0.09 A +ATOM 1246 CG PHE A 103 33.515 37.392 36.833 1.00 0.09 A +ATOM 1247 CD1 PHE A 103 34.812 37.464 36.328 1.00 0.09 A +ATOM 1248 CD2 PHE A 103 32.862 36.158 36.911 1.00 0.10 A +ATOM 1249 CE1 PHE A 103 35.458 36.300 35.894 1.00 0.09 A +ATOM 1250 CE2 PHE A 103 33.506 34.994 36.483 1.00 0.10 A +ATOM 1251 CZ PHE A 103 34.804 35.065 35.971 1.00 0.10 A +ATOM 1252 H PHE A 103 32.212 37.532 39.728 1.00 0.11 A +ATOM 1253 HA PHE A 103 34.322 39.302 38.669 1.00 0.09 A +ATOM 1254 1HB PHE A 103 31.740 38.477 37.287 1.00 0.10 A +ATOM 1255 2HB PHE A 103 33.038 39.453 36.605 1.00 0.09 A +ATOM 1256 HD1 PHE A 103 35.316 38.415 36.270 1.00 0.08 A +ATOM 1257 HD2 PHE A 103 31.863 36.104 37.312 1.00 0.11 A +ATOM 1258 HE1 PHE A 103 36.462 36.355 35.505 1.00 0.08 A +ATOM 1259 HE2 PHE A 103 32.998 34.043 36.545 1.00 0.11 A +ATOM 1260 HZ PHE A 103 35.301 34.169 35.630 1.00 0.10 A +ATOM 1261 N LYS A 104 32.896 41.432 38.742 1.00 0.09 A +ATOM 1262 CA LYS A 104 32.228 42.690 38.968 1.00 0.09 A +ATOM 1263 C LYS A 104 32.422 43.580 37.763 1.00 0.08 A +ATOM 1264 O LYS A 104 33.520 44.017 37.472 1.00 0.08 A +ATOM 1265 CB LYS A 104 32.642 43.452 40.217 1.00 0.09 A +ATOM 1266 CG LYS A 104 32.857 42.506 41.420 1.00 0.09 A +ATOM 1267 CD LYS A 104 34.239 41.818 41.348 1.00 0.09 A +ATOM 1268 CE LYS A 104 34.229 40.470 42.093 1.00 0.10 A +ATOM 1269 NZ LYS A 104 35.477 39.704 41.796 1.00 0.10 A +ATOM 1270 H LYS A 104 33.746 41.454 38.257 1.00 0.08 A +ATOM 1271 HA LYS A 104 31.169 42.492 39.039 1.00 0.09 A +ATOM 1272 1HB LYS A 104 33.563 43.985 40.022 1.00 0.09 A +ATOM 1273 2HB LYS A 104 31.870 44.167 40.468 1.00 0.09 A +ATOM 1274 1HG LYS A 104 32.807 43.090 42.329 1.00 0.10 A +ATOM 1275 2HG LYS A 104 32.079 41.764 41.431 1.00 0.10 A +ATOM 1276 1HD LYS A 104 34.494 41.649 40.334 1.00 0.09 A +ATOM 1277 2HD LYS A 104 34.984 42.460 41.795 1.00 0.09 A +ATOM 1278 1HE LYS A 104 34.168 40.647 43.153 1.00 0.10 A +ATOM 1279 2HE LYS A 104 33.376 39.889 41.775 1.00 0.10 A +ATOM 1280 1HZ LYS A 104 35.295 39.028 41.025 1.00 0.10 A +ATOM 1281 2HZ LYS A 104 35.773 39.182 42.648 1.00 0.10 A +ATOM 1282 3HZ LYS A 104 36.234 40.356 41.510 1.00 0.09 A +ATOM 1283 N ARG A 105 31.345 43.858 37.070 1.00 0.09 A +ATOM 1284 CA ARG A 105 31.422 44.722 35.913 1.00 0.08 A +ATOM 1285 C ARG A 105 31.755 46.083 36.329 1.00 0.08 A +ATOM 1286 O ARG A 105 31.069 46.672 37.144 1.00 0.09 A +ATOM 1287 CB ARG A 105 30.170 44.662 35.063 1.00 0.09 A +ATOM 1288 CG ARG A 105 29.981 45.853 34.129 1.00 0.09 A +ATOM 1289 CD ARG A 105 28.582 45.813 33.476 1.00 0.10 A +ATOM 1290 NE ARG A 105 28.176 44.391 33.193 1.00 0.10 A +ATOM 1291 CZ ARG A 105 27.284 44.106 32.274 1.00 0.11 A +ATOM 1292 NH1 ARG A 105 26.790 45.062 31.516 1.00 0.12 A +ATOM 1293 NH2 ARG A 105 26.890 42.873 32.087 1.00 0.12 A +ATOM 1294 H ARG A 105 30.481 43.483 37.339 1.00 0.09 A +ATOM 1295 HA ARG A 105 32.265 44.421 35.310 1.00 0.08 A +ATOM 1296 1HB ARG A 105 30.206 43.766 34.463 1.00 0.09 A +ATOM 1297 2HB ARG A 105 29.316 44.599 35.722 1.00 0.10 A +ATOM 1298 1HG ARG A 105 30.065 46.771 34.687 1.00 0.09 A +ATOM 1299 2HG ARG A 105 30.733 45.827 33.360 1.00 0.09 A +ATOM 1300 1HD ARG A 105 27.859 46.233 34.127 1.00 0.11 A +ATOM 1301 2HD ARG A 105 28.612 46.423 32.572 1.00 0.10 A +ATOM 1302 1HH1 ARG A 105 27.086 46.009 31.643 1.00 0.12 A +ATOM 1303 2HH1 ARG A 105 26.132 44.838 30.794 1.00 0.12 A +ATOM 1304 1HH2 ARG A 105 27.257 42.138 32.649 1.00 0.11 A +ATOM 1305 2HH2 ARG A 105 26.231 42.666 31.363 1.00 0.12 A +ATOM 1306 N ILE A 106 32.834 46.629 35.785 1.00 0.08 A +ATOM 1307 CA ILE A 106 33.127 47.940 36.226 1.00 0.08 A +ATOM 1308 C ILE A 106 32.774 48.896 35.118 1.00 0.09 A +ATOM 1309 O ILE A 106 32.323 49.999 35.369 1.00 0.09 A +ATOM 1310 CB ILE A 106 34.587 48.049 36.605 1.00 0.08 A +ATOM 1311 CG1 ILE A 106 34.931 47.101 37.746 1.00 0.08 A +ATOM 1312 CG2 ILE A 106 34.973 49.502 36.933 1.00 0.09 A +ATOM 1313 CD1 ILE A 106 34.335 47.554 39.080 1.00 0.08 A +ATOM 1314 H ILE A 106 33.386 46.148 35.134 1.00 0.08 A +ATOM 1315 HA ILE A 106 32.516 48.173 37.085 1.00 0.09 A +ATOM 1316 HB ILE A 106 35.170 47.753 35.740 1.00 0.08 A +ATOM 1317 1HG1 ILE A 106 34.560 46.115 37.510 1.00 0.08 A +ATOM 1318 2HG1 ILE A 106 35.995 47.072 37.830 1.00 0.08 A +ATOM 1319 1HG2 ILE A 106 35.221 50.026 36.018 1.00 0.09 A +ATOM 1320 2HG2 ILE A 106 35.834 49.509 37.588 1.00 0.09 A +ATOM 1321 3HG2 ILE A 106 34.149 50.000 37.418 1.00 0.09 A +ATOM 1322 1HD1 ILE A 106 34.447 48.618 39.195 1.00 0.09 A +ATOM 1323 2HD1 ILE A 106 34.859 47.055 39.883 1.00 0.09 A +ATOM 1324 3HD1 ILE A 106 33.291 47.291 39.115 1.00 0.09 A +ATOM 1325 N ALA A 107 32.968 48.498 33.880 1.00 0.09 A +ATOM 1326 CA ALA A 107 32.652 49.400 32.809 1.00 0.09 A +ATOM 1327 C ALA A 107 31.241 49.164 32.249 1.00 0.10 A +ATOM 1328 O ALA A 107 30.533 48.272 32.683 1.00 0.10 A +ATOM 1329 CB ALA A 107 33.688 49.282 31.697 1.00 0.09 A +ATOM 1330 H ALA A 107 33.335 47.607 33.700 1.00 0.08 A +ATOM 1331 HA ALA A 107 32.646 50.412 33.184 1.00 0.10 A +ATOM 1332 1HB ALA A 107 33.636 48.298 31.257 1.00 0.08 A +ATOM 1333 2HB ALA A 107 34.670 49.448 32.107 1.00 0.09 A +ATOM 1334 3HB ALA A 107 33.488 50.027 30.941 1.00 0.09 A +ATOM 1335 N GLU A 108 30.832 49.981 31.266 1.00 0.10 A +ATOM 1336 CA GLU A 108 29.516 49.819 30.654 1.00 0.11 A +ATOM 1337 C GLU A 108 29.598 49.502 29.161 1.00 0.12 A +ATOM 1338 O GLU A 108 30.503 49.943 28.485 1.00 0.11 A +ATOM 1339 CB GLU A 108 28.666 51.102 30.727 1.00 0.12 A +ATOM 1340 CG GLU A 108 28.699 51.805 32.080 1.00 0.12 A +ATOM 1341 CD GLU A 108 27.819 53.060 31.992 1.00 0.13 A +ATOM 1342 OE1 GLU A 108 27.467 53.447 30.883 1.00 0.14 A +ATOM 1343 OE2 GLU A 108 27.503 53.607 33.039 1.00 0.13 A +ATOM 1344 H GLU A 108 31.438 50.677 30.935 1.00 0.11 A +ATOM 1345 HA GLU A 108 28.991 49.027 31.167 1.00 0.11 A +ATOM 1346 1HB GLU A 108 29.017 51.801 29.981 1.00 0.13 A +ATOM 1347 2HB GLU A 108 27.642 50.842 30.499 1.00 0.13 A +ATOM 1348 1HG GLU A 108 28.313 51.151 32.845 1.00 0.12 A +ATOM 1349 2HG GLU A 108 29.710 52.096 32.318 1.00 0.12 A +ATOM 1350 N GLU A 109 28.613 48.790 28.621 1.00 0.12 A +ATOM 1351 CA GLU A 109 28.624 48.563 27.164 1.00 0.12 A +ATOM 1352 C GLU A 109 28.551 49.935 26.469 1.00 0.13 A +ATOM 1353 O GLU A 109 27.810 50.815 26.861 1.00 0.14 A +ATOM 1354 CB GLU A 109 27.573 47.598 26.537 1.00 0.13 A +ATOM 1355 CG GLU A 109 27.709 46.212 27.140 1.00 0.16 A +ATOM 1356 CD GLU A 109 26.631 45.298 26.557 1.00 1.02 A +ATOM 1357 OE1 GLU A 109 25.843 45.778 25.758 1.00 1.60 A +ATOM 1358 OE2 GLU A 109 26.604 44.137 26.926 1.00 1.25 A +ATOM 1359 H GLU A 109 27.882 48.441 29.174 1.00 0.12 A +ATOM 1360 HA GLU A 109 29.600 48.173 26.914 1.00 0.12 A +ATOM 1361 1HB GLU A 109 26.580 47.976 26.730 1.00 0.16 A +ATOM 1362 2HB GLU A 109 27.733 47.541 25.470 1.00 0.15 A +ATOM 1363 1HG GLU A 109 28.678 45.826 26.897 1.00 0.73 A +ATOM 1364 2HG GLU A 109 27.595 46.266 28.210 1.00 0.65 A +ATOM 1365 N GLY A 110 29.344 50.106 25.433 1.00 0.13 A +ATOM 1366 CA GLY A 110 29.399 51.366 24.668 1.00 0.14 A +ATOM 1367 C GLY A 110 30.417 52.318 25.239 1.00 0.14 A +ATOM 1368 O GLY A 110 30.672 53.377 24.691 1.00 0.14 A +ATOM 1369 H GLY A 110 29.916 49.366 25.145 1.00 0.13 A +ATOM 1370 1HA GLY A 110 29.657 51.137 23.645 1.00 0.14 A +ATOM 1371 2HA GLY A 110 28.425 51.831 24.698 1.00 0.15 A +ATOM 1372 N GLN A 111 31.000 51.967 26.333 1.00 0.13 A +ATOM 1373 CA GLN A 111 31.983 52.848 26.895 1.00 0.13 A +ATOM 1374 C GLN A 111 33.220 52.993 26.017 1.00 0.13 A +ATOM 1375 O GLN A 111 33.776 52.043 25.495 1.00 0.12 A +ATOM 1376 CB GLN A 111 32.432 52.339 28.287 1.00 0.12 A +ATOM 1377 CG GLN A 111 33.037 53.489 29.104 1.00 0.12 A +ATOM 1378 CD GLN A 111 33.268 53.040 30.542 1.00 0.11 A +ATOM 1379 OE1 GLN A 111 32.370 52.527 31.192 1.00 0.11 A +ATOM 1380 NE2 GLN A 111 34.451 53.223 31.064 1.00 0.11 A +ATOM 1381 H GLN A 111 30.772 51.120 26.767 1.00 0.12 A +ATOM 1382 HA GLN A 111 31.560 53.836 26.998 1.00 0.13 A +ATOM 1383 1HB GLN A 111 31.579 51.945 28.813 1.00 0.12 A +ATOM 1384 2HB GLN A 111 33.170 51.561 28.168 1.00 0.11 A +ATOM 1385 1HG GLN A 111 33.982 53.776 28.672 1.00 0.12 A +ATOM 1386 2HG GLN A 111 32.365 54.333 29.098 1.00 0.13 A +ATOM 1387 1HE2 GLN A 111 35.157 53.646 30.529 1.00 0.11 A +ATOM 1388 2HE2 GLN A 111 34.640 52.931 31.980 1.00 0.11 A +ATOM 1389 N ARG A 112 33.671 54.218 25.927 1.00 0.13 A +ATOM 1390 CA ARG A 112 34.866 54.540 25.229 1.00 0.14 A +ATOM 1391 C ARG A 112 35.998 54.363 26.183 1.00 0.13 A +ATOM 1392 O ARG A 112 35.928 54.792 27.322 1.00 0.13 A +ATOM 1393 CB ARG A 112 34.852 55.918 24.588 1.00 0.15 A +ATOM 1394 CG ARG A 112 35.198 55.803 23.085 1.00 0.15 A +ATOM 1395 CD ARG A 112 34.867 57.120 22.329 1.00 0.16 A +ATOM 1396 NE ARG A 112 36.005 57.637 21.512 1.00 0.17 A +ATOM 1397 CZ ARG A 112 36.794 56.891 20.836 1.00 0.16 A +ATOM 1398 NH1 ARG A 112 36.488 55.623 20.643 1.00 0.16 A +ATOM 1399 NH2 ARG A 112 37.852 57.402 20.268 1.00 0.17 A +ATOM 1400 H ARG A 112 33.186 54.932 26.392 1.00 0.14 A +ATOM 1401 HA ARG A 112 35.014 53.805 24.453 1.00 0.13 A +ATOM 1402 1HB ARG A 112 33.866 56.348 24.694 1.00 0.15 A +ATOM 1403 2HB ARG A 112 35.575 56.562 25.070 1.00 0.15 A +ATOM 1404 1HG ARG A 112 36.251 55.594 22.995 1.00 0.15 A +ATOM 1405 2HG ARG A 112 34.634 54.994 22.645 1.00 0.15 A +ATOM 1406 1HD ARG A 112 33.945 56.945 21.731 1.00 0.17 A +ATOM 1407 2HD ARG A 112 34.711 57.906 23.003 1.00 0.17 A +ATOM 1408 1HH1 ARG A 112 35.640 55.250 21.025 1.00 0.16 A +ATOM 1409 2HH1 ARG A 112 37.094 55.034 20.107 1.00 0.15 A +ATOM 1410 1HH2 ARG A 112 38.045 58.379 20.360 1.00 0.18 A +ATOM 1411 2HH2 ARG A 112 38.463 56.821 19.729 1.00 0.17 A +ATOM 1412 N VAL A 113 37.042 53.689 25.755 1.00 0.12 A +ATOM 1413 CA VAL A 113 38.113 53.455 26.693 1.00 0.12 A +ATOM 1414 C VAL A 113 39.448 53.595 26.089 1.00 0.12 A +ATOM 1415 O VAL A 113 39.660 53.456 24.897 1.00 0.12 A +ATOM 1416 CB VAL A 113 38.091 52.029 27.244 1.00 0.10 A +ATOM 1417 CG1 VAL A 113 36.789 51.764 27.999 1.00 0.10 A +ATOM 1418 CG2 VAL A 113 38.256 51.019 26.111 1.00 0.10 A +ATOM 1419 H VAL A 113 37.076 53.345 24.839 1.00 0.12 A +ATOM 1420 HA VAL A 113 38.014 54.149 27.516 1.00 0.12 A +ATOM 1421 HB VAL A 113 38.911 51.911 27.924 1.00 0.10 A +ATOM 1422 1HG1 VAL A 113 35.965 51.732 27.304 1.00 0.11 A +ATOM 1423 2HG1 VAL A 113 36.626 52.551 28.721 1.00 0.11 A +ATOM 1424 3HG1 VAL A 113 36.863 50.816 28.515 1.00 0.09 A +ATOM 1425 1HG2 VAL A 113 37.614 51.286 25.287 1.00 0.11 A +ATOM 1426 2HG2 VAL A 113 37.996 50.041 26.477 1.00 0.09 A +ATOM 1427 3HG2 VAL A 113 39.287 51.015 25.782 1.00 0.10 A +ATOM 1428 N LYS A 114 40.358 53.787 26.977 1.00 0.12 A +ATOM 1429 CA LYS A 114 41.739 53.839 26.635 1.00 0.12 A +ATOM 1430 C LYS A 114 42.414 52.614 27.195 1.00 0.11 A +ATOM 1431 O LYS A 114 41.971 52.030 28.169 1.00 0.10 A +ATOM 1432 CB LYS A 114 42.454 55.038 27.227 1.00 0.13 A +ATOM 1433 CG LYS A 114 41.910 56.369 26.670 1.00 0.14 A +ATOM 1434 CD LYS A 114 41.487 57.340 27.796 1.00 0.14 A +ATOM 1435 CE LYS A 114 40.492 56.687 28.779 1.00 0.14 A +ATOM 1436 NZ LYS A 114 40.461 57.426 30.075 1.00 0.14 A +ATOM 1437 H LYS A 114 40.094 53.874 27.917 1.00 0.11 A +ATOM 1438 HA LYS A 114 41.826 53.885 25.559 1.00 0.12 A +ATOM 1439 1HB LYS A 114 42.378 55.003 28.292 1.00 0.12 A +ATOM 1440 2HB LYS A 114 43.505 54.958 26.977 1.00 0.13 A +ATOM 1441 1HG LYS A 114 42.694 56.845 26.090 1.00 0.14 A +ATOM 1442 2HG LYS A 114 41.068 56.180 26.024 1.00 0.14 A +ATOM 1443 1HD LYS A 114 42.363 57.664 28.333 1.00 0.15 A +ATOM 1444 2HD LYS A 114 41.013 58.196 27.340 1.00 0.15 A +ATOM 1445 1HE LYS A 114 39.509 56.689 28.348 1.00 0.14 A +ATOM 1446 2HE LYS A 114 40.777 55.689 28.974 1.00 0.13 A +ATOM 1447 1HZ LYS A 114 39.564 57.939 30.159 1.00 0.14 A +ATOM 1448 2HZ LYS A 114 41.255 58.096 30.118 1.00 0.15 A +ATOM 1449 3HZ LYS A 114 40.541 56.745 30.860 1.00 0.13 A +ATOM 1450 N VAL A 115 43.507 52.259 26.616 1.00 0.11 A +ATOM 1451 CA VAL A 115 44.274 51.158 27.108 1.00 0.10 A +ATOM 1452 C VAL A 115 44.437 51.218 28.626 1.00 0.10 A +ATOM 1453 O VAL A 115 44.738 52.250 29.194 1.00 0.10 A +ATOM 1454 CB VAL A 115 45.653 51.216 26.494 1.00 0.10 A +ATOM 1455 CG1 VAL A 115 46.467 49.992 26.928 1.00 0.09 A +ATOM 1456 CG2 VAL A 115 45.512 51.219 24.954 1.00 0.10 A +ATOM 1457 H VAL A 115 43.827 52.763 25.840 1.00 0.11 A +ATOM 1458 HA VAL A 115 43.794 50.229 26.834 1.00 0.09 A +ATOM 1459 HB VAL A 115 46.156 52.115 26.821 1.00 0.11 A +ATOM 1460 1HG1 VAL A 115 45.901 49.094 26.727 1.00 0.08 A +ATOM 1461 2HG1 VAL A 115 46.691 50.054 27.979 1.00 0.09 A +ATOM 1462 3HG1 VAL A 115 47.387 49.965 26.365 1.00 0.10 A +ATOM 1463 1HG2 VAL A 115 44.474 51.088 24.677 1.00 0.10 A +ATOM 1464 2HG2 VAL A 115 46.090 50.412 24.526 1.00 0.10 A +ATOM 1465 3HG2 VAL A 115 45.866 52.158 24.559 1.00 0.11 A +ATOM 1466 N GLY A 116 44.263 50.094 29.283 1.00 0.09 A +ATOM 1467 CA GLY A 116 44.437 50.039 30.711 1.00 0.09 A +ATOM 1468 C GLY A 116 43.170 50.347 31.516 1.00 0.09 A +ATOM 1469 O GLY A 116 43.124 50.096 32.703 1.00 0.08 A +ATOM 1470 H GLY A 116 44.025 49.278 28.793 1.00 0.08 A +ATOM 1471 1HA GLY A 116 44.769 49.046 30.970 1.00 0.08 A +ATOM 1472 2HA GLY A 116 45.197 50.757 30.982 1.00 0.09 A +ATOM 1473 N ASP A 117 42.155 50.866 30.907 1.00 0.09 A +ATOM 1474 CA ASP A 117 40.906 51.163 31.638 1.00 0.09 A +ATOM 1475 C ASP A 117 40.301 49.874 32.169 1.00 0.08 A +ATOM 1476 O ASP A 117 40.273 48.866 31.494 1.00 0.07 A +ATOM 1477 CB ASP A 117 39.916 51.977 30.757 1.00 0.10 A +ATOM 1478 CG ASP A 117 40.290 53.445 30.606 1.00 0.11 A +ATOM 1479 OD1 ASP A 117 41.131 53.929 31.350 1.00 0.11 A +ATOM 1480 OD2 ASP A 117 39.689 54.066 29.741 1.00 0.11 A +ATOM 1481 H ASP A 117 42.211 51.061 29.949 1.00 0.09 A +ATOM 1482 HA ASP A 117 41.144 51.734 32.523 1.00 0.09 A +ATOM 1483 1HB ASP A 117 39.898 51.529 29.789 1.00 0.09 A +ATOM 1484 2HB ASP A 117 38.928 51.909 31.193 1.00 0.09 A +ATOM 1485 N THR A 118 39.840 49.898 33.418 1.00 0.08 A +ATOM 1486 CA THR A 118 39.283 48.667 34.016 1.00 0.07 A +ATOM 1487 C THR A 118 37.904 48.393 33.499 1.00 0.07 A +ATOM 1488 O THR A 118 37.035 49.247 33.442 1.00 0.08 A +ATOM 1489 CB THR A 118 39.280 48.644 35.577 1.00 0.08 A +ATOM 1490 OG1 THR A 118 40.573 48.983 36.052 1.00 0.08 A +ATOM 1491 CG2 THR A 118 38.881 47.270 36.127 1.00 0.07 A +ATOM 1492 H THR A 118 39.877 50.726 33.941 1.00 0.09 A +ATOM 1493 HA THR A 118 39.869 47.830 33.668 1.00 0.07 A +ATOM 1494 HB THR A 118 38.571 49.377 35.935 1.00 0.08 A +ATOM 1495 HG1 THR A 118 40.475 49.380 36.920 1.00 0.08 A +ATOM 1496 1HG2 THR A 118 37.833 47.093 35.933 1.00 0.07 A +ATOM 1497 2HG2 THR A 118 39.052 47.253 37.196 1.00 0.07 A +ATOM 1498 3HG2 THR A 118 39.472 46.501 35.658 1.00 0.06 A +ATOM 1499 N VAL A 119 37.729 47.154 33.115 1.00 0.06 A +ATOM 1500 CA VAL A 119 36.503 46.699 32.601 1.00 0.07 A +ATOM 1501 C VAL A 119 35.812 45.846 33.639 1.00 0.06 A +ATOM 1502 O VAL A 119 34.637 46.013 33.916 1.00 0.07 A +ATOM 1503 CB VAL A 119 36.746 45.897 31.302 1.00 0.06 A +ATOM 1504 CG1 VAL A 119 35.407 45.478 30.686 1.00 0.07 A +ATOM 1505 CG2 VAL A 119 37.548 46.716 30.287 1.00 0.06 A +ATOM 1506 H VAL A 119 38.477 46.527 33.195 1.00 0.06 A +ATOM 1507 HA VAL A 119 35.866 47.546 32.386 1.00 0.07 A +ATOM 1508 HB VAL A 119 37.307 45.005 31.548 1.00 0.06 A +ATOM 1509 1HG1 VAL A 119 34.789 46.348 30.529 1.00 0.07 A +ATOM 1510 2HG1 VAL A 119 34.903 44.794 31.352 1.00 0.07 A +ATOM 1511 3HG1 VAL A 119 35.584 44.987 29.739 1.00 0.07 A +ATOM 1512 1HG2 VAL A 119 37.742 46.108 29.413 1.00 0.06 A +ATOM 1513 2HG2 VAL A 119 38.486 47.017 30.726 1.00 0.06 A +ATOM 1514 3HG2 VAL A 119 36.987 47.590 29.997 1.00 0.07 A +ATOM 1515 N ILE A 120 36.539 44.928 34.199 1.00 0.06 A +ATOM 1516 CA ILE A 120 35.997 44.014 35.157 1.00 0.06 A +ATOM 1517 C ILE A 120 36.964 43.577 36.189 1.00 0.06 A +ATOM 1518 O ILE A 120 38.118 43.318 35.893 1.00 0.06 A +ATOM 1519 CB ILE A 120 35.564 42.765 34.443 1.00 0.06 A +ATOM 1520 CG1 ILE A 120 34.228 42.991 33.688 1.00 0.07 A +ATOM 1521 CG2 ILE A 120 35.419 41.584 35.433 1.00 0.07 A +ATOM 1522 CD1 ILE A 120 34.138 42.129 32.422 1.00 0.07 A +ATOM 1523 H ILE A 120 37.483 44.857 33.945 1.00 0.06 A +ATOM 1524 HA ILE A 120 35.147 44.465 35.649 1.00 0.07 A +ATOM 1525 HB ILE A 120 36.328 42.511 33.727 1.00 0.06 A +ATOM 1526 1HG1 ILE A 120 33.409 42.739 34.331 1.00 0.07 A +ATOM 1527 2HG1 ILE A 120 34.139 44.009 33.400 1.00 0.07 A +ATOM 1528 1HG2 ILE A 120 34.970 41.937 36.350 1.00 0.07 A +ATOM 1529 2HG2 ILE A 120 36.399 41.172 35.646 1.00 0.06 A +ATOM 1530 3HG2 ILE A 120 34.801 40.818 35.000 1.00 0.07 A +ATOM 1531 1HD1 ILE A 120 33.226 42.375 31.894 1.00 0.07 A +ATOM 1532 2HD1 ILE A 120 34.126 41.086 32.691 1.00 0.07 A +ATOM 1533 3HD1 ILE A 120 34.984 42.331 31.781 1.00 0.06 A +ATOM 1534 N GLU A 121 36.480 43.404 37.412 1.00 0.07 A +ATOM 1535 CA GLU A 121 37.392 42.893 38.402 1.00 0.07 A +ATOM 1536 C GLU A 121 36.933 41.529 38.763 1.00 0.07 A +ATOM 1537 O GLU A 121 35.761 41.230 38.715 1.00 0.08 A +ATOM 1538 CB GLU A 121 37.539 43.810 39.621 1.00 0.08 A +ATOM 1539 CG GLU A 121 37.782 45.230 39.136 1.00 0.08 A +ATOM 1540 CD GLU A 121 37.721 46.193 40.316 1.00 0.08 A +ATOM 1541 OE1 GLU A 121 37.022 45.874 41.268 1.00 0.09 A +ATOM 1542 OE2 GLU A 121 38.371 47.225 40.255 1.00 0.09 A +ATOM 1543 H GLU A 121 35.546 43.613 37.626 1.00 0.07 A +ATOM 1544 HA GLU A 121 38.362 42.770 37.944 1.00 0.07 A +ATOM 1545 1HB GLU A 121 36.638 43.773 40.214 1.00 0.08 A +ATOM 1546 2HB GLU A 121 38.380 43.487 40.217 1.00 0.08 A +ATOM 1547 1HG GLU A 121 38.747 45.294 38.658 1.00 0.07 A +ATOM 1548 2HG GLU A 121 37.023 45.479 38.432 1.00 0.07 A +ATOM 1549 N PHE A 122 37.864 40.682 39.079 1.00 0.08 A +ATOM 1550 CA PHE A 122 37.530 39.336 39.427 1.00 0.08 A +ATOM 1551 C PHE A 122 38.257 38.884 40.709 1.00 0.09 A +ATOM 1552 O PHE A 122 39.232 39.469 41.138 1.00 0.09 A +ATOM 1553 CB PHE A 122 37.927 38.408 38.240 1.00 0.08 A +ATOM 1554 CG PHE A 122 39.362 38.595 37.783 1.00 0.07 A +ATOM 1555 CD1 PHE A 122 40.398 37.866 38.379 1.00 0.08 A +ATOM 1556 CD2 PHE A 122 39.645 39.440 36.703 1.00 0.07 A +ATOM 1557 CE1 PHE A 122 41.710 37.983 37.898 1.00 0.08 A +ATOM 1558 CE2 PHE A 122 40.956 39.562 36.229 1.00 0.06 A +ATOM 1559 CZ PHE A 122 41.988 38.832 36.823 1.00 0.07 A +ATOM 1560 H PHE A 122 38.801 40.967 39.071 1.00 0.08 A +ATOM 1561 HA PHE A 122 36.468 39.258 39.611 1.00 0.09 A +ATOM 1562 1HB PHE A 122 37.799 37.386 38.546 1.00 0.09 A +ATOM 1563 2HB PHE A 122 37.270 38.608 37.412 1.00 0.08 A +ATOM 1564 HD1 PHE A 122 40.188 37.217 39.213 1.00 0.09 A +ATOM 1565 HD2 PHE A 122 38.853 40.011 36.247 1.00 0.06 A +ATOM 1566 HE1 PHE A 122 42.507 37.412 38.352 1.00 0.08 A +ATOM 1567 HE2 PHE A 122 41.167 40.200 35.392 1.00 0.06 A +ATOM 1568 HZ PHE A 122 43.000 38.926 36.452 1.00 0.07 A +ATOM 1569 N ASP A 123 37.753 37.805 41.274 1.00 0.10 A +ATOM 1570 CA ASP A 123 38.306 37.148 42.458 1.00 0.11 A +ATOM 1571 C ASP A 123 39.124 35.922 42.037 1.00 0.11 A +ATOM 1572 O ASP A 123 38.567 34.873 41.780 1.00 0.12 A +ATOM 1573 CB ASP A 123 37.167 36.627 43.320 1.00 0.12 A +ATOM 1574 CG ASP A 123 37.636 36.259 44.727 1.00 0.13 A +ATOM 1575 OD1 ASP A 123 38.572 35.494 44.837 1.00 0.13 A +ATOM 1576 OD2 ASP A 123 37.024 36.726 45.676 1.00 0.13 A +ATOM 1577 H ASP A 123 36.968 37.393 40.858 1.00 0.10 A +ATOM 1578 HA ASP A 123 38.894 37.856 43.024 1.00 0.11 A +ATOM 1579 1HB ASP A 123 36.414 37.397 43.394 1.00 0.11 A +ATOM 1580 2HB ASP A 123 36.725 35.769 42.846 1.00 0.12 A +ATOM 1581 N LEU A 124 40.408 36.025 41.937 1.00 0.11 A +ATOM 1582 CA LEU A 124 41.177 34.891 41.456 1.00 0.11 A +ATOM 1583 C LEU A 124 41.061 33.622 42.262 1.00 0.12 A +ATOM 1584 O LEU A 124 40.787 32.556 41.727 1.00 0.13 A +ATOM 1585 CB LEU A 124 42.671 35.275 41.319 1.00 0.11 A +ATOM 1586 CG LEU A 124 43.506 34.374 40.342 1.00 0.11 A +ATOM 1587 CD1 LEU A 124 42.709 33.855 39.142 1.00 0.11 A +ATOM 1588 CD2 LEU A 124 44.698 35.182 39.800 1.00 0.11 A +ATOM 1589 H LEU A 124 40.855 36.872 42.140 1.00 0.11 A +ATOM 1590 HA LEU A 124 40.798 34.586 40.491 1.00 0.11 A +ATOM 1591 1HB LEU A 124 42.724 36.293 40.971 1.00 0.11 A +ATOM 1592 2HB LEU A 124 43.148 35.227 42.271 1.00 0.12 A +ATOM 1593 HG LEU A 124 43.893 33.530 40.893 1.00 0.12 A +ATOM 1594 1HD1 LEU A 124 42.184 34.670 38.673 1.00 0.10 A +ATOM 1595 2HD1 LEU A 124 42.008 33.110 39.467 1.00 0.11 A +ATOM 1596 3HD1 LEU A 124 43.389 33.411 38.430 1.00 0.11 A +ATOM 1597 1HD2 LEU A 124 44.335 35.994 39.186 1.00 0.10 A +ATOM 1598 2HD2 LEU A 124 45.327 34.536 39.204 1.00 0.11 A +ATOM 1599 3HD2 LEU A 124 45.272 35.581 40.622 1.00 0.11 A +ATOM 1600 N PRO A 125 41.317 33.692 43.480 1.00 0.13 A +ATOM 1601 CA PRO A 125 41.324 32.514 44.319 1.00 0.14 A +ATOM 1602 C PRO A 125 39.962 31.809 44.233 1.00 0.15 A +ATOM 1603 O PRO A 125 39.886 30.604 44.076 1.00 0.15 A +ATOM 1604 CB PRO A 125 41.611 33.060 45.712 1.00 0.15 A +ATOM 1605 CG PRO A 125 42.125 34.455 45.560 1.00 0.14 A +ATOM 1606 CD PRO A 125 41.571 34.943 44.249 1.00 0.13 A +ATOM 1607 HA PRO A 125 42.097 31.826 44.010 1.00 0.15 A +ATOM 1608 1HB PRO A 125 40.703 33.064 46.305 1.00 0.15 A +ATOM 1609 2HB PRO A 125 42.358 32.448 46.203 1.00 0.16 A +ATOM 1610 1HG PRO A 125 41.773 35.081 46.374 1.00 0.14 A +ATOM 1611 2HG PRO A 125 43.206 34.463 45.527 1.00 0.14 A +ATOM 1612 1HD PRO A 125 40.659 35.485 44.405 1.00 0.13 A +ATOM 1613 2HD PRO A 125 42.273 35.568 43.768 1.00 0.13 A +ATOM 1614 N LEU A 126 38.891 32.568 44.304 1.00 0.14 A +ATOM 1615 CA LEU A 126 37.557 31.995 44.183 1.00 0.14 A +ATOM 1616 C LEU A 126 37.449 31.246 42.841 1.00 0.14 A +ATOM 1617 O LEU A 126 37.058 30.091 42.795 1.00 0.15 A +ATOM 1618 CB LEU A 126 36.423 33.047 44.393 1.00 0.14 A +ATOM 1619 CG LEU A 126 35.045 32.742 43.758 1.00 0.14 A +ATOM 1620 CD1 LEU A 126 34.663 31.304 43.892 1.00 0.15 A +ATOM 1621 CD2 LEU A 126 33.954 33.569 44.457 1.00 0.14 A +ATOM 1622 H LEU A 126 38.991 33.536 44.426 1.00 0.14 A +ATOM 1623 HA LEU A 126 37.448 31.218 44.925 1.00 0.15 A +ATOM 1624 1HB LEU A 126 36.280 33.173 45.454 1.00 0.15 A +ATOM 1625 2HB LEU A 126 36.775 33.970 43.998 1.00 0.13 A +ATOM 1626 HG LEU A 126 35.066 33.005 42.714 1.00 0.13 A +ATOM 1627 1HD1 LEU A 126 33.596 31.199 43.721 1.00 0.15 A +ATOM 1628 2HD1 LEU A 126 34.912 30.933 44.874 1.00 0.16 A +ATOM 1629 3HD1 LEU A 126 35.179 30.758 43.155 1.00 0.15 A +ATOM 1630 1HD2 LEU A 126 33.094 33.638 43.807 1.00 0.14 A +ATOM 1631 2HD2 LEU A 126 34.327 34.553 44.674 1.00 0.14 A +ATOM 1632 3HD2 LEU A 126 33.664 33.080 45.381 1.00 0.15 A +ATOM 1633 N LEU A 127 37.800 31.870 41.779 1.00 0.13 A +ATOM 1634 CA LEU A 127 37.708 31.261 40.455 1.00 0.13 A +ATOM 1635 C LEU A 127 38.689 30.140 40.281 1.00 0.14 A +ATOM 1636 O LEU A 127 38.451 29.195 39.551 1.00 0.14 A +ATOM 1637 CB LEU A 127 38.013 32.319 39.392 1.00 0.12 A +ATOM 1638 CG LEU A 127 37.016 33.458 39.454 1.00 0.11 A +ATOM 1639 CD1 LEU A 127 37.561 34.632 38.642 1.00 0.10 A +ATOM 1640 CD2 LEU A 127 35.699 32.990 38.839 1.00 0.12 A +ATOM 1641 H LEU A 127 38.140 32.784 41.860 1.00 0.13 A +ATOM 1642 HA LEU A 127 36.711 30.873 40.303 1.00 0.13 A +ATOM 1643 1HB LEU A 127 39.009 32.705 39.561 1.00 0.12 A +ATOM 1644 2HB LEU A 127 37.980 31.859 38.415 1.00 0.12 A +ATOM 1645 HG LEU A 127 36.868 33.760 40.482 1.00 0.12 A +ATOM 1646 1HD1 LEU A 127 37.930 34.272 37.694 1.00 0.10 A +ATOM 1647 2HD1 LEU A 127 38.367 35.105 39.186 1.00 0.10 A +ATOM 1648 3HD1 LEU A 127 36.770 35.343 38.473 1.00 0.10 A +ATOM 1649 1HD2 LEU A 127 35.043 33.832 38.705 1.00 0.11 A +ATOM 1650 2HD2 LEU A 127 35.234 32.275 39.491 1.00 0.13 A +ATOM 1651 3HD2 LEU A 127 35.893 32.531 37.879 1.00 0.12 A +ATOM 1652 N GLU A 128 39.796 30.230 40.913 1.00 0.14 A +ATOM 1653 CA GLU A 128 40.757 29.171 40.770 1.00 0.14 A +ATOM 1654 C GLU A 128 40.135 27.936 41.376 1.00 0.16 A +ATOM 1655 O GLU A 128 40.266 26.837 40.872 1.00 0.16 A +ATOM 1656 CB GLU A 128 42.055 29.531 41.454 1.00 0.14 A +ATOM 1657 CG GLU A 128 43.001 30.188 40.444 1.00 0.14 A +ATOM 1658 CD GLU A 128 44.366 30.420 41.068 1.00 0.14 A +ATOM 1659 OE1 GLU A 128 44.452 30.421 42.286 1.00 0.15 A +ATOM 1660 OE2 GLU A 128 45.311 30.582 40.306 1.00 0.14 A +ATOM 1661 H GLU A 128 39.982 31.005 41.485 1.00 0.14 A +ATOM 1662 HA GLU A 128 40.944 29.001 39.721 1.00 0.14 A +ATOM 1663 1HB GLU A 128 41.856 30.220 42.262 1.00 0.14 A +ATOM 1664 2HB GLU A 128 42.525 28.640 41.849 1.00 0.15 A +ATOM 1665 1HG GLU A 128 43.119 29.545 39.585 1.00 0.14 A +ATOM 1666 2HG GLU A 128 42.589 31.122 40.134 1.00 0.13 A +ATOM 1667 N GLU A 129 39.423 28.142 42.446 1.00 0.16 A +ATOM 1668 CA GLU A 129 38.732 27.050 43.099 1.00 0.17 A +ATOM 1669 C GLU A 129 37.481 26.600 42.359 1.00 0.17 A +ATOM 1670 O GLU A 129 37.204 25.416 42.284 1.00 0.18 A +ATOM 1671 CB GLU A 129 38.267 27.444 44.497 1.00 0.17 A +ATOM 1672 CG GLU A 129 37.519 26.265 45.158 1.00 0.19 A +ATOM 1673 CD GLU A 129 37.663 26.311 46.681 1.00 0.19 A +ATOM 1674 OE1 GLU A 129 38.697 25.888 47.180 1.00 0.20 A +ATOM 1675 OE2 GLU A 129 36.720 26.756 47.321 1.00 0.19 A +ATOM 1676 H GLU A 129 39.337 29.051 42.805 1.00 0.16 A +ATOM 1677 HA GLU A 129 39.401 26.205 43.176 1.00 0.18 A +ATOM 1678 1HB GLU A 129 39.128 27.712 45.093 1.00 0.18 A +ATOM 1679 2HB GLU A 129 37.603 28.294 44.426 1.00 0.17 A +ATOM 1680 1HG GLU A 129 36.471 26.329 44.910 1.00 0.19 A +ATOM 1681 2HG GLU A 129 37.916 25.329 44.791 1.00 0.19 A +ATOM 1682 N LYS A 130 36.688 27.514 41.863 1.00 0.16 A +ATOM 1683 CA LYS A 130 35.447 27.115 41.235 1.00 0.17 A +ATOM 1684 C LYS A 130 35.480 26.941 39.729 1.00 0.16 A +ATOM 1685 O LYS A 130 34.707 26.168 39.194 1.00 0.17 A +ATOM 1686 CB LYS A 130 34.311 28.041 41.596 1.00 0.16 A +ATOM 1687 CG LYS A 130 34.255 28.297 43.102 1.00 0.17 A +ATOM 1688 CD LYS A 130 32.902 27.866 43.741 1.00 0.18 A +ATOM 1689 CE LYS A 130 33.114 26.771 44.808 1.00 0.19 A +ATOM 1690 NZ LYS A 130 32.239 25.609 44.524 1.00 0.20 A +ATOM 1691 H LYS A 130 36.927 28.461 41.934 1.00 0.16 A +ATOM 1692 HA LYS A 130 35.199 26.114 41.557 1.00 0.18 A +ATOM 1693 1HB LYS A 130 34.446 28.976 41.062 1.00 0.16 A +ATOM 1694 2HB LYS A 130 33.395 27.587 41.260 1.00 0.17 A +ATOM 1695 1HG LYS A 130 35.082 27.828 43.594 1.00 0.17 A +ATOM 1696 2HG LYS A 130 34.354 29.301 43.234 1.00 0.16 A +ATOM 1697 1HD LYS A 130 32.443 28.733 44.211 1.00 0.17 A +ATOM 1698 2HD LYS A 130 32.228 27.498 42.987 1.00 0.18 A +ATOM 1699 1HE LYS A 130 34.135 26.432 44.809 1.00 0.19 A +ATOM 1700 2HE LYS A 130 32.873 27.168 45.780 1.00 0.19 A +ATOM 1701 1HZ LYS A 130 31.244 25.903 44.564 1.00 0.20 A +ATOM 1702 2HZ LYS A 130 32.416 24.873 45.237 1.00 0.20 A +ATOM 1703 3HZ LYS A 130 32.453 25.235 43.577 1.00 0.20 A +ATOM 1704 N ALA A 131 36.285 27.625 39.039 1.00 0.15 A +ATOM 1705 CA ALA A 131 36.276 27.522 37.604 1.00 0.15 A +ATOM 1706 C ALA A 131 36.974 26.294 37.033 1.00 0.16 A +ATOM 1707 O ALA A 131 37.992 25.851 37.521 1.00 0.16 A +ATOM 1708 CB ALA A 131 36.850 28.805 37.039 1.00 0.14 A +ATOM 1709 H ALA A 131 36.895 28.253 39.481 1.00 0.15 A +ATOM 1710 HA ALA A 131 35.265 27.386 37.251 1.00 0.15 A +ATOM 1711 1HB ALA A 131 36.697 28.828 35.970 1.00 0.13 A +ATOM 1712 2HB ALA A 131 37.907 28.850 37.253 1.00 0.14 A +ATOM 1713 3HB ALA A 131 36.354 29.651 37.491 1.00 0.13 A +ATOM 1714 N LYS A 132 36.390 25.746 35.944 1.00 0.16 A +ATOM 1715 CA LYS A 132 36.988 24.567 35.292 1.00 0.17 A +ATOM 1716 C LYS A 132 38.448 24.904 34.918 1.00 0.16 A +ATOM 1717 O LYS A 132 39.345 24.091 35.030 1.00 0.16 A +ATOM 1718 CB LYS A 132 36.184 24.095 34.078 1.00 0.17 A +ATOM 1719 CG LYS A 132 36.069 22.541 33.942 1.00 0.18 A +ATOM 1720 CD LYS A 132 36.634 21.736 35.167 1.00 0.19 A +ATOM 1721 CE LYS A 132 37.474 20.526 34.743 1.00 0.19 A +ATOM 1722 NZ LYS A 132 38.781 20.535 35.478 1.00 0.19 A +ATOM 1723 H LYS A 132 35.572 26.137 35.569 1.00 0.16 A +ATOM 1724 HA LYS A 132 37.037 23.763 36.009 1.00 0.17 A +ATOM 1725 1HB LYS A 132 35.190 24.513 34.151 1.00 0.17 A +ATOM 1726 2HB LYS A 132 36.648 24.490 33.181 1.00 0.16 A +ATOM 1727 1HG LYS A 132 35.020 22.291 33.828 1.00 0.19 A +ATOM 1728 2HG LYS A 132 36.581 22.246 33.042 1.00 0.18 A +ATOM 1729 1HD LYS A 132 37.267 22.343 35.757 1.00 0.18 A +ATOM 1730 2HD LYS A 132 35.808 21.405 35.778 1.00 0.19 A +ATOM 1731 1HE LYS A 132 36.942 19.625 34.982 1.00 0.20 A +ATOM 1732 2HE LYS A 132 37.674 20.557 33.689 1.00 0.19 A +ATOM 1733 1HZ LYS A 132 39.407 19.816 35.066 1.00 0.20 A +ATOM 1734 2HZ LYS A 132 38.619 20.319 36.484 1.00 0.20 A +ATOM 1735 3HZ LYS A 132 39.230 21.470 35.394 1.00 0.18 A +ATOM 1736 N SER A 133 38.647 26.115 34.502 1.00 0.15 A +ATOM 1737 CA SER A 133 39.931 26.663 34.132 1.00 0.14 A +ATOM 1738 C SER A 133 39.870 28.195 34.077 1.00 0.13 A +ATOM 1739 O SER A 133 38.878 28.786 33.696 1.00 0.12 A +ATOM 1740 CB SER A 133 40.509 26.060 32.859 1.00 0.14 A +ATOM 1741 OG SER A 133 41.475 26.946 32.315 1.00 0.13 A +ATOM 1742 H SER A 133 37.871 26.707 34.436 1.00 0.14 A +ATOM 1743 HA SER A 133 40.624 26.484 34.941 1.00 0.14 A +ATOM 1744 1HB SER A 133 40.984 25.119 33.087 1.00 0.15 A +ATOM 1745 2HB SER A 133 39.720 25.893 32.149 1.00 0.14 A +ATOM 1746 HG SER A 133 41.725 26.614 31.450 1.00 0.13 A +ATOM 1747 N THR A 134 40.979 28.815 34.491 1.00 0.12 A +ATOM 1748 CA THR A 134 41.150 30.260 34.516 1.00 0.11 A +ATOM 1749 C THR A 134 41.865 30.736 33.256 1.00 0.10 A +ATOM 1750 O THR A 134 42.072 31.925 33.054 1.00 0.09 A +ATOM 1751 CB THR A 134 41.874 30.775 35.794 1.00 0.11 A +ATOM 1752 OG1 THR A 134 43.184 30.245 35.892 1.00 0.11 A +ATOM 1753 CG2 THR A 134 41.063 30.398 37.029 1.00 0.12 A +ATOM 1754 H THR A 134 41.737 28.267 34.779 1.00 0.13 A +ATOM 1755 HA THR A 134 40.174 30.721 34.467 1.00 0.11 A +ATOM 1756 HB THR A 134 41.926 31.838 35.746 1.00 0.10 A +ATOM 1757 HG1 THR A 134 43.686 30.814 36.488 1.00 0.11 A +ATOM 1758 1HG2 THR A 134 40.051 30.762 36.916 1.00 0.12 A +ATOM 1759 2HG2 THR A 134 41.509 30.853 37.902 1.00 0.12 A +ATOM 1760 3HG2 THR A 134 41.051 29.327 37.145 1.00 0.13 A +ATOM 1761 N LEU A 135 42.206 29.818 32.401 1.00 0.11 A +ATOM 1762 CA LEU A 135 42.851 30.172 31.114 1.00 0.10 A +ATOM 1763 C LEU A 135 41.913 31.153 30.389 1.00 0.09 A +ATOM 1764 O LEU A 135 40.726 30.939 30.301 1.00 0.10 A +ATOM 1765 CB LEU A 135 43.095 28.940 30.251 1.00 0.11 A +ATOM 1766 CG LEU A 135 44.416 28.300 30.651 1.00 0.11 A +ATOM 1767 CD1 LEU A 135 44.591 26.988 29.885 1.00 0.12 A +ATOM 1768 CD2 LEU A 135 45.557 29.279 30.307 1.00 0.10 A +ATOM 1769 H LEU A 135 42.028 28.877 32.613 1.00 0.11 A +ATOM 1770 HA LEU A 135 43.797 30.651 31.317 1.00 0.09 A +ATOM 1771 1HB LEU A 135 42.291 28.233 30.401 1.00 0.11 A +ATOM 1772 2HB LEU A 135 43.131 29.221 29.208 1.00 0.10 A +ATOM 1773 HG LEU A 135 44.409 28.100 31.714 1.00 0.12 A +ATOM 1774 1HD1 LEU A 135 43.843 26.280 30.210 1.00 0.13 A +ATOM 1775 2HD1 LEU A 135 45.574 26.590 30.079 1.00 0.12 A +ATOM 1776 3HD1 LEU A 135 44.477 27.175 28.828 1.00 0.12 A +ATOM 1777 1HD2 LEU A 135 45.250 29.938 29.503 1.00 0.10 A +ATOM 1778 2HD2 LEU A 135 46.433 28.738 30.008 1.00 0.11 A +ATOM 1779 3HD2 LEU A 135 45.791 29.873 31.175 1.00 0.10 A +ATOM 1780 N THR A 136 42.473 32.242 29.937 1.00 0.08 A +ATOM 1781 CA THR A 136 41.782 33.346 29.344 1.00 0.07 A +ATOM 1782 C THR A 136 42.107 33.703 27.925 1.00 0.07 A +ATOM 1783 O THR A 136 43.071 34.393 27.654 1.00 0.06 A +ATOM 1784 CB THR A 136 41.979 34.564 30.264 1.00 0.07 A +ATOM 1785 OG1 THR A 136 41.442 34.245 31.535 1.00 0.07 A +ATOM 1786 CG2 THR A 136 41.284 35.808 29.710 1.00 0.06 A +ATOM 1787 H THR A 136 43.440 32.338 30.048 1.00 0.08 A +ATOM 1788 HA THR A 136 40.731 33.119 29.255 1.00 0.08 A +ATOM 1789 HB THR A 136 43.036 34.767 30.368 1.00 0.06 A +ATOM 1790 HG1 THR A 136 41.946 33.506 31.887 1.00 0.08 A +ATOM 1791 1HG2 THR A 136 41.915 36.273 28.969 1.00 0.05 A +ATOM 1792 2HG2 THR A 136 41.107 36.503 30.513 1.00 0.05 A +ATOM 1793 3HG2 THR A 136 40.343 35.532 29.264 1.00 0.06 A +ATOM 1794 N PRO A 137 41.300 33.226 26.972 1.00 0.08 A +ATOM 1795 CA PRO A 137 41.627 33.557 25.602 1.00 0.07 A +ATOM 1796 C PRO A 137 41.482 35.037 25.259 1.00 0.07 A +ATOM 1797 O PRO A 137 40.543 35.699 25.661 1.00 0.06 A +ATOM 1798 CB PRO A 137 40.575 32.831 24.752 1.00 0.08 A +ATOM 1799 CG PRO A 137 39.806 31.908 25.652 1.00 0.09 A +ATOM 1800 CD PRO A 137 40.193 32.244 27.090 1.00 0.09 A +ATOM 1801 HA PRO A 137 42.621 33.210 25.355 1.00 0.07 A +ATOM 1802 1HB PRO A 137 39.894 33.542 24.291 1.00 0.08 A +ATOM 1803 2HB PRO A 137 41.066 32.259 23.974 1.00 0.09 A +ATOM 1804 1HG PRO A 137 38.738 32.056 25.514 1.00 0.10 A +ATOM 1805 2HG PRO A 137 40.053 30.875 25.434 1.00 0.10 A +ATOM 1806 1HD PRO A 137 39.359 32.640 27.615 1.00 0.09 A +ATOM 1807 2HD PRO A 137 40.562 31.352 27.586 1.00 0.09 A +ATOM 1808 N VAL A 138 42.378 35.502 24.445 1.00 0.06 A +ATOM 1809 CA VAL A 138 42.320 36.835 23.901 1.00 0.06 A +ATOM 1810 C VAL A 138 42.399 36.658 22.428 1.00 0.06 A +ATOM 1811 O VAL A 138 43.421 36.318 21.880 1.00 0.06 A +ATOM 1812 CB VAL A 138 43.214 37.878 24.539 1.00 0.05 A +ATOM 1813 CG1 VAL A 138 43.769 37.357 25.865 1.00 0.04 A +ATOM 1814 CG2 VAL A 138 44.313 38.336 23.583 1.00 0.05 A +ATOM 1815 H VAL A 138 43.114 34.918 24.169 1.00 0.06 A +ATOM 1816 HA VAL A 138 41.301 37.179 23.991 1.00 0.06 A +ATOM 1817 HB VAL A 138 42.608 38.752 24.768 1.00 0.05 A +ATOM 1818 1HG1 VAL A 138 42.970 37.330 26.595 1.00 0.04 A +ATOM 1819 2HG1 VAL A 138 44.550 38.012 26.217 1.00 0.04 A +ATOM 1820 3HG1 VAL A 138 44.152 36.366 25.737 1.00 0.05 A +ATOM 1821 1HG2 VAL A 138 43.854 38.782 22.708 1.00 0.05 A +ATOM 1822 2HG2 VAL A 138 44.905 37.499 23.286 1.00 0.05 A +ATOM 1823 3HG2 VAL A 138 44.930 39.074 24.070 1.00 0.04 A +ATOM 1824 N VAL A 139 41.243 36.821 21.765 1.00 0.07 A +ATOM 1825 CA VAL A 139 41.244 36.590 20.358 1.00 0.08 A +ATOM 1826 C VAL A 139 40.768 37.743 19.486 1.00 0.08 A +ATOM 1827 O VAL A 139 40.067 38.649 19.901 1.00 0.08 A +ATOM 1828 CB VAL A 139 40.539 35.280 19.995 1.00 0.09 A +ATOM 1829 CG1 VAL A 139 41.143 34.120 20.758 1.00 0.09 A +ATOM 1830 CG2 VAL A 139 39.051 35.382 20.312 1.00 0.10 A +ATOM 1831 H VAL A 139 40.422 37.066 22.240 1.00 0.07 A +ATOM 1832 HA VAL A 139 42.266 36.545 20.012 1.00 0.08 A +ATOM 1833 HB VAL A 139 40.659 35.103 18.935 1.00 0.10 A +ATOM 1834 1HG1 VAL A 139 40.849 33.202 20.276 1.00 0.10 A +ATOM 1835 2HG1 VAL A 139 40.788 34.128 21.780 1.00 0.09 A +ATOM 1836 3HG1 VAL A 139 42.218 34.207 20.748 1.00 0.08 A +ATOM 1837 1HG2 VAL A 139 38.584 36.071 19.625 1.00 0.10 A +ATOM 1838 2HG2 VAL A 139 38.920 35.734 21.323 1.00 0.09 A +ATOM 1839 3HG2 VAL A 139 38.597 34.407 20.207 1.00 0.10 A +ATOM 1840 N ILE A 140 41.200 37.661 18.208 1.00 0.09 A +ATOM 1841 CA ILE A 140 40.839 38.640 17.215 1.00 0.10 A +ATOM 1842 C ILE A 140 39.691 38.029 16.485 1.00 0.11 A +ATOM 1843 O ILE A 140 39.773 36.909 16.028 1.00 0.11 A +ATOM 1844 CB ILE A 140 41.989 39.038 16.255 1.00 0.10 A +ATOM 1845 CG1 ILE A 140 42.891 40.102 16.887 1.00 0.09 A +ATOM 1846 CG2 ILE A 140 41.420 39.645 14.972 1.00 0.11 A +ATOM 1847 CD1 ILE A 140 43.617 39.570 18.119 1.00 0.08 A +ATOM 1848 H ILE A 140 41.740 36.889 17.938 1.00 0.09 A +ATOM 1849 HA ILE A 140 40.503 39.530 17.726 1.00 0.10 A +ATOM 1850 HB ILE A 140 42.576 38.164 16.014 1.00 0.10 A +ATOM 1851 1HG1 ILE A 140 43.621 40.416 16.159 1.00 0.09 A +ATOM 1852 2HG1 ILE A 140 42.291 40.943 17.157 1.00 0.09 A +ATOM 1853 1HG2 ILE A 140 40.957 38.875 14.375 1.00 0.12 A +ATOM 1854 2HG2 ILE A 140 42.214 40.113 14.405 1.00 0.11 A +ATOM 1855 3HG2 ILE A 140 40.690 40.382 15.240 1.00 0.11 A +ATOM 1856 1HD1 ILE A 140 42.914 39.416 18.916 1.00 0.08 A +ATOM 1857 2HD1 ILE A 140 44.360 40.292 18.429 1.00 0.08 A +ATOM 1858 3HD1 ILE A 140 44.101 38.637 17.881 1.00 0.08 A +ATOM 1859 N SER A 141 38.606 38.735 16.420 1.00 0.11 A +ATOM 1860 CA SER A 141 37.412 38.192 15.816 1.00 0.12 A +ATOM 1861 C SER A 141 37.215 38.653 14.333 1.00 0.13 A +ATOM 1862 O SER A 141 36.312 38.250 13.626 1.00 0.14 A +ATOM 1863 CB SER A 141 36.167 38.436 16.665 1.00 0.12 A +ATOM 1864 OG SER A 141 35.786 39.801 16.558 1.00 0.12 A +ATOM 1865 H SER A 141 38.594 39.637 16.804 1.00 0.11 A +ATOM 1866 HA SER A 141 37.542 37.128 15.687 1.00 0.13 A +ATOM 1867 1HB SER A 141 35.361 37.814 16.313 1.00 0.13 A +ATOM 1868 2HB SER A 141 36.383 38.192 17.697 1.00 0.12 A +ATOM 1869 HG SER A 141 34.903 39.834 16.182 1.00 0.12 A +ATOM 1870 N ASN A 142 38.075 39.484 13.944 1.00 0.13 A +ATOM 1871 CA ASN A 142 38.226 40.144 12.655 1.00 0.14 A +ATOM 1872 C ASN A 142 39.261 39.480 11.712 1.00 0.14 A +ATOM 1873 O ASN A 142 39.740 40.123 10.795 1.00 0.15 A +ATOM 1874 CB ASN A 142 39.006 41.423 13.072 1.00 0.13 A +ATOM 1875 CG ASN A 142 38.203 42.661 12.706 1.00 0.14 A +ATOM 1876 OD1 ASN A 142 38.670 43.768 12.863 1.00 0.14 A +ATOM 1877 ND2 ASN A 142 36.997 42.519 12.235 1.00 0.15 A +ATOM 1878 H ASN A 142 38.712 39.778 14.620 1.00 0.12 A +ATOM 1879 HA ASN A 142 37.270 40.388 12.218 1.00 0.15 A +ATOM 1880 1HB ASN A 142 39.149 41.435 14.137 1.00 0.13 A +ATOM 1881 2HB ASN A 142 39.975 41.485 12.592 1.00 0.13 A +ATOM 1882 N MET A 143 39.670 38.294 11.973 1.00 0.14 A +ATOM 1883 CA MET A 143 40.724 37.675 11.198 1.00 0.14 A +ATOM 1884 C MET A 143 40.762 38.056 9.693 1.00 0.15 A +ATOM 1885 O MET A 143 41.817 38.359 9.160 1.00 0.15 A +ATOM 1886 CB MET A 143 40.833 36.159 11.443 1.00 0.14 A +ATOM 1887 CG MET A 143 41.387 35.772 12.829 1.00 0.13 A +ATOM 1888 SD MET A 143 42.837 36.758 13.309 1.00 0.12 A +ATOM 1889 CE MET A 143 44.113 35.861 12.380 1.00 0.12 A +ATOM 1890 H MET A 143 39.276 37.802 12.724 1.00 0.13 A +ATOM 1891 HA MET A 143 41.663 38.135 11.463 1.00 0.13 A +ATOM 1892 1HB MET A 143 39.850 35.728 11.341 1.00 0.14 A +ATOM 1893 2HB MET A 143 41.473 35.736 10.681 1.00 0.14 A +ATOM 1894 1HG MET A 143 40.615 35.894 13.566 1.00 0.13 A +ATOM 1895 2HG MET A 143 41.673 34.727 12.793 1.00 0.13 A +ATOM 1896 1HE MET A 143 43.742 35.616 11.400 1.00 0.13 A +ATOM 1897 2HE MET A 143 44.377 34.956 12.897 1.00 0.12 A +ATOM 1898 3HE MET A 143 44.990 36.479 12.290 1.00 0.12 A +ATOM 1899 N ASP A 144 39.701 38.073 9.029 1.00 0.16 A +ATOM 1900 CA ASP A 144 39.682 38.433 7.618 1.00 0.17 A +ATOM 1901 C ASP A 144 40.100 39.857 7.366 1.00 0.17 A +ATOM 1902 O ASP A 144 40.334 40.192 6.221 1.00 0.17 A +ATOM 1903 CB ASP A 144 38.320 38.115 6.946 1.00 0.18 A +ATOM 1904 CG ASP A 144 38.117 36.599 6.895 1.00 0.19 A +ATOM 1905 OD1 ASP A 144 39.075 35.885 7.142 1.00 0.18 A +ATOM 1906 OD2 ASP A 144 37.008 36.179 6.609 1.00 0.24 A +ATOM 1907 H ASP A 144 38.864 37.820 9.475 1.00 0.16 A +ATOM 1908 HA ASP A 144 40.458 37.881 7.109 1.00 0.17 A +ATOM 1909 1HB ASP A 144 37.522 38.566 7.518 1.00 0.17 A +ATOM 1910 2HB ASP A 144 38.312 38.512 5.942 1.00 0.19 A +ATOM 1911 N GLU A 145 40.218 40.717 8.354 1.00 0.16 A +ATOM 1912 CA GLU A 145 40.632 42.069 8.015 1.00 0.16 A +ATOM 1913 C GLU A 145 42.035 42.322 8.408 1.00 0.16 A +ATOM 1914 O GLU A 145 42.451 43.469 8.423 1.00 0.16 A +ATOM 1915 CB GLU A 145 39.708 43.156 8.624 1.00 0.16 A +ATOM 1916 CG GLU A 145 38.232 42.752 8.480 1.00 0.17 A +ATOM 1917 CD GLU A 145 37.345 43.689 9.311 1.00 0.17 A +ATOM 1918 OE1 GLU A 145 37.840 44.728 9.730 1.00 0.17 A +ATOM 1919 OE2 GLU A 145 36.188 43.349 9.521 1.00 0.17 A +ATOM 1920 H GLU A 145 40.013 40.450 9.274 1.00 0.16 A +ATOM 1921 HA GLU A 145 40.623 42.172 6.940 1.00 0.17 A +ATOM 1922 1HB GLU A 145 39.944 43.278 9.671 1.00 0.16 A +ATOM 1923 2HB GLU A 145 39.873 44.091 8.109 1.00 0.17 A +ATOM 1924 1HG GLU A 145 37.943 42.820 7.444 1.00 0.18 A +ATOM 1925 2HG GLU A 145 38.101 41.740 8.826 1.00 0.17 A +ATOM 1926 N ILE A 146 42.798 41.309 8.750 1.00 0.15 A +ATOM 1927 CA ILE A 146 44.132 41.641 9.181 1.00 0.14 A +ATOM 1928 C ILE A 146 45.224 41.015 8.339 1.00 0.14 A +ATOM 1929 O ILE A 146 45.151 39.886 7.894 1.00 0.15 A +ATOM 1930 CB ILE A 146 44.322 41.388 10.685 1.00 0.13 A +ATOM 1931 CG1 ILE A 146 44.518 39.888 10.947 1.00 0.13 A +ATOM 1932 CG2 ILE A 146 43.131 41.888 11.516 1.00 0.13 A +ATOM 1933 CD1 ILE A 146 45.441 39.715 12.134 1.00 0.12 A +ATOM 1934 H ILE A 146 42.454 40.391 8.756 1.00 0.15 A +ATOM 1935 HA ILE A 146 44.316 42.685 8.976 1.00 0.15 A +ATOM 1936 HB ILE A 146 45.204 41.926 11.006 1.00 0.13 A +ATOM 1937 1HG1 ILE A 146 43.570 39.425 11.162 1.00 0.13 A +ATOM 1938 2HG1 ILE A 146 44.958 39.400 10.101 1.00 0.13 A +ATOM 1939 1HG2 ILE A 146 42.988 42.943 11.352 1.00 0.13 A +ATOM 1940 2HG2 ILE A 146 43.340 41.713 12.565 1.00 0.12 A +ATOM 1941 3HG2 ILE A 146 42.241 41.348 11.236 1.00 0.13 A +ATOM 1942 1HD1 ILE A 146 46.426 40.087 11.883 1.00 0.12 A +ATOM 1943 2HD1 ILE A 146 45.495 38.679 12.359 1.00 0.11 A +ATOM 1944 3HD1 ILE A 146 45.052 40.259 12.979 1.00 0.11 A +ATOM 1945 N LYS A 147 46.267 41.806 8.113 1.00 0.15 A +ATOM 1946 CA LYS A 147 47.392 41.323 7.309 1.00 0.15 A +ATOM 1947 C LYS A 147 48.220 40.338 8.121 1.00 0.14 A +ATOM 1948 O LYS A 147 48.397 39.207 7.693 1.00 0.14 A +ATOM 1949 CB LYS A 147 48.194 42.424 6.592 1.00 0.15 A +ATOM 1950 CG LYS A 147 48.813 41.956 5.239 1.00 0.16 A +ATOM 1951 CD LYS A 147 47.756 41.372 4.248 1.00 0.17 A +ATOM 1952 CE LYS A 147 48.376 41.134 2.853 1.00 0.18 A +ATOM 1953 NZ LYS A 147 47.694 39.996 2.150 1.00 0.18 A +ATOM 1954 H LYS A 147 46.288 42.715 8.482 1.00 0.14 A +ATOM 1955 HA LYS A 147 47.005 40.648 6.559 1.00 0.15 A +ATOM 1956 1HB LYS A 147 47.569 43.226 6.397 1.00 0.16 A +ATOM 1957 2HB LYS A 147 48.994 42.748 7.240 1.00 0.15 A +ATOM 1958 1HG LYS A 147 49.272 42.816 4.770 1.00 0.17 A +ATOM 1959 2HG LYS A 147 49.571 41.218 5.432 1.00 0.16 A +ATOM 1960 1HD LYS A 147 47.398 40.430 4.614 1.00 0.16 A +ATOM 1961 2HD LYS A 147 46.932 42.063 4.158 1.00 0.17 A +ATOM 1962 1HE LYS A 147 48.270 42.025 2.257 1.00 0.18 A +ATOM 1963 2HE LYS A 147 49.423 40.899 2.962 1.00 0.17 A +ATOM 1964 1HZ LYS A 147 46.689 39.964 2.413 1.00 0.18 A +ATOM 1965 2HZ LYS A 147 48.150 39.098 2.413 1.00 0.18 A +ATOM 1966 3HZ LYS A 147 47.774 40.131 1.120 1.00 0.19 A +ATOM 1967 N GLU A 148 48.692 40.671 9.274 1.00 0.13 A +ATOM 1968 CA GLU A 148 49.415 39.676 10.028 1.00 0.12 A +ATOM 1969 C GLU A 148 49.258 39.805 11.526 1.00 0.11 A +ATOM 1970 O GLU A 148 49.166 40.857 12.099 1.00 0.11 A +ATOM 1971 CB GLU A 148 50.905 39.513 9.649 1.00 0.12 A +ATOM 1972 CG GLU A 148 51.255 38.040 9.229 1.00 0.12 A +ATOM 1973 CD GLU A 148 51.972 37.967 7.866 1.00 0.13 A +ATOM 1974 OE1 GLU A 148 52.606 38.936 7.475 1.00 0.14 A +ATOM 1975 OE2 GLU A 148 51.868 36.915 7.238 1.00 0.14 A +ATOM 1976 H GLU A 148 48.552 41.575 9.624 1.00 0.13 A +ATOM 1977 HA GLU A 148 48.927 38.725 9.878 1.00 0.12 A +ATOM 1978 1HB GLU A 148 51.124 40.180 8.827 1.00 0.13 A +ATOM 1979 2HB GLU A 148 51.526 39.795 10.492 1.00 0.12 A +ATOM 1980 1HG GLU A 148 51.899 37.603 9.974 1.00 0.12 A +ATOM 1981 2HG GLU A 148 50.359 37.446 9.162 1.00 0.13 A +ATOM 1982 N LEU A 149 49.258 38.620 12.107 1.00 0.11 A +ATOM 1983 CA LEU A 149 49.183 38.379 13.500 1.00 0.10 A +ATOM 1984 C LEU A 149 50.482 37.710 13.986 1.00 0.09 A +ATOM 1985 O LEU A 149 50.785 36.571 13.679 1.00 0.10 A +ATOM 1986 CB LEU A 149 47.959 37.504 13.799 1.00 0.10 A +ATOM 1987 CG LEU A 149 47.313 37.817 15.166 1.00 0.09 A +ATOM 1988 CD1 LEU A 149 45.790 37.715 15.048 1.00 0.09 A +ATOM 1989 CD2 LEU A 149 47.794 36.801 16.198 1.00 0.08 A +ATOM 1990 H LEU A 149 49.339 37.839 11.521 1.00 0.11 A +ATOM 1991 HA LEU A 149 49.091 39.319 14.024 1.00 0.10 A +ATOM 1992 1HB LEU A 149 47.245 37.656 13.017 1.00 0.10 A +ATOM 1993 2HB LEU A 149 48.261 36.463 13.775 1.00 0.10 A +ATOM 1994 HG LEU A 149 47.573 38.812 15.489 1.00 0.09 A +ATOM 1995 1HD1 LEU A 149 45.412 38.584 14.544 1.00 0.10 A +ATOM 1996 2HD1 LEU A 149 45.351 37.658 16.030 1.00 0.09 A +ATOM 1997 3HD1 LEU A 149 45.533 36.831 14.485 1.00 0.10 A +ATOM 1998 1HD2 LEU A 149 47.343 35.842 15.989 1.00 0.09 A +ATOM 1999 2HD2 LEU A 149 47.507 37.129 17.183 1.00 0.08 A +ATOM 2000 3HD2 LEU A 149 48.867 36.714 16.140 1.00 0.08 A +ATOM 2001 N ILE A 150 51.214 38.454 14.774 1.00 0.09 A +ATOM 2002 CA ILE A 150 52.468 38.014 15.396 1.00 0.09 A +ATOM 2003 C ILE A 150 52.210 37.832 16.902 1.00 0.08 A +ATOM 2004 O ILE A 150 51.965 38.778 17.624 1.00 0.08 A +ATOM 2005 CB ILE A 150 53.556 39.060 15.182 1.00 0.09 A +ATOM 2006 CG1 ILE A 150 53.688 39.309 13.671 1.00 0.10 A +ATOM 2007 CG2 ILE A 150 54.891 38.628 15.810 1.00 0.09 A +ATOM 2008 CD1 ILE A 150 54.722 40.399 13.371 1.00 0.11 A +ATOM 2009 H ILE A 150 50.898 39.358 14.974 1.00 0.09 A +ATOM 2010 HA ILE A 150 52.779 37.081 14.952 1.00 0.09 A +ATOM 2011 HB ILE A 150 53.249 39.978 15.661 1.00 0.09 A +ATOM 2012 1HG1 ILE A 150 53.980 38.396 13.181 1.00 0.10 A +ATOM 2013 2HG1 ILE A 150 52.727 39.626 13.287 1.00 0.10 A +ATOM 2014 1HG2 ILE A 150 55.175 37.655 15.444 1.00 0.09 A +ATOM 2015 2HG2 ILE A 150 54.785 38.591 16.886 1.00 0.09 A +ATOM 2016 3HG2 ILE A 150 55.658 39.348 15.557 1.00 0.10 A +ATOM 2017 1HD1 ILE A 150 54.778 40.551 12.301 1.00 0.11 A +ATOM 2018 2HD1 ILE A 150 55.688 40.094 13.740 1.00 0.11 A +ATOM 2019 3HD1 ILE A 150 54.427 41.322 13.847 1.00 0.11 A +ATOM 2020 N LYS A 151 52.260 36.604 17.342 1.00 0.08 A +ATOM 2021 CA LYS A 151 52.029 36.215 18.723 1.00 0.07 A +ATOM 2022 C LYS A 151 53.252 36.322 19.582 1.00 0.07 A +ATOM 2023 O LYS A 151 54.316 35.829 19.253 1.00 0.08 A +ATOM 2024 CB LYS A 151 51.425 34.806 18.827 1.00 0.07 A +ATOM 2025 CG LYS A 151 50.160 34.638 17.970 1.00 0.08 A +ATOM 2026 CD LYS A 151 49.438 33.319 18.349 1.00 0.08 A +ATOM 2027 CE LYS A 151 48.354 32.961 17.303 1.00 0.09 A +ATOM 2028 NZ LYS A 151 48.243 31.478 17.148 1.00 0.09 A +ATOM 2029 H LYS A 151 52.460 35.892 16.702 1.00 0.08 A +ATOM 2030 HA LYS A 151 51.350 36.921 19.176 1.00 0.07 A +ATOM 2031 1HB LYS A 151 52.162 34.088 18.502 1.00 0.08 A +ATOM 2032 2HB LYS A 151 51.179 34.610 19.860 1.00 0.07 A +ATOM 2033 1HG LYS A 151 49.497 35.471 18.137 1.00 0.07 A +ATOM 2034 2HG LYS A 151 50.442 34.601 16.931 1.00 0.08 A +ATOM 2035 1HD LYS A 151 50.156 32.518 18.409 1.00 0.08 A +ATOM 2036 2HD LYS A 151 48.965 33.445 19.315 1.00 0.08 A +ATOM 2037 1HE LYS A 151 47.401 33.349 17.625 1.00 0.09 A +ATOM 2038 2HE LYS A 151 48.608 33.392 16.349 1.00 0.09 A +ATOM 2039 1HZ LYS A 151 47.291 31.240 16.800 1.00 0.10 A +ATOM 2040 2HZ LYS A 151 48.404 31.014 18.064 1.00 0.09 A +ATOM 2041 3HZ LYS A 151 48.949 31.146 16.460 1.00 0.10 A +ATOM 2042 N LEU A 152 53.085 36.989 20.730 1.00 0.07 A +ATOM 2043 CA LEU A 152 54.188 37.156 21.603 1.00 0.07 A +ATOM 2044 C LEU A 152 54.241 36.105 22.653 1.00 0.07 A +ATOM 2045 O LEU A 152 53.429 35.204 22.721 1.00 0.07 A +ATOM 2046 CB LEU A 152 54.404 38.574 22.119 1.00 0.07 A +ATOM 2047 CG LEU A 152 54.400 39.558 20.974 1.00 0.08 A +ATOM 2048 CD1 LEU A 152 54.413 40.975 21.550 1.00 0.08 A +ATOM 2049 CD2 LEU A 152 55.651 39.314 20.125 1.00 0.08 A +ATOM 2050 H LEU A 152 52.208 37.362 20.961 1.00 0.06 A +ATOM 2051 HA LEU A 152 55.079 36.854 21.076 1.00 0.08 A +ATOM 2052 1HB LEU A 152 53.612 38.822 22.810 1.00 0.07 A +ATOM 2053 2HB LEU A 152 55.351 38.624 22.634 1.00 0.08 A +ATOM 2054 HG LEU A 152 53.511 39.415 20.376 1.00 0.07 A +ATOM 2055 1HD1 LEU A 152 54.266 41.690 20.757 1.00 0.08 A +ATOM 2056 2HD1 LEU A 152 55.362 41.159 22.032 1.00 0.08 A +ATOM 2057 3HD1 LEU A 152 53.618 41.077 22.277 1.00 0.07 A +ATOM 2058 1HD2 LEU A 152 55.544 38.387 19.584 1.00 0.08 A +ATOM 2059 2HD2 LEU A 152 56.518 39.257 20.767 1.00 0.09 A +ATOM 2060 3HD2 LEU A 152 55.776 40.120 19.426 1.00 0.09 A +ATOM 2061 N SER A 153 55.289 36.184 23.411 1.00 0.08 A +ATOM 2062 CA SER A 153 55.585 35.175 24.419 1.00 0.08 A +ATOM 2063 C SER A 153 55.921 35.736 25.815 1.00 0.09 A +ATOM 2064 O SER A 153 56.357 36.865 25.956 1.00 0.09 A +ATOM 2065 CB SER A 153 56.882 34.538 23.944 1.00 0.09 A +ATOM 2066 OG SER A 153 56.605 33.262 23.391 1.00 0.09 A +ATOM 2067 H SER A 153 55.904 36.940 23.305 1.00 0.08 A +ATOM 2068 HA SER A 153 54.795 34.441 24.469 1.00 0.08 A +ATOM 2069 1HB SER A 153 57.341 35.153 23.186 1.00 0.09 A +ATOM 2070 2HB SER A 153 57.582 34.423 24.768 1.00 0.10 A +ATOM 2071 HG SER A 153 56.013 33.384 22.649 1.00 0.09 A +ATOM 2072 N GLY A 154 55.803 34.890 26.850 1.00 0.09 A +ATOM 2073 CA GLY A 154 56.217 35.305 28.186 1.00 0.09 A +ATOM 2074 C GLY A 154 55.149 35.758 29.183 1.00 0.09 A +ATOM 2075 O GLY A 154 53.973 35.453 29.106 1.00 0.08 A +ATOM 2076 H GLY A 154 55.455 33.987 26.705 1.00 0.09 A +ATOM 2077 1HA GLY A 154 56.734 34.469 28.630 1.00 0.10 A +ATOM 2078 2HA GLY A 154 56.901 36.129 28.064 1.00 0.10 A +ATOM 2079 N SER A 155 55.657 36.509 30.152 1.00 0.10 A +ATOM 2080 CA SER A 155 54.883 37.062 31.250 1.00 0.10 A +ATOM 2081 C SER A 155 54.448 38.474 30.916 1.00 0.09 A +ATOM 2082 O SER A 155 55.174 39.219 30.291 1.00 0.09 A +ATOM 2083 CB SER A 155 55.730 37.023 32.509 1.00 0.11 A +ATOM 2084 OG SER A 155 56.849 36.179 32.280 1.00 0.11 A +ATOM 2085 H SER A 155 56.615 36.709 30.122 1.00 0.10 A +ATOM 2086 HA SER A 155 53.988 36.476 31.396 1.00 0.09 A +ATOM 2087 1HB SER A 155 56.084 38.013 32.757 1.00 0.11 A +ATOM 2088 2HB SER A 155 55.145 36.639 33.336 1.00 0.11 A +ATOM 2089 HG SER A 155 56.525 35.282 32.170 1.00 0.11 A +ATOM 2090 N VAL A 156 53.244 38.841 31.305 1.00 0.08 A +ATOM 2091 CA VAL A 156 52.757 40.152 30.971 1.00 0.08 A +ATOM 2092 C VAL A 156 52.195 40.793 32.155 1.00 0.08 A +ATOM 2093 O VAL A 156 51.825 40.167 33.132 1.00 0.08 A +ATOM 2094 CB VAL A 156 51.662 40.111 29.908 1.00 0.07 A +ATOM 2095 CG1 VAL A 156 52.306 39.681 28.564 1.00 0.07 A +ATOM 2096 CG2 VAL A 156 50.615 39.061 30.319 1.00 0.06 A +ATOM 2097 H VAL A 156 52.673 38.214 31.795 1.00 0.08 A +ATOM 2098 HA VAL A 156 53.580 40.744 30.600 1.00 0.08 A +ATOM 2099 HB VAL A 156 51.191 41.071 29.817 1.00 0.07 A +ATOM 2100 1HG1 VAL A 156 51.947 40.313 27.780 1.00 0.06 A +ATOM 2101 2HG1 VAL A 156 52.056 38.651 28.344 1.00 0.07 A +ATOM 2102 3HG1 VAL A 156 53.383 39.765 28.613 1.00 0.08 A +ATOM 2103 1HG2 VAL A 156 49.818 39.044 29.590 1.00 0.06 A +ATOM 2104 2HG2 VAL A 156 50.215 39.305 31.289 1.00 0.07 A +ATOM 2105 3HG2 VAL A 156 51.085 38.087 30.357 1.00 0.07 A +ATOM 2106 N THR A 157 52.128 42.060 32.043 1.00 0.08 A +ATOM 2107 CA THR A 157 51.621 42.854 33.086 1.00 0.09 A +ATOM 2108 C THR A 157 50.437 43.677 32.535 1.00 0.08 A +ATOM 2109 O THR A 157 50.551 44.402 31.568 1.00 0.08 A +ATOM 2110 CB THR A 157 52.814 43.687 33.679 1.00 0.10 A +ATOM 2111 OG1 THR A 157 53.704 42.823 34.376 1.00 0.11 A +ATOM 2112 CG2 THR A 157 52.306 44.782 34.617 1.00 0.10 A +ATOM 2113 H THR A 157 52.444 42.484 31.218 1.00 0.08 A +ATOM 2114 HA THR A 157 51.195 42.225 33.852 1.00 0.09 A +ATOM 2115 HB THR A 157 53.349 44.155 32.865 1.00 0.10 A +ATOM 2116 HG1 THR A 157 54.306 42.435 33.733 1.00 0.11 A +ATOM 2117 1HG2 THR A 157 51.697 45.478 34.059 1.00 0.10 A +ATOM 2118 2HG2 THR A 157 53.150 45.306 35.042 1.00 0.11 A +ATOM 2119 3HG2 THR A 157 51.721 44.342 35.408 1.00 0.10 A +ATOM 2120 N VAL A 158 49.287 43.519 33.190 1.00 0.08 A +ATOM 2121 CA VAL A 158 48.065 44.213 32.842 1.00 0.07 A +ATOM 2122 C VAL A 158 48.280 45.658 32.379 1.00 0.08 A +ATOM 2123 O VAL A 158 48.818 46.512 33.059 1.00 0.08 A +ATOM 2124 CB VAL A 158 47.008 44.118 33.989 1.00 0.07 A +ATOM 2125 CG1 VAL A 158 47.440 44.858 35.261 1.00 0.08 A +ATOM 2126 CG2 VAL A 158 45.663 44.681 33.534 1.00 0.06 A +ATOM 2127 H VAL A 158 49.271 42.917 33.962 1.00 0.08 A +ATOM 2128 HA VAL A 158 47.653 43.771 31.947 1.00 0.06 A +ATOM 2129 HB VAL A 158 46.872 43.074 34.234 1.00 0.07 A +ATOM 2130 1HG1 VAL A 158 47.578 45.905 35.048 1.00 0.08 A +ATOM 2131 2HG1 VAL A 158 48.360 44.437 35.635 1.00 0.08 A +ATOM 2132 3HG1 VAL A 158 46.666 44.745 36.013 1.00 0.08 A +ATOM 2133 1HG2 VAL A 158 45.734 45.752 33.431 1.00 0.07 A +ATOM 2134 2HG2 VAL A 158 44.913 44.441 34.276 1.00 0.06 A +ATOM 2135 3HG2 VAL A 158 45.386 44.240 32.589 1.00 0.06 A +ATOM 2136 N GLY A 159 47.774 45.894 31.171 1.00 0.07 A +ATOM 2137 CA GLY A 159 47.775 47.199 30.555 1.00 0.08 A +ATOM 2138 C GLY A 159 49.132 47.767 30.333 1.00 0.09 A +ATOM 2139 O GLY A 159 49.292 48.974 30.246 1.00 0.10 A +ATOM 2140 H GLY A 159 47.348 45.154 30.690 1.00 0.06 A +ATOM 2141 1HA GLY A 159 47.295 47.113 29.591 1.00 0.07 A +ATOM 2142 2HA GLY A 159 47.206 47.865 31.184 1.00 0.08 A +ATOM 2143 N GLU A 160 50.102 46.930 30.208 1.00 0.09 A +ATOM 2144 CA GLU A 160 51.429 47.415 29.968 1.00 0.10 A +ATOM 2145 C GLU A 160 52.148 46.603 28.893 1.00 0.09 A +ATOM 2146 O GLU A 160 52.697 47.132 27.949 1.00 0.10 A +ATOM 2147 CB GLU A 160 52.248 47.340 31.282 1.00 0.10 A +ATOM 2148 CG GLU A 160 53.327 48.453 31.361 1.00 0.12 A +ATOM 2149 CD GLU A 160 52.979 49.457 32.467 1.00 0.12 A +ATOM 2150 OE1 GLU A 160 53.191 49.135 33.627 1.00 0.13 A +ATOM 2151 OE2 GLU A 160 52.500 50.530 32.126 1.00 0.13 A +ATOM 2152 H GLU A 160 49.925 45.968 30.268 1.00 0.08 A +ATOM 2153 HA GLU A 160 51.383 48.439 29.628 1.00 0.10 A +ATOM 2154 1HB GLU A 160 51.566 47.432 32.116 1.00 0.10 A +ATOM 2155 2HB GLU A 160 52.731 46.372 31.344 1.00 0.10 A +ATOM 2156 1HG GLU A 160 54.285 48.006 31.585 1.00 0.12 A +ATOM 2157 2HG GLU A 160 53.395 48.977 30.423 1.00 0.12 A +ATOM 2158 N THR A 161 52.183 45.334 29.072 1.00 0.09 A +ATOM 2159 CA THR A 161 52.912 44.455 28.174 1.00 0.09 A +ATOM 2160 C THR A 161 52.121 44.024 26.943 1.00 0.08 A +ATOM 2161 O THR A 161 51.070 43.422 27.059 1.00 0.07 A +ATOM 2162 CB THR A 161 53.310 43.175 28.940 1.00 0.08 A +ATOM 2163 OG1 THR A 161 53.855 43.524 30.205 1.00 0.09 A +ATOM 2164 CG2 THR A 161 54.362 42.425 28.121 1.00 0.09 A +ATOM 2165 H THR A 161 51.729 44.949 29.849 1.00 0.08 A +ATOM 2166 HA THR A 161 53.800 44.957 27.819 1.00 0.09 A +ATOM 2167 HB THR A 161 52.453 42.561 29.072 1.00 0.08 A +ATOM 2168 HG1 THR A 161 53.956 44.478 30.232 1.00 0.10 A +ATOM 2169 1HG2 THR A 161 53.906 42.035 27.223 1.00 0.08 A +ATOM 2170 2HG2 THR A 161 54.765 41.614 28.705 1.00 0.09 A +ATOM 2171 3HG2 THR A 161 55.160 43.102 27.853 1.00 0.09 A +ATOM 2172 N PRO A 162 52.667 44.304 25.759 1.00 0.08 A +ATOM 2173 CA PRO A 162 52.054 43.911 24.481 1.00 0.08 A +ATOM 2174 C PRO A 162 51.973 42.376 24.394 1.00 0.07 A +ATOM 2175 O PRO A 162 52.879 41.690 24.826 1.00 0.07 A +ATOM 2176 CB PRO A 162 52.967 44.464 23.369 1.00 0.08 A +ATOM 2177 CG PRO A 162 54.053 45.268 24.027 1.00 0.09 A +ATOM 2178 CD PRO A 162 53.914 45.097 25.539 1.00 0.09 A +ATOM 2179 HA PRO A 162 51.064 44.334 24.397 1.00 0.07 A +ATOM 2180 1HB PRO A 162 53.402 43.650 22.797 1.00 0.08 A +ATOM 2181 2HB PRO A 162 52.390 45.096 22.709 1.00 0.09 A +ATOM 2182 1HG PRO A 162 55.029 44.913 23.706 1.00 0.10 A +ATOM 2183 2HG PRO A 162 53.954 46.317 23.768 1.00 0.10 A +ATOM 2184 1HD PRO A 162 54.778 44.578 25.936 1.00 0.09 A +ATOM 2185 2HD PRO A 162 53.813 46.075 26.003 1.00 0.10 A +ATOM 2186 N VAL A 163 50.898 41.839 23.845 1.00 0.06 A +ATOM 2187 CA VAL A 163 50.741 40.376 23.721 1.00 0.06 A +ATOM 2188 C VAL A 163 50.675 39.921 22.255 1.00 0.06 A +ATOM 2189 O VAL A 163 51.040 38.807 21.920 1.00 0.06 A +ATOM 2190 CB VAL A 163 49.513 39.870 24.450 1.00 0.05 A +ATOM 2191 CG1 VAL A 163 49.604 40.237 25.923 1.00 0.05 A +ATOM 2192 CG2 VAL A 163 48.247 40.480 23.839 1.00 0.05 A +ATOM 2193 H VAL A 163 50.183 42.421 23.515 1.00 0.06 A +ATOM 2194 HA VAL A 163 51.615 39.895 24.137 1.00 0.06 A +ATOM 2195 HB VAL A 163 49.465 38.795 24.356 1.00 0.05 A +ATOM 2196 1HG1 VAL A 163 49.658 41.309 26.028 1.00 0.05 A +ATOM 2197 2HG1 VAL A 163 50.483 39.791 26.331 1.00 0.05 A +ATOM 2198 3HG1 VAL A 163 48.738 39.863 26.444 1.00 0.04 A +ATOM 2199 1HG2 VAL A 163 48.333 41.556 23.821 1.00 0.05 A +ATOM 2200 2HG2 VAL A 163 47.389 40.198 24.433 1.00 0.04 A +ATOM 2201 3HG2 VAL A 163 48.118 40.113 22.833 1.00 0.05 A +ATOM 2202 N ILE A 164 50.212 40.773 21.405 1.00 0.06 A +ATOM 2203 CA ILE A 164 50.093 40.513 19.989 1.00 0.07 A +ATOM 2204 C ILE A 164 50.470 41.796 19.222 1.00 0.07 A +ATOM 2205 O ILE A 164 50.278 42.899 19.692 1.00 0.08 A +ATOM 2206 CB ILE A 164 48.668 40.084 19.615 1.00 0.06 A +ATOM 2207 CG1 ILE A 164 48.288 38.723 20.251 1.00 0.06 A +ATOM 2208 CG2 ILE A 164 48.507 39.982 18.100 1.00 0.07 A +ATOM 2209 CD1 ILE A 164 46.759 38.615 20.451 1.00 0.06 A +ATOM 2210 H ILE A 164 49.933 41.651 21.742 1.00 0.06 A +ATOM 2211 HA ILE A 164 50.779 39.724 19.718 1.00 0.07 A +ATOM 2212 HB ILE A 164 47.984 40.836 19.969 1.00 0.06 A +ATOM 2213 1HG1 ILE A 164 48.612 37.922 19.604 1.00 0.06 A +ATOM 2214 2HG1 ILE A 164 48.771 38.621 21.202 1.00 0.06 A +ATOM 2215 1HG2 ILE A 164 47.541 39.549 17.877 1.00 0.07 A +ATOM 2216 2HG2 ILE A 164 49.283 39.353 17.695 1.00 0.07 A +ATOM 2217 3HG2 ILE A 164 48.568 40.966 17.663 1.00 0.08 A +ATOM 2218 1HD1 ILE A 164 46.245 39.038 19.600 1.00 0.06 A +ATOM 2219 2HD1 ILE A 164 46.470 39.149 21.345 1.00 0.05 A +ATOM 2220 3HD1 ILE A 164 46.484 37.574 20.555 1.00 0.06 A +ATOM 2221 N ARG A 165 50.980 41.619 18.033 1.00 0.08 A +ATOM 2222 CA ARG A 165 51.338 42.683 17.127 1.00 0.09 A +ATOM 2223 C ARG A 165 50.615 42.385 15.841 1.00 0.09 A +ATOM 2224 O ARG A 165 50.642 41.263 15.363 1.00 0.09 A +ATOM 2225 CB ARG A 165 52.843 42.705 16.939 1.00 0.09 A +ATOM 2226 CG ARG A 165 53.457 43.926 17.644 1.00 0.10 A +ATOM 2227 CD ARG A 165 54.977 43.775 17.826 1.00 0.10 A +ATOM 2228 NE ARG A 165 55.430 44.678 18.923 1.00 0.10 A +ATOM 2229 CZ ARG A 165 56.251 44.285 19.856 1.00 0.10 A +ATOM 2230 NH1 ARG A 165 56.703 43.062 19.885 1.00 0.10 A +ATOM 2231 NH2 ARG A 165 56.599 45.114 20.801 1.00 0.11 A +ATOM 2232 H ARG A 165 51.111 40.700 17.722 1.00 0.08 A +ATOM 2233 HA ARG A 165 51.013 43.629 17.538 1.00 0.09 A +ATOM 2234 1HB ARG A 165 53.260 41.799 17.353 1.00 0.09 A +ATOM 2235 2HB ARG A 165 53.084 42.754 15.884 1.00 0.10 A +ATOM 2236 1HG ARG A 165 53.255 44.809 17.062 1.00 0.10 A +ATOM 2237 2HG ARG A 165 53.005 44.031 18.619 1.00 0.09 A +ATOM 2238 1HD ARG A 165 55.203 42.719 18.041 1.00 0.10 A +ATOM 2239 2HD ARG A 165 55.489 44.106 16.950 1.00 0.11 A +ATOM 2240 1HH1 ARG A 165 56.434 42.408 19.184 1.00 0.10 A +ATOM 2241 2HH1 ARG A 165 57.306 42.776 20.630 1.00 0.10 A +ATOM 2242 1HH2 ARG A 165 56.245 46.048 20.804 1.00 0.11 A +ATOM 2243 2HH2 ARG A 165 57.204 44.806 21.536 1.00 0.11 A +ATOM 2244 N ILE A 166 49.937 43.347 15.290 1.00 0.10 A +ATOM 2245 CA ILE A 166 49.193 43.076 14.070 1.00 0.11 A +ATOM 2246 C ILE A 166 49.545 44.092 13.025 1.00 0.12 A +ATOM 2247 O ILE A 166 49.914 45.199 13.332 1.00 0.12 A +ATOM 2248 CB ILE A 166 47.658 43.137 14.227 1.00 0.11 A +ATOM 2249 CG1 ILE A 166 47.271 44.427 14.763 1.00 0.11 A +ATOM 2250 CG2 ILE A 166 47.108 42.037 15.148 1.00 0.10 A +ATOM 2251 CD1 ILE A 166 45.762 44.553 14.734 1.00 0.11 A +ATOM 2252 H ILE A 166 49.915 44.234 15.707 1.00 0.10 A +ATOM 2253 HA ILE A 166 49.458 42.088 13.727 1.00 0.10 A +ATOM 2254 HB ILE A 166 47.207 43.007 13.252 1.00 0.11 A +ATOM 2255 1HG1 ILE A 166 47.632 44.502 15.778 1.00 0.10 A +ATOM 2256 2HG1 ILE A 166 47.704 45.181 14.156 1.00 0.11 A +ATOM 2257 1HG2 ILE A 166 46.036 41.962 14.990 1.00 0.10 A +ATOM 2258 2HG2 ILE A 166 47.293 42.295 16.181 1.00 0.09 A +ATOM 2259 3HG2 ILE A 166 47.569 41.094 14.916 1.00 0.10 A +ATOM 2260 1HD1 ILE A 166 45.441 44.642 13.702 1.00 0.12 A +ATOM 2261 2HD1 ILE A 166 45.474 45.419 15.288 1.00 0.11 A +ATOM 2262 3HD1 ILE A 166 45.297 43.698 15.177 1.00 0.10 A +ATOM 2263 N LYS A 167 49.368 43.722 11.796 1.00 0.12 A +ATOM 2264 CA LYS A 167 49.594 44.620 10.682 1.00 0.13 A +ATOM 2265 C LYS A 167 48.302 44.763 9.890 1.00 0.14 A +ATOM 2266 O LYS A 167 47.442 43.904 9.923 1.00 0.14 A +ATOM 2267 CB LYS A 167 50.776 44.251 9.778 1.00 0.14 A +ATOM 2268 CG LYS A 167 51.482 45.521 9.247 1.00 0.15 A +ATOM 2269 CD LYS A 167 52.981 45.240 8.945 1.00 0.15 A +ATOM 2270 CE LYS A 167 53.361 45.731 7.539 1.00 0.16 A +ATOM 2271 NZ LYS A 167 54.487 44.919 7.009 1.00 0.16 A +ATOM 2272 H LYS A 167 49.056 42.811 11.616 1.00 0.12 A +ATOM 2273 HA LYS A 167 49.774 45.608 11.080 1.00 0.13 A +ATOM 2274 1HB LYS A 167 51.473 43.658 10.352 1.00 0.13 A +ATOM 2275 2HB LYS A 167 50.421 43.665 8.942 1.00 0.14 A +ATOM 2276 1HG LYS A 167 50.972 45.848 8.358 1.00 0.15 A +ATOM 2277 2HG LYS A 167 51.422 46.309 9.984 1.00 0.14 A +ATOM 2278 1HD LYS A 167 53.589 45.765 9.674 1.00 0.15 A +ATOM 2279 2HD LYS A 167 53.189 44.184 9.017 1.00 0.14 A +ATOM 2280 1HE LYS A 167 52.521 45.628 6.871 1.00 0.16 A +ATOM 2281 2HE LYS A 167 53.659 46.767 7.588 1.00 0.16 A +ATOM 2282 1HZ LYS A 167 54.203 43.920 6.965 1.00 0.15 A +ATOM 2283 2HZ LYS A 167 55.313 45.022 7.631 1.00 0.16 A +ATOM 2284 3HZ LYS A 167 54.726 45.251 6.054 1.00 0.17 A +ATOM 2285 N LYS A 168 48.170 45.888 9.208 1.00 0.15 A +ATOM 2286 CA LYS A 168 46.969 46.212 8.440 1.00 0.16 A +ATOM 2287 C LYS A 168 45.738 45.676 9.191 1.00 0.15 A +ATOM 2288 CB LYS A 168 47.014 45.719 6.995 1.00 0.16 A +ATOM 2289 CG LYS A 168 45.594 45.584 6.346 1.00 0.17 A +ATOM 2290 CD LYS A 168 45.496 44.324 5.461 1.00 0.17 A +ATOM 2291 CE LYS A 168 44.107 44.222 4.824 1.00 0.18 A +ATOM 2292 NZ LYS A 168 43.803 42.803 4.459 1.00 0.18 A +ATOM 2293 H LYS A 168 48.906 46.534 9.217 1.00 0.15 A +ATOM 2294 HA LYS A 168 46.848 47.285 8.429 1.00 0.16 A +ATOM 2295 1HB LYS A 168 47.599 46.418 6.411 1.00 0.17 A +ATOM 2296 2HB LYS A 168 47.504 44.798 6.994 1.00 0.16 A +ATOM 2297 1HG LYS A 168 44.838 45.524 7.099 1.00 0.17 A +ATOM 2298 2HG LYS A 168 45.407 46.453 5.734 1.00 0.18 A +ATOM 2299 1HD LYS A 168 46.247 44.369 4.688 1.00 0.18 A +ATOM 2300 2HD LYS A 168 45.648 43.453 6.070 1.00 0.17 A +ATOM 2301 1HE LYS A 168 43.366 44.568 5.526 1.00 0.18 A +ATOM 2302 2HE LYS A 168 44.077 44.831 3.936 1.00 0.19 A +ATOM 2303 1HZ LYS A 168 42.829 42.575 4.745 1.00 0.18 A +ATOM 2304 2HZ LYS A 168 44.465 42.162 4.944 1.00 0.17 A +ATOM 2305 3HZ LYS A 168 43.894 42.682 3.430 1.00 0.19 A +TER 2306 LYS A 168 +ATOM 2307 N MET B 1 13.639 37.821 -0.846 1.00 0.21 B +ATOM 2308 CA MET B 1 14.123 37.656 0.530 1.00 0.20 B +ATOM 2309 C MET B 1 13.201 36.682 1.252 1.00 0.19 B +ATOM 2310 O MET B 1 12.049 36.500 0.900 1.00 0.19 B +ATOM 2311 CB MET B 1 14.116 39.022 1.227 1.00 0.20 B +ATOM 2312 CG MET B 1 13.755 38.872 2.711 1.00 0.18 B +ATOM 2313 SD MET B 1 13.906 40.480 3.509 1.00 0.19 B +ATOM 2314 CE MET B 1 15.668 40.712 3.151 1.00 0.19 B +ATOM 2315 HA MET B 1 15.128 37.258 0.518 1.00 0.19 B +ATOM 2316 1HB MET B 1 15.069 39.449 1.136 1.00 0.20 B +ATOM 2317 2HB MET B 1 13.398 39.668 0.750 1.00 0.21 B +ATOM 2318 1HG MET B 1 12.736 38.517 2.806 1.00 0.19 B +ATOM 2319 2HG MET B 1 14.429 38.167 3.178 1.00 0.17 B +ATOM 2320 1HE MET B 1 15.775 41.242 2.210 1.00 0.20 B +ATOM 2321 2HE MET B 1 16.153 39.748 3.076 1.00 0.18 B +ATOM 2322 3HE MET B 1 16.124 41.277 3.939 1.00 0.19 B +ATOM 2323 N PHE B 2 13.709 36.079 2.279 1.00 0.17 B +ATOM 2324 CA PHE B 2 12.907 35.138 3.066 1.00 0.17 B +ATOM 2325 C PHE B 2 13.306 35.323 4.540 1.00 0.15 B +ATOM 2326 O PHE B 2 14.460 35.552 4.851 1.00 0.15 B +ATOM 2327 CB PHE B 2 13.200 33.779 2.434 1.00 0.17 B +ATOM 2328 CG PHE B 2 12.433 32.720 3.155 1.00 0.16 B +ATOM 2329 CD1 PHE B 2 11.049 32.687 3.040 1.00 0.17 B +ATOM 2330 CD2 PHE B 2 13.098 31.779 3.926 1.00 0.16 B +ATOM 2331 CE1 PHE B 2 10.319 31.700 3.699 1.00 0.17 B +ATOM 2332 CE2 PHE B 2 12.381 30.780 4.586 1.00 0.16 B +ATOM 2333 CZ PHE B 2 10.989 30.741 4.471 1.00 0.16 B +ATOM 2334 H PHE B 2 14.640 36.251 2.541 1.00 0.17 B +ATOM 2335 HA PHE B 2 11.853 35.364 2.993 1.00 0.17 B +ATOM 2336 1HB PHE B 2 12.885 33.801 1.397 1.00 0.18 B +ATOM 2337 2HB PHE B 2 14.260 33.575 2.479 1.00 0.16 B +ATOM 2338 HD1 PHE B 2 10.543 33.426 2.439 1.00 0.18 B +ATOM 2339 HD2 PHE B 2 14.166 31.833 4.016 1.00 0.15 B +ATOM 2340 HE1 PHE B 2 9.242 31.675 3.614 1.00 0.18 B +ATOM 2341 HE2 PHE B 2 12.899 30.033 5.171 1.00 0.15 B +ATOM 2342 HZ PHE B 2 10.429 29.979 4.987 1.00 0.17 B +ATOM 2343 N GLN B 3 12.352 35.266 5.454 1.00 0.15 B +ATOM 2344 CA GLN B 3 12.674 35.459 6.891 1.00 0.14 B +ATOM 2345 C GLN B 3 11.679 34.676 7.745 1.00 0.14 B +ATOM 2346 O GLN B 3 10.579 34.357 7.327 1.00 0.15 B +ATOM 2347 CB GLN B 3 12.681 36.930 7.295 1.00 0.14 B +ATOM 2348 CG GLN B 3 11.407 37.762 7.085 1.00 0.16 B +ATOM 2349 CD GLN B 3 11.836 39.239 7.246 1.00 0.16 B +ATOM 2350 OE1 GLN B 3 11.476 39.903 8.199 1.00 0.16 B +ATOM 2351 NE2 GLN B 3 12.552 39.790 6.309 1.00 0.17 B +ATOM 2352 H GLN B 3 11.426 35.086 5.193 1.00 0.16 B +ATOM 2353 HA GLN B 3 13.676 35.072 7.066 1.00 0.13 B +ATOM 2354 1HB GLN B 3 12.922 36.978 8.339 1.00 0.13 B +ATOM 2355 2HB GLN B 3 13.464 37.394 6.747 1.00 0.14 B +ATOM 2356 1HG GLN B 3 11.006 37.596 6.101 1.00 0.16 B +ATOM 2357 2HG GLN B 3 10.683 37.521 7.841 1.00 0.15 B +ATOM 2358 1HE2 GLN B 3 12.736 39.297 5.488 1.00 0.17 B +ATOM 2359 2HE2 GLN B 3 13.019 40.629 6.484 1.00 0.17 B +ATOM 2360 N GLN B 4 12.076 34.372 8.937 1.00 0.13 B +ATOM 2361 CA GLN B 4 11.223 33.607 9.889 1.00 0.13 B +ATOM 2362 C GLN B 4 11.665 34.006 11.311 1.00 0.12 B +ATOM 2363 O GLN B 4 12.827 34.277 11.539 1.00 0.11 B +ATOM 2364 CB GLN B 4 11.427 32.077 9.744 1.00 0.13 B +ATOM 2365 CG GLN B 4 10.982 31.455 8.393 1.00 0.14 B +ATOM 2366 CD GLN B 4 9.480 31.254 8.482 1.00 0.15 B +ATOM 2367 OE1 GLN B 4 9.028 30.209 8.927 1.00 0.16 B +ATOM 2368 NE2 GLN B 4 8.689 32.120 7.931 1.00 0.16 B +ATOM 2369 H GLN B 4 12.962 34.659 9.228 1.00 0.12 B +ATOM 2370 HA GLN B 4 10.190 33.859 9.746 1.00 0.14 B +ATOM 2371 1HB GLN B 4 12.467 31.876 9.869 1.00 0.12 B +ATOM 2372 2HB GLN B 4 10.883 31.593 10.547 1.00 0.13 B +ATOM 2373 1HG GLN B 4 11.235 32.108 7.577 1.00 0.14 B +ATOM 2374 2HG GLN B 4 11.472 30.496 8.267 1.00 0.14 B +ATOM 2375 1HE2 GLN B 4 9.047 32.789 7.337 1.00 0.16 B +ATOM 2376 2HE2 GLN B 4 7.826 32.268 8.315 1.00 0.16 B +ATOM 2377 N GLU B 5 10.758 34.025 12.256 1.00 0.13 B +ATOM 2378 CA GLU B 5 11.095 34.358 13.653 1.00 0.12 B +ATOM 2379 C GLU B 5 11.365 33.050 14.409 1.00 0.12 B +ATOM 2380 O GLU B 5 10.768 32.028 14.115 1.00 0.13 B +ATOM 2381 CB GLU B 5 9.874 34.978 14.380 1.00 0.14 B +ATOM 2382 CG GLU B 5 9.987 36.511 14.541 1.00 0.14 B +ATOM 2383 CD GLU B 5 8.615 37.199 14.486 1.00 0.15 B +ATOM 2384 OE1 GLU B 5 7.900 37.012 13.513 1.00 0.16 B +ATOM 2385 OE2 GLU B 5 8.314 37.926 15.424 1.00 0.16 B +ATOM 2386 H GLU B 5 9.839 33.803 12.038 1.00 0.14 B +ATOM 2387 HA GLU B 5 11.926 35.038 13.673 1.00 0.12 B +ATOM 2388 1HB GLU B 5 8.987 34.746 13.815 1.00 0.14 B +ATOM 2389 2HB GLU B 5 9.776 34.536 15.369 1.00 0.14 B +ATOM 2390 1HG GLU B 5 10.415 36.723 15.494 1.00 0.14 B +ATOM 2391 2HG GLU B 5 10.616 36.916 13.775 1.00 0.14 B +ATOM 2392 N VAL B 6 12.181 33.091 15.425 1.00 0.12 B +ATOM 2393 CA VAL B 6 12.393 31.890 16.260 1.00 0.12 B +ATOM 2394 C VAL B 6 12.712 32.372 17.683 1.00 0.13 B +ATOM 2395 O VAL B 6 13.353 33.391 17.872 1.00 0.12 B +ATOM 2396 CB VAL B 6 13.500 30.972 15.693 1.00 0.12 B +ATOM 2397 CG1 VAL B 6 14.831 31.704 15.578 1.00 0.10 B +ATOM 2398 CG2 VAL B 6 13.694 29.733 16.589 1.00 0.13 B +ATOM 2399 H VAL B 6 12.626 33.929 15.660 1.00 0.11 B +ATOM 2400 HA VAL B 6 11.468 31.331 16.295 1.00 0.13 B +ATOM 2401 HB VAL B 6 13.202 30.641 14.709 1.00 0.12 B +ATOM 2402 1HG1 VAL B 6 14.693 32.622 15.030 1.00 0.10 B +ATOM 2403 2HG1 VAL B 6 15.534 31.072 15.051 1.00 0.10 B +ATOM 2404 3HG1 VAL B 6 15.212 31.919 16.564 1.00 0.11 B +ATOM 2405 1HG2 VAL B 6 14.070 30.036 17.555 1.00 0.13 B +ATOM 2406 2HG2 VAL B 6 14.404 29.063 16.123 1.00 0.13 B +ATOM 2407 3HG2 VAL B 6 12.751 29.222 16.712 1.00 0.14 B +ATOM 2408 N THR B 7 12.254 31.650 18.679 1.00 0.14 B +ATOM 2409 CA THR B 7 12.522 32.005 20.094 1.00 0.14 B +ATOM 2410 C THR B 7 13.772 31.253 20.603 1.00 0.14 B +ATOM 2411 O THR B 7 13.934 30.061 20.388 1.00 0.15 B +ATOM 2412 CB THR B 7 11.352 31.602 20.995 1.00 0.16 B +ATOM 2413 OG1 THR B 7 10.195 32.281 20.512 1.00 0.16 B +ATOM 2414 CG2 THR B 7 11.634 32.021 22.451 1.00 0.17 B +ATOM 2415 H THR B 7 11.736 30.852 18.488 1.00 0.14 B +ATOM 2416 HA THR B 7 12.661 33.066 20.166 1.00 0.14 B +ATOM 2417 HB THR B 7 11.195 30.533 20.944 1.00 0.16 B +ATOM 2418 HG1 THR B 7 9.859 32.844 21.213 1.00 0.17 B +ATOM 2419 1HG2 THR B 7 11.964 33.049 22.474 1.00 0.16 B +ATOM 2420 2HG2 THR B 7 12.406 31.389 22.872 1.00 0.17 B +ATOM 2421 3HG2 THR B 7 10.732 31.921 23.039 1.00 0.18 B +ATOM 2422 N ILE B 8 14.612 31.953 21.315 1.00 0.14 B +ATOM 2423 CA ILE B 8 15.832 31.383 21.916 1.00 0.14 B +ATOM 2424 C ILE B 8 15.367 30.802 23.254 1.00 0.16 B +ATOM 2425 O ILE B 8 14.911 31.511 24.138 1.00 0.16 B +ATOM 2426 CB ILE B 8 16.933 32.467 22.134 1.00 0.14 B +ATOM 2427 CG1 ILE B 8 17.465 32.868 20.746 1.00 0.12 B +ATOM 2428 CG2 ILE B 8 18.059 31.908 23.010 1.00 0.14 B +ATOM 2429 CD1 ILE B 8 18.523 33.974 20.835 1.00 0.12 B +ATOM 2430 H ILE B 8 14.409 32.880 21.482 1.00 0.14 B +ATOM 2431 HA ILE B 8 16.219 30.613 21.257 1.00 0.14 B +ATOM 2432 HB ILE B 8 16.503 33.329 22.621 1.00 0.14 B +ATOM 2433 1HG1 ILE B 8 17.902 32.002 20.273 1.00 0.12 B +ATOM 2434 2HG1 ILE B 8 16.639 33.220 20.146 1.00 0.12 B +ATOM 2435 1HG2 ILE B 8 18.860 32.631 23.064 1.00 0.14 B +ATOM 2436 2HG2 ILE B 8 18.430 30.986 22.594 1.00 0.14 B +ATOM 2437 3HG2 ILE B 8 17.678 31.721 23.996 1.00 0.15 B +ATOM 2438 1HD1 ILE B 8 18.998 34.086 19.869 1.00 0.11 B +ATOM 2439 2HD1 ILE B 8 19.268 33.711 21.570 1.00 0.12 B +ATOM 2440 3HD1 ILE B 8 18.053 34.905 21.111 1.00 0.12 B +ATOM 2441 N THR B 9 15.440 29.516 23.363 1.00 0.17 B +ATOM 2442 CA THR B 9 14.993 28.768 24.601 1.00 0.18 B +ATOM 2443 C THR B 9 16.152 28.218 25.476 1.00 0.19 B +ATOM 2444 O THR B 9 15.887 27.673 26.531 1.00 0.21 B +ATOM 2445 CB THR B 9 14.055 27.572 24.219 1.00 0.19 B +ATOM 2446 OG1 THR B 9 14.754 26.720 23.298 1.00 0.19 B +ATOM 2447 CG2 THR B 9 12.748 28.127 23.633 1.00 0.19 B +ATOM 2448 H THR B 9 15.779 29.020 22.604 1.00 0.16 B +ATOM 2449 HA THR B 9 14.457 29.446 25.229 1.00 0.19 B +ATOM 2450 HB THR B 9 13.818 27.008 25.113 1.00 0.21 B +ATOM 2451 HG1 THR B 9 14.133 26.349 22.674 1.00 0.19 B +ATOM 2452 1HG2 THR B 9 12.345 28.867 24.315 1.00 0.19 B +ATOM 2453 2HG2 THR B 9 12.030 27.329 23.515 1.00 0.20 B +ATOM 2454 3HG2 THR B 9 12.941 28.589 22.678 1.00 0.18 B +ATOM 2455 N ALA B 10 17.396 28.348 25.084 1.00 0.18 B +ATOM 2456 CA ALA B 10 18.534 27.840 25.896 1.00 0.19 B +ATOM 2457 C ALA B 10 18.738 28.706 27.151 1.00 0.20 B +ATOM 2458 O ALA B 10 18.656 29.907 27.052 1.00 0.19 B +ATOM 2459 CB ALA B 10 19.777 27.935 25.015 1.00 0.18 B +ATOM 2460 H ALA B 10 17.586 28.787 24.237 1.00 0.17 B +ATOM 2461 HA ALA B 10 18.359 26.819 26.164 1.00 0.20 B +ATOM 2462 1HB ALA B 10 19.522 27.647 24.011 1.00 0.18 B +ATOM 2463 2HB ALA B 10 20.543 27.277 25.395 1.00 0.19 B +ATOM 2464 3HB ALA B 10 20.144 28.952 25.010 1.00 0.18 B +ATOM 2465 N PRO B 11 19.025 28.117 28.314 1.00 0.21 B +ATOM 2466 CA PRO B 11 19.258 28.881 29.580 1.00 0.22 B +ATOM 2467 C PRO B 11 20.163 30.070 29.501 1.00 0.21 B +ATOM 2468 O PRO B 11 19.811 31.108 30.043 1.00 0.22 B +ATOM 2469 CB PRO B 11 19.774 27.791 30.541 1.00 0.24 B +ATOM 2470 CG PRO B 11 19.132 26.521 30.048 1.00 0.24 B +ATOM 2471 CD PRO B 11 19.132 26.630 28.515 1.00 0.23 B +ATOM 2472 HA PRO B 11 18.338 29.263 29.943 1.00 0.23 B +ATOM 2473 1HB PRO B 11 20.853 27.711 30.481 1.00 0.24 B +ATOM 2474 2HB PRO B 11 19.467 27.996 31.555 1.00 0.25 B +ATOM 2475 1HG PRO B 11 19.689 25.658 30.378 1.00 0.25 B +ATOM 2476 2HG PRO B 11 18.112 26.469 30.406 1.00 0.25 B +ATOM 2477 1HD PRO B 11 20.060 26.249 28.109 1.00 0.23 B +ATOM 2478 2HD PRO B 11 18.282 26.121 28.108 1.00 0.23 B +ATOM 2479 N ASN B 12 21.283 30.019 28.867 1.00 0.21 B +ATOM 2480 CA ASN B 12 22.086 31.288 28.855 1.00 0.20 B +ATOM 2481 C ASN B 12 21.915 31.914 27.477 1.00 0.19 B +ATOM 2482 O ASN B 12 22.793 32.599 26.989 1.00 0.18 B +ATOM 2483 CB ASN B 12 23.556 30.981 29.187 1.00 0.21 B +ATOM 2484 CG ASN B 12 23.659 30.470 30.625 1.00 0.30 B +ATOM 2485 OD1 ASN B 12 22.751 30.650 31.413 1.00 1.08 B +ATOM 2486 ND2 ASN B 12 24.735 29.836 31.004 1.00 0.68 B +ATOM 2487 H ASN B 12 21.587 29.197 28.402 1.00 0.21 B +ATOM 2488 HA ASN B 12 21.696 31.988 29.598 1.00 0.21 B +ATOM 2489 1HB ASN B 12 23.928 30.227 28.508 1.00 0.26 B +ATOM 2490 2HB ASN B 12 24.144 31.881 29.083 1.00 0.25 B +ATOM 2491 1HD2 ASN B 12 25.467 29.691 30.369 1.00 1.34 B +ATOM 2492 2HD2 ASN B 12 24.811 29.504 31.923 1.00 0.66 B +ATOM 2493 N GLY B 13 20.778 31.687 26.819 1.00 0.18 B +ATOM 2494 CA GLY B 13 20.626 32.301 25.471 1.00 0.16 B +ATOM 2495 C GLY B 13 21.721 31.822 24.526 1.00 0.16 B +ATOM 2496 O GLY B 13 22.197 30.695 24.605 1.00 0.16 B +ATOM 2497 H GLY B 13 20.057 31.124 27.203 1.00 0.19 B +ATOM 2498 1HA GLY B 13 19.675 32.025 25.055 1.00 0.16 B +ATOM 2499 2HA GLY B 13 20.686 33.369 25.553 1.00 0.16 B +ATOM 2500 N LEU B 14 22.117 32.662 23.597 1.00 0.14 B +ATOM 2501 CA LEU B 14 23.141 32.209 22.632 1.00 0.14 B +ATOM 2502 C LEU B 14 24.516 32.470 23.213 1.00 0.15 B +ATOM 2503 O LEU B 14 25.190 33.391 22.800 1.00 0.14 B +ATOM 2504 CB LEU B 14 22.910 32.956 21.312 1.00 0.12 B +ATOM 2505 CG LEU B 14 23.721 32.365 20.155 1.00 0.12 B +ATOM 2506 CD1 LEU B 14 23.130 31.034 19.682 1.00 0.12 B +ATOM 2507 CD2 LEU B 14 23.675 33.366 18.999 1.00 0.11 B +ATOM 2508 H LEU B 14 21.722 33.566 23.530 1.00 0.14 B +ATOM 2509 HA LEU B 14 23.039 31.153 22.470 1.00 0.14 B +ATOM 2510 1HB LEU B 14 21.861 32.906 21.062 1.00 0.12 B +ATOM 2511 2HB LEU B 14 23.189 33.991 21.447 1.00 0.12 B +ATOM 2512 HG LEU B 14 24.732 32.210 20.465 1.00 0.13 B +ATOM 2513 1HD1 LEU B 14 22.069 31.143 19.532 1.00 0.12 B +ATOM 2514 2HD1 LEU B 14 23.315 30.268 20.417 1.00 0.13 B +ATOM 2515 3HD1 LEU B 14 23.596 30.749 18.750 1.00 0.12 B +ATOM 2516 1HD2 LEU B 14 22.652 33.685 18.845 1.00 0.10 B +ATOM 2517 2HD2 LEU B 14 24.045 32.903 18.098 1.00 0.11 B +ATOM 2518 3HD2 LEU B 14 24.283 34.224 19.243 1.00 0.11 B +ATOM 2519 N HIS B 15 24.940 31.677 24.190 1.00 0.16 B +ATOM 2520 CA HIS B 15 26.285 31.936 24.792 1.00 0.17 B +ATOM 2521 C HIS B 15 27.427 31.625 23.834 1.00 0.17 B +ATOM 2522 O HIS B 15 27.237 31.345 22.669 1.00 0.16 B +ATOM 2523 CB HIS B 15 26.427 31.192 26.135 1.00 0.18 B +ATOM 2524 CG HIS B 15 26.055 29.743 25.976 1.00 0.37 B +ATOM 2525 ND1 HIS B 15 27.006 28.735 25.967 1.00 0.57 B +ATOM 2526 CD2 HIS B 15 24.842 29.115 25.848 1.00 0.59 B +ATOM 2527 CE1 HIS B 15 26.356 27.565 25.840 1.00 0.79 B +ATOM 2528 NE2 HIS B 15 25.034 27.739 25.762 1.00 0.81 B +ATOM 2529 H HIS B 15 24.375 30.941 24.532 1.00 0.16 B +ATOM 2530 HA HIS B 15 26.378 32.991 24.969 1.00 0.17 B +ATOM 2531 1HB HIS B 15 27.449 31.261 26.475 1.00 0.30 B +ATOM 2532 2HB HIS B 15 25.777 31.650 26.866 1.00 0.29 B +ATOM 2533 HD2 HIS B 15 23.884 29.611 25.823 1.00 0.67 B +ATOM 2534 HE1 HIS B 15 26.843 26.602 25.805 1.00 0.98 B +ATOM 2535 N THR B 16 28.623 31.796 24.323 1.00 0.18 B +ATOM 2536 CA THR B 16 29.847 31.650 23.470 1.00 0.18 B +ATOM 2537 C THR B 16 29.988 30.408 22.588 1.00 0.18 B +ATOM 2538 O THR B 16 30.137 30.563 21.388 1.00 0.17 B +ATOM 2539 CB THR B 16 31.127 31.844 24.346 1.00 0.19 B +ATOM 2540 OG1 THR B 16 30.907 32.899 25.272 1.00 0.21 B +ATOM 2541 CG2 THR B 16 32.318 32.197 23.452 1.00 0.19 B +ATOM 2542 H THR B 16 28.718 32.099 25.256 1.00 0.18 B +ATOM 2543 HA THR B 16 29.815 32.423 22.743 1.00 0.17 B +ATOM 2544 HB THR B 16 31.339 30.931 24.882 1.00 0.21 B +ATOM 2545 HG1 THR B 16 30.625 32.510 26.103 1.00 0.92 B +ATOM 2546 1HG2 THR B 16 32.279 31.615 22.543 1.00 1.05 B +ATOM 2547 2HG2 THR B 16 33.233 31.978 23.975 1.00 1.01 B +ATOM 2548 3HG2 THR B 16 32.286 33.248 23.208 1.00 1.01 B +ATOM 2549 N ARG B 17 30.014 29.219 23.068 1.00 0.19 B +ATOM 2550 CA ARG B 17 30.233 28.107 22.095 1.00 0.19 B +ATOM 2551 C ARG B 17 29.093 27.973 21.065 1.00 0.18 B +ATOM 2552 O ARG B 17 29.372 27.809 19.894 1.00 0.18 B +ATOM 2553 CB ARG B 17 30.550 26.827 22.900 1.00 0.20 B +ATOM 2554 CG ARG B 17 30.285 25.575 22.050 1.00 0.33 B +ATOM 2555 CD ARG B 17 30.674 24.322 22.839 1.00 0.26 B +ATOM 2556 NE ARG B 17 32.034 24.494 23.422 1.00 0.71 B +ATOM 2557 CZ ARG B 17 32.439 23.695 24.372 1.00 0.68 B +ATOM 2558 NH1 ARG B 17 31.654 22.749 24.808 1.00 1.24 B +ATOM 2559 NH2 ARG B 17 33.630 23.843 24.884 1.00 1.12 B +ATOM 2560 H ARG B 17 29.931 29.045 24.033 1.00 0.19 B +ATOM 2561 HA ARG B 17 31.087 28.352 21.481 1.00 0.19 B +ATOM 2562 1HB ARG B 17 31.591 26.843 23.191 1.00 0.33 B +ATOM 2563 2HB ARG B 17 29.939 26.794 23.787 1.00 0.29 B +ATOM 2564 1HG ARG B 17 29.235 25.521 21.801 1.00 0.61 B +ATOM 2565 2HG ARG B 17 30.869 25.623 21.144 1.00 0.58 B +ATOM 2566 1HD ARG B 17 29.960 24.163 23.634 1.00 0.62 B +ATOM 2567 2HD ARG B 17 30.672 23.467 22.179 1.00 0.38 B +ATOM 2568 HE ARG B 17 32.622 25.204 23.094 1.00 1.44 B +ATOM 2569 1HH1 ARG B 17 30.741 22.636 24.416 1.00 1.48 B +ATOM 2570 2HH1 ARG B 17 31.964 22.137 25.536 1.00 1.73 B +ATOM 2571 1HH2 ARG B 17 34.231 24.567 24.549 1.00 1.66 B +ATOM 2572 2HH2 ARG B 17 33.941 23.231 25.612 1.00 1.25 B +ATOM 2573 N PRO B 18 27.850 28.042 21.427 1.00 0.17 B +ATOM 2574 CA PRO B 18 26.784 27.922 20.414 1.00 0.16 B +ATOM 2575 C PRO B 18 26.758 29.130 19.461 1.00 0.15 B +ATOM 2576 O PRO B 18 26.369 29.011 18.316 1.00 0.14 B +ATOM 2577 CB PRO B 18 25.517 27.772 21.274 1.00 0.16 B +ATOM 2578 CG PRO B 18 25.871 28.154 22.721 1.00 0.18 B +ATOM 2579 CD PRO B 18 27.406 28.206 22.842 1.00 0.18 B +ATOM 2580 HA PRO B 18 26.938 27.035 19.827 1.00 0.17 B +ATOM 2581 1HB PRO B 18 24.738 28.425 20.897 1.00 0.15 B +ATOM 2582 2HB PRO B 18 25.171 26.746 21.244 1.00 0.18 B +ATOM 2583 1HG PRO B 18 25.449 29.125 22.957 1.00 0.19 B +ATOM 2584 2HG PRO B 18 25.476 27.415 23.404 1.00 0.22 B +ATOM 2585 1HD PRO B 18 27.721 29.149 23.247 1.00 0.17 B +ATOM 2586 2HD PRO B 18 27.768 27.390 23.443 1.00 0.20 B +ATOM 2587 N ALA B 19 27.171 30.284 19.911 1.00 0.14 B +ATOM 2588 CA ALA B 19 27.165 31.484 18.997 1.00 0.13 B +ATOM 2589 C ALA B 19 28.248 31.292 17.915 1.00 0.14 B +ATOM 2590 O ALA B 19 28.065 31.651 16.766 1.00 0.13 B +ATOM 2591 CB ALA B 19 27.330 32.766 19.838 1.00 0.13 B +ATOM 2592 H ALA B 19 27.471 30.370 20.843 1.00 0.15 B +ATOM 2593 HA ALA B 19 26.230 31.529 18.468 1.00 0.12 B +ATOM 2594 1HB ALA B 19 26.901 33.604 19.309 1.00 0.13 B +ATOM 2595 2HB ALA B 19 28.376 32.949 20.018 1.00 0.14 B +ATOM 2596 3HB ALA B 19 26.829 32.645 20.783 1.00 0.14 B +ATOM 2597 N ALA B 20 29.351 30.688 18.258 1.00 0.15 B +ATOM 2598 CA ALA B 20 30.425 30.414 17.262 1.00 0.15 B +ATOM 2599 C ALA B 20 29.951 29.302 16.314 1.00 0.15 B +ATOM 2600 O ALA B 20 30.199 29.337 15.119 1.00 0.15 B +ATOM 2601 CB ALA B 20 31.695 29.900 17.957 1.00 0.17 B +ATOM 2602 H ALA B 20 29.474 30.397 19.174 1.00 0.15 B +ATOM 2603 HA ALA B 20 30.650 31.325 16.720 1.00 0.15 B +ATOM 2604 1HB ALA B 20 32.466 29.778 17.215 1.00 0.17 B +ATOM 2605 2HB ALA B 20 31.492 28.945 18.420 1.00 0.18 B +ATOM 2606 3HB ALA B 20 32.015 30.607 18.707 1.00 0.18 B +ATOM 2607 N GLN B 21 29.265 28.295 16.836 1.00 0.16 B +ATOM 2608 CA GLN B 21 28.781 27.215 15.913 1.00 0.16 B +ATOM 2609 C GLN B 21 27.687 27.812 14.974 1.00 0.15 B +ATOM 2610 O GLN B 21 27.585 27.443 13.820 1.00 0.15 B +ATOM 2611 CB GLN B 21 28.198 26.016 16.676 1.00 0.17 B +ATOM 2612 CG GLN B 21 29.303 25.378 17.521 1.00 0.18 B +ATOM 2613 CD GLN B 21 28.721 24.242 18.364 1.00 1.15 B +ATOM 2614 OE1 GLN B 21 27.522 24.047 18.398 1.00 1.74 B +ATOM 2615 NE2 GLN B 21 29.527 23.482 19.054 1.00 1.63 B +ATOM 2616 H GLN B 21 29.059 28.269 17.801 1.00 0.16 B +ATOM 2617 HA GLN B 21 29.623 26.873 15.324 1.00 0.17 B +ATOM 2618 1HB GLN B 21 27.397 26.352 17.319 1.00 0.17 B +ATOM 2619 2HB GLN B 21 27.818 25.290 15.973 1.00 0.17 B +ATOM 2620 1HG GLN B 21 30.071 24.985 16.870 1.00 0.85 B +ATOM 2621 2HG GLN B 21 29.731 26.123 18.174 1.00 0.87 B +ATOM 2622 1HE2 GLN B 21 30.493 23.643 19.027 1.00 1.40 B +ATOM 2623 2HE2 GLN B 21 29.167 22.754 19.601 1.00 2.35 B +ATOM 2624 N PHE B 22 26.857 28.725 15.477 1.00 0.13 B +ATOM 2625 CA PHE B 22 25.774 29.334 14.662 1.00 0.12 B +ATOM 2626 C PHE B 22 26.409 30.135 13.525 1.00 0.12 B +ATOM 2627 O PHE B 22 26.008 30.066 12.374 1.00 0.12 B +ATOM 2628 CB PHE B 22 24.915 30.243 15.585 1.00 0.11 B +ATOM 2629 CG PHE B 22 23.824 30.953 14.793 1.00 0.10 B +ATOM 2630 CD1 PHE B 22 22.607 30.306 14.573 1.00 0.10 B +ATOM 2631 CD2 PHE B 22 24.022 32.249 14.290 1.00 0.09 B +ATOM 2632 CE1 PHE B 22 21.581 30.936 13.859 1.00 0.09 B +ATOM 2633 CE2 PHE B 22 23.000 32.883 13.574 1.00 0.09 B +ATOM 2634 CZ PHE B 22 21.780 32.230 13.358 1.00 0.09 B +ATOM 2635 H PHE B 22 26.949 28.994 16.408 1.00 0.13 B +ATOM 2636 HA PHE B 22 25.162 28.555 14.248 1.00 0.12 B +ATOM 2637 1HB PHE B 22 24.448 29.628 16.343 1.00 0.12 B +ATOM 2638 2HB PHE B 22 25.549 30.973 16.063 1.00 0.11 B +ATOM 2639 HD1 PHE B 22 22.458 29.319 14.965 1.00 0.11 B +ATOM 2640 HD2 PHE B 22 24.958 32.760 14.454 1.00 0.10 B +ATOM 2641 HE1 PHE B 22 20.643 30.419 13.688 1.00 0.09 B +ATOM 2642 HE2 PHE B 22 23.154 33.877 13.189 1.00 0.09 B +ATOM 2643 HZ PHE B 22 20.991 32.729 12.815 1.00 0.08 B +ATOM 2644 N VAL B 23 27.414 30.881 13.868 1.00 0.12 B +ATOM 2645 CA VAL B 23 28.163 31.727 12.878 1.00 0.13 B +ATOM 2646 C VAL B 23 28.871 30.846 11.846 1.00 0.14 B +ATOM 2647 O VAL B 23 28.889 31.155 10.671 1.00 0.14 B +ATOM 2648 CB VAL B 23 29.165 32.675 13.609 1.00 0.13 B +ATOM 2649 CG1 VAL B 23 30.066 33.360 12.581 1.00 0.14 B +ATOM 2650 CG2 VAL B 23 28.383 33.737 14.387 1.00 0.12 B +ATOM 2651 H VAL B 23 27.689 30.889 14.801 1.00 0.12 B +ATOM 2652 HA VAL B 23 27.460 32.317 12.333 1.00 0.12 B +ATOM 2653 HB VAL B 23 29.773 32.098 14.292 1.00 0.14 B +ATOM 2654 1HG1 VAL B 23 30.793 32.651 12.212 1.00 1.01 B +ATOM 2655 2HG1 VAL B 23 30.578 34.190 13.046 1.00 1.05 B +ATOM 2656 3HG1 VAL B 23 29.466 33.721 11.759 1.00 1.01 B +ATOM 2657 1HG2 VAL B 23 29.064 34.307 15.001 1.00 1.03 B +ATOM 2658 2HG2 VAL B 23 27.649 33.255 15.015 1.00 1.03 B +ATOM 2659 3HG2 VAL B 23 27.885 34.397 13.693 1.00 1.01 B +ATOM 2660 N LYS B 24 29.442 29.760 12.254 1.00 0.14 B +ATOM 2661 CA LYS B 24 30.128 28.876 11.284 1.00 0.16 B +ATOM 2662 C LYS B 24 29.110 28.303 10.301 1.00 0.16 B +ATOM 2663 O LYS B 24 29.356 28.205 9.115 1.00 0.16 B +ATOM 2664 CB LYS B 24 30.816 27.705 12.019 1.00 0.17 B +ATOM 2665 CG LYS B 24 31.759 26.971 11.064 1.00 0.22 B +ATOM 2666 CD LYS B 24 32.338 25.741 11.767 1.00 1.00 B +ATOM 2667 CE LYS B 24 33.397 25.092 10.873 1.00 1.18 B +ATOM 2668 NZ LYS B 24 34.165 24.088 11.662 1.00 1.22 B +ATOM 2669 H LYS B 24 29.421 29.524 13.199 1.00 0.14 B +ATOM 2670 HA LYS B 24 30.860 29.453 10.749 1.00 0.16 B +ATOM 2671 1HB LYS B 24 31.381 28.090 12.856 1.00 0.17 B +ATOM 2672 2HB LYS B 24 30.065 27.017 12.379 1.00 0.20 B +ATOM 2673 1HG LYS B 24 31.215 26.663 10.184 1.00 0.78 B +ATOM 2674 2HG LYS B 24 32.566 27.630 10.780 1.00 0.75 B +ATOM 2675 1HD LYS B 24 32.789 26.040 12.702 1.00 1.57 B +ATOM 2676 2HD LYS B 24 31.548 25.030 11.959 1.00 1.59 B +ATOM 2677 1HE LYS B 24 32.914 24.602 10.040 1.00 1.54 B +ATOM 2678 2HE LYS B 24 34.070 25.851 10.503 1.00 1.52 B +ATOM 2679 1HZ LYS B 24 34.907 23.672 11.065 1.00 1.64 B +ATOM 2680 2HZ LYS B 24 33.521 23.339 11.990 1.00 1.60 B +ATOM 2681 3HZ LYS B 24 34.603 24.553 12.482 1.00 1.57 B +ATOM 2682 N GLU B 25 27.967 27.925 10.793 1.00 0.15 B +ATOM 2683 CA GLU B 25 26.935 27.366 9.923 1.00 0.15 B +ATOM 2684 C GLU B 25 26.401 28.483 8.984 1.00 0.14 B +ATOM 2685 O GLU B 25 26.151 28.248 7.814 1.00 0.15 B +ATOM 2686 CB GLU B 25 25.784 26.772 10.757 1.00 0.15 B +ATOM 2687 CG GLU B 25 24.806 26.202 9.673 1.00 0.15 B +ATOM 2688 CD GLU B 25 23.664 25.269 10.101 1.00 0.15 B +ATOM 2689 OE1 GLU B 25 23.922 24.167 10.558 1.00 0.17 B +ATOM 2690 OE2 GLU B 25 22.530 25.643 9.835 1.00 0.15 B +ATOM 2691 H GLU B 25 27.793 28.028 11.745 1.00 0.14 B +ATOM 2692 HA GLU B 25 27.374 26.572 9.324 1.00 0.16 B +ATOM 2693 1HB GLU B 25 26.159 25.993 11.412 1.00 0.15 B +ATOM 2694 2HB GLU B 25 25.300 27.549 11.330 1.00 0.14 B +ATOM 2695 1HG GLU B 25 24.339 27.038 9.223 1.00 0.14 B +ATOM 2696 2HG GLU B 25 25.385 25.685 8.923 1.00 0.16 B +ATOM 2697 N ALA B 26 26.220 29.697 9.489 1.00 0.13 B +ATOM 2698 CA ALA B 26 25.732 30.817 8.634 1.00 0.13 B +ATOM 2699 C ALA B 26 26.725 31.042 7.472 1.00 0.14 B +ATOM 2700 O ALA B 26 26.325 31.226 6.336 1.00 0.14 B +ATOM 2701 CB ALA B 26 25.578 32.038 9.553 1.00 0.12 B +ATOM 2702 H ALA B 26 26.406 29.865 10.438 1.00 0.13 B +ATOM 2703 HA ALA B 26 24.783 30.566 8.196 1.00 0.12 B +ATOM 2704 1HB ALA B 26 25.139 32.856 9.003 1.00 0.12 B +ATOM 2705 2HB ALA B 26 26.546 32.332 9.931 1.00 0.12 B +ATOM 2706 3HB ALA B 26 24.935 31.777 10.384 1.00 0.11 B +ATOM 2707 N LYS B 27 28.003 31.002 7.740 1.00 0.15 B +ATOM 2708 CA LYS B 27 29.025 31.172 6.664 1.00 0.16 B +ATOM 2709 C LYS B 27 28.964 30.053 5.591 1.00 0.17 B +ATOM 2710 O LYS B 27 29.543 30.193 4.532 1.00 0.18 B +ATOM 2711 CB LYS B 27 30.439 31.179 7.273 1.00 0.17 B +ATOM 2712 CG LYS B 27 30.661 32.476 8.045 1.00 0.17 B +ATOM 2713 CD LYS B 27 32.090 32.508 8.592 1.00 0.29 B +ATOM 2714 CE LYS B 27 32.294 33.780 9.416 1.00 1.15 B +ATOM 2715 NZ LYS B 27 33.748 33.972 9.681 1.00 1.43 B +ATOM 2716 H LYS B 27 28.297 30.859 8.659 1.00 0.14 B +ATOM 2717 HA LYS B 27 28.850 32.108 6.172 1.00 0.16 B +ATOM 2718 1HB LYS B 27 30.545 30.339 7.944 1.00 0.17 B +ATOM 2719 2HB LYS B 27 31.172 31.103 6.484 1.00 0.18 B +ATOM 2720 1HG LYS B 27 30.514 33.312 7.380 1.00 0.20 B +ATOM 2721 2HG LYS B 27 29.961 32.536 8.864 1.00 0.19 B +ATOM 2722 1HD LYS B 27 32.255 31.642 9.218 1.00 1.05 B +ATOM 2723 2HD LYS B 27 32.790 32.497 7.771 1.00 1.10 B +ATOM 2724 1HE LYS B 27 31.914 34.629 8.867 1.00 1.87 B +ATOM 2725 2HE LYS B 27 31.766 33.692 10.353 1.00 1.89 B +ATOM 2726 1HZ LYS B 27 34.216 34.313 8.817 1.00 1.77 B +ATOM 2727 2HZ LYS B 27 34.170 33.066 9.970 1.00 1.93 B +ATOM 2728 3HZ LYS B 27 33.874 34.672 10.439 1.00 1.86 B +ATOM 2729 N GLY B 28 28.298 28.954 5.833 1.00 0.17 B +ATOM 2730 CA GLY B 28 28.247 27.878 4.820 1.00 0.18 B +ATOM 2731 C GLY B 28 27.236 28.260 3.747 1.00 0.18 B +ATOM 2732 O GLY B 28 27.195 27.620 2.705 1.00 0.19 B +ATOM 2733 H GLY B 28 27.828 28.837 6.676 1.00 0.16 B +ATOM 2734 1HA GLY B 28 29.227 27.753 4.373 1.00 0.19 B +ATOM 2735 2HA GLY B 28 27.950 26.952 5.291 1.00 0.18 B +ATOM 2736 N PHE B 29 26.417 29.311 3.971 1.00 0.17 B +ATOM 2737 CA PHE B 29 25.427 29.698 2.904 1.00 0.17 B +ATOM 2738 C PHE B 29 25.909 30.940 2.170 1.00 0.18 B +ATOM 2739 O PHE B 29 26.508 31.824 2.751 1.00 0.17 B +ATOM 2740 CB PHE B 29 24.040 30.004 3.472 1.00 0.16 B +ATOM 2741 CG PHE B 29 23.528 28.823 4.245 1.00 0.16 B +ATOM 2742 CD1 PHE B 29 22.870 27.795 3.579 1.00 0.17 B +ATOM 2743 CD2 PHE B 29 23.700 28.763 5.631 1.00 0.15 B +ATOM 2744 CE1 PHE B 29 22.380 26.711 4.299 1.00 0.17 B +ATOM 2745 CE2 PHE B 29 23.202 27.670 6.344 1.00 0.15 B +ATOM 2746 CZ PHE B 29 22.540 26.648 5.673 1.00 0.16 B +ATOM 2747 H PHE B 29 26.473 29.821 4.816 1.00 0.16 B +ATOM 2748 HA PHE B 29 25.346 28.888 2.198 1.00 0.18 B +ATOM 2749 1HB PHE B 29 24.098 30.857 4.118 1.00 0.15 B +ATOM 2750 2HB PHE B 29 23.361 30.216 2.657 1.00 0.16 B +ATOM 2751 HD1 PHE B 29 22.735 27.841 2.509 1.00 0.17 B +ATOM 2752 HD2 PHE B 29 24.223 29.555 6.148 1.00 0.14 B +ATOM 2753 HE1 PHE B 29 21.885 25.926 3.801 1.00 0.18 B +ATOM 2754 HE2 PHE B 29 23.315 27.623 7.406 1.00 0.14 B +ATOM 2755 HZ PHE B 29 22.152 25.803 6.218 1.00 0.16 B +ATOM 2756 N THR B 30 25.639 31.014 0.891 1.00 0.19 B +ATOM 2757 CA THR B 30 26.088 32.208 0.095 1.00 0.20 B +ATOM 2758 C THR B 30 25.208 33.435 0.335 1.00 0.19 B +ATOM 2759 O THR B 30 25.709 34.541 0.234 1.00 0.20 B +ATOM 2760 CB THR B 30 26.214 31.842 -1.408 1.00 0.21 B +ATOM 2761 OG1 THR B 30 24.948 31.381 -1.876 1.00 0.21 B +ATOM 2762 CG2 THR B 30 27.288 30.751 -1.524 1.00 0.22 B +ATOM 2763 H THR B 30 25.139 30.290 0.453 1.00 0.19 B +ATOM 2764 HA THR B 30 27.054 32.506 0.454 1.00 0.20 B +ATOM 2765 HB THR B 30 26.523 32.709 -1.974 1.00 0.22 B +ATOM 2766 HG1 THR B 30 25.081 30.896 -2.691 1.00 0.22 B +ATOM 2767 1HG2 THR B 30 27.449 30.497 -2.559 1.00 0.23 B +ATOM 2768 2HG2 THR B 30 26.970 29.874 -0.979 1.00 0.21 B +ATOM 2769 3HG2 THR B 30 28.213 31.118 -1.095 1.00 0.22 B +ATOM 2770 N SER B 31 23.938 33.295 0.663 1.00 0.18 B +ATOM 2771 CA SER B 31 23.129 34.514 0.905 1.00 0.18 B +ATOM 2772 C SER B 31 23.653 35.426 2.024 1.00 0.17 B +ATOM 2773 O SER B 31 24.285 35.015 2.986 1.00 0.16 B +ATOM 2774 CB SER B 31 21.708 34.178 1.365 1.00 0.17 B +ATOM 2775 OG SER B 31 21.088 33.306 0.448 1.00 0.18 B +ATOM 2776 H SER B 31 23.526 32.406 0.737 1.00 0.18 B +ATOM 2777 HA SER B 31 23.077 35.069 -0.001 1.00 0.19 B +ATOM 2778 1HB SER B 31 21.743 33.708 2.335 1.00 0.16 B +ATOM 2779 2HB SER B 31 21.140 35.099 1.441 1.00 0.17 B +ATOM 2780 HG SER B 31 21.474 32.440 0.566 1.00 0.18 B +ATOM 2781 N GLU B 32 23.243 36.670 1.927 1.00 0.18 B +ATOM 2782 CA GLU B 32 23.502 37.653 2.993 1.00 0.17 B +ATOM 2783 C GLU B 32 22.415 37.310 4.024 1.00 0.16 B +ATOM 2784 O GLU B 32 21.256 37.149 3.681 1.00 0.16 B +ATOM 2785 CB GLU B 32 23.539 39.120 2.481 1.00 0.19 B +ATOM 2786 CG GLU B 32 22.431 40.155 2.865 1.00 0.19 B +ATOM 2787 CD GLU B 32 21.765 40.086 4.244 1.00 0.17 B +ATOM 2788 OE1 GLU B 32 22.335 40.606 5.194 1.00 0.17 B +ATOM 2789 OE2 GLU B 32 20.628 39.640 4.295 1.00 0.17 B +ATOM 2790 H GLU B 32 22.693 36.915 1.169 1.00 0.18 B +ATOM 2791 HA GLU B 32 24.468 37.421 3.403 1.00 0.17 B +ATOM 2792 1HB GLU B 32 24.481 39.543 2.791 1.00 0.19 B +ATOM 2793 2HB GLU B 32 23.558 39.063 1.400 1.00 0.20 B +ATOM 2794 1HG GLU B 32 22.895 41.126 2.809 1.00 0.20 B +ATOM 2795 2HG GLU B 32 21.665 40.108 2.116 1.00 0.19 B +ATOM 2796 N ILE B 33 22.793 37.117 5.264 1.00 0.15 B +ATOM 2797 CA ILE B 33 21.850 36.689 6.323 1.00 0.13 B +ATOM 2798 C ILE B 33 21.944 37.682 7.472 1.00 0.13 B +ATOM 2799 O ILE B 33 23.028 38.053 7.895 1.00 0.13 B +ATOM 2800 CB ILE B 33 22.268 35.280 6.837 1.00 0.12 B +ATOM 2801 CG1 ILE B 33 22.324 34.284 5.646 1.00 0.13 B +ATOM 2802 CG2 ILE B 33 21.304 34.821 7.949 1.00 0.11 B +ATOM 2803 CD1 ILE B 33 23.170 33.032 5.968 1.00 0.13 B +ATOM 2804 H ILE B 33 23.725 37.244 5.501 1.00 0.15 B +ATOM 2805 HA ILE B 33 20.845 36.660 5.933 1.00 0.13 B +ATOM 2806 HB ILE B 33 23.251 35.363 7.276 1.00 0.12 B +ATOM 2807 1HG1 ILE B 33 21.328 33.974 5.386 1.00 0.13 B +ATOM 2808 2HG1 ILE B 33 22.769 34.783 4.796 1.00 0.14 B +ATOM 2809 1HG2 ILE B 33 21.433 35.464 8.813 1.00 0.11 B +ATOM 2810 2HG2 ILE B 33 21.527 33.803 8.232 1.00 0.11 B +ATOM 2811 3HG2 ILE B 33 20.283 34.888 7.608 1.00 0.11 B +ATOM 2812 1HD1 ILE B 33 22.519 32.187 6.126 1.00 0.13 B +ATOM 2813 2HD1 ILE B 33 23.771 33.190 6.848 1.00 0.12 B +ATOM 2814 3HD1 ILE B 33 23.819 32.827 5.130 1.00 0.14 B +ATOM 2815 N THR B 34 20.811 38.104 7.967 1.00 0.13 B +ATOM 2816 CA THR B 34 20.755 39.073 9.082 1.00 0.13 B +ATOM 2817 C THR B 34 19.921 38.481 10.224 1.00 0.12 B +ATOM 2818 O THR B 34 18.876 37.883 10.024 1.00 0.11 B +ATOM 2819 CB THR B 34 20.068 40.412 8.589 1.00 0.14 B +ATOM 2820 OG1 THR B 34 20.865 40.935 7.536 1.00 0.16 B +ATOM 2821 CG2 THR B 34 19.893 41.530 9.645 1.00 0.15 B +ATOM 2822 H THR B 34 19.983 37.773 7.581 1.00 0.13 B +ATOM 2823 HA THR B 34 21.762 39.282 9.416 1.00 0.13 B +ATOM 2824 HB THR B 34 19.089 40.173 8.193 1.00 0.14 B +ATOM 2825 HG1 THR B 34 20.808 40.331 6.793 1.00 0.16 B +ATOM 2826 1HG2 THR B 34 19.867 42.488 9.130 1.00 0.16 B +ATOM 2827 2HG2 THR B 34 20.708 41.525 10.344 1.00 0.15 B +ATOM 2828 3HG2 THR B 34 18.956 41.396 10.170 1.00 0.15 B +ATOM 2829 N VAL B 35 20.395 38.735 11.402 1.00 0.11 B +ATOM 2830 CA VAL B 35 19.728 38.389 12.685 1.00 0.11 B +ATOM 2831 C VAL B 35 19.219 39.739 13.261 1.00 0.12 B +ATOM 2832 O VAL B 35 19.969 40.691 13.375 1.00 0.13 B +ATOM 2833 CB VAL B 35 20.701 37.672 13.672 1.00 0.10 B +ATOM 2834 CG1 VAL B 35 19.961 37.454 15.002 1.00 0.10 B +ATOM 2835 CG2 VAL B 35 21.183 36.334 13.078 1.00 0.09 B +ATOM 2836 H VAL B 35 21.222 39.228 11.443 1.00 0.12 B +ATOM 2837 HA VAL B 35 18.876 37.772 12.502 1.00 0.10 B +ATOM 2838 HB VAL B 35 21.559 38.308 13.853 1.00 0.10 B +ATOM 2839 1HG1 VAL B 35 19.792 38.414 15.472 1.00 0.10 B +ATOM 2840 2HG1 VAL B 35 20.554 36.835 15.657 1.00 0.09 B +ATOM 2841 3HG1 VAL B 35 19.010 36.978 14.814 1.00 0.09 B +ATOM 2842 1HG2 VAL B 35 20.535 36.032 12.266 1.00 0.09 B +ATOM 2843 2HG2 VAL B 35 21.188 35.567 13.838 1.00 0.09 B +ATOM 2844 3HG2 VAL B 35 22.185 36.463 12.706 1.00 0.09 B +ATOM 2845 N THR B 36 17.938 39.821 13.605 1.00 0.12 B +ATOM 2846 CA THR B 36 17.328 41.063 14.162 1.00 0.13 B +ATOM 2847 C THR B 36 16.678 40.781 15.468 1.00 0.13 B +ATOM 2848 O THR B 36 15.761 39.976 15.574 1.00 0.13 B +ATOM 2849 CB THR B 36 16.271 41.716 13.209 1.00 0.14 B +ATOM 2850 OG1 THR B 36 16.912 42.027 11.980 1.00 0.15 B +ATOM 2851 CG2 THR B 36 15.664 42.990 13.824 1.00 0.16 B +ATOM 2852 H THR B 36 17.380 39.038 13.502 1.00 0.11 B +ATOM 2853 HA THR B 36 18.098 41.763 14.354 1.00 0.14 B +ATOM 2854 HB THR B 36 15.477 41.022 13.027 1.00 0.14 B +ATOM 2855 HG1 THR B 36 17.525 42.752 12.134 1.00 0.16 B +ATOM 2856 1HG2 THR B 36 15.172 43.562 13.049 1.00 0.17 B +ATOM 2857 2HG2 THR B 36 16.438 43.586 14.276 1.00 0.16 B +ATOM 2858 3HG2 THR B 36 14.935 42.713 14.576 1.00 0.16 B +ATOM 2859 N SER B 37 17.143 41.478 16.474 1.00 0.14 B +ATOM 2860 CA SER B 37 16.506 41.302 17.816 1.00 0.14 B +ATOM 2861 C SER B 37 16.071 42.696 18.330 1.00 0.16 B +ATOM 2862 O SER B 37 16.863 43.621 18.399 1.00 0.17 B +ATOM 2863 CB SER B 37 17.476 40.582 18.756 1.00 0.14 B +ATOM 2864 OG SER B 37 16.887 40.527 20.048 1.00 0.14 B +ATOM 2865 H SER B 37 17.891 42.119 16.330 1.00 0.15 B +ATOM 2866 HA SER B 37 15.609 40.705 17.716 1.00 0.14 B +ATOM 2867 1HB SER B 37 17.653 39.581 18.400 1.00 0.13 B +ATOM 2868 2HB SER B 37 18.407 41.115 18.798 1.00 0.14 B +ATOM 2869 HG SER B 37 17.484 40.055 20.628 1.00 0.14 B +ATOM 2870 N ASN B 38 14.785 42.848 18.651 1.00 0.17 B +ATOM 2871 CA ASN B 38 14.236 44.174 19.133 1.00 0.18 B +ATOM 2872 C ASN B 38 14.630 45.353 18.221 1.00 0.19 B +ATOM 2873 O ASN B 38 14.888 46.437 18.699 1.00 0.21 B +ATOM 2874 CB ASN B 38 14.700 44.416 20.584 1.00 0.19 B +ATOM 2875 CG ASN B 38 13.935 45.567 21.247 1.00 0.21 B +ATOM 2876 OD1 ASN B 38 14.452 46.220 22.147 1.00 0.22 B +ATOM 2877 ND2 ASN B 38 12.781 45.925 20.769 1.00 0.22 B +ATOM 2878 H ASN B 38 14.172 42.083 18.565 1.00 0.16 B +ATOM 2879 HA ASN B 38 13.156 44.134 19.111 1.00 0.19 B +ATOM 2880 1HB ASN B 38 14.505 43.520 21.157 1.00 0.19 B +ATOM 2881 2HB ASN B 38 15.757 44.621 20.597 1.00 0.19 B +ATOM 2882 1HD2 ASN B 38 12.459 45.540 19.937 1.00 0.21 B +ATOM 2883 2HD2 ASN B 38 12.166 46.425 21.330 1.00 0.23 B +ATOM 2884 N GLY B 39 14.623 45.184 16.913 1.00 0.19 B +ATOM 2885 CA GLY B 39 14.924 46.333 16.021 1.00 0.20 B +ATOM 2886 C GLY B 39 16.408 46.601 15.868 1.00 0.20 B +ATOM 2887 O GLY B 39 16.787 47.632 15.336 1.00 0.21 B +ATOM 2888 H GLY B 39 14.389 44.318 16.519 1.00 0.18 B +ATOM 2889 1HA GLY B 39 14.516 46.123 15.046 1.00 0.20 B +ATOM 2890 2HA GLY B 39 14.453 47.214 16.424 1.00 0.21 B +ATOM 2891 N LYS B 40 17.252 45.704 16.297 1.00 0.19 B +ATOM 2892 CA LYS B 40 18.711 45.913 16.128 1.00 0.19 B +ATOM 2893 C LYS B 40 19.157 44.692 15.314 1.00 0.17 B +ATOM 2894 O LYS B 40 18.690 43.596 15.520 1.00 0.16 B +ATOM 2895 CB LYS B 40 19.369 46.018 17.497 1.00 0.19 B +ATOM 2896 CG LYS B 40 18.838 47.256 18.222 1.00 0.94 B +ATOM 2897 CD LYS B 40 19.588 47.436 19.543 1.00 1.31 B +ATOM 2898 CE LYS B 40 18.981 48.606 20.318 1.00 1.93 B +ATOM 2899 NZ LYS B 40 19.592 48.672 21.675 1.00 2.59 B +ATOM 2900 H LYS B 40 16.929 44.875 16.716 1.00 0.18 B +ATOM 2901 HA LYS B 40 18.901 46.823 15.560 1.00 0.20 B +ATOM 2902 1HB LYS B 40 19.141 45.134 18.076 1.00 0.67 B +ATOM 2903 2HB LYS B 40 20.438 46.104 17.378 1.00 0.69 B +ATOM 2904 1HG LYS B 40 18.987 48.128 17.601 1.00 1.52 B +ATOM 2905 2HG LYS B 40 17.785 47.133 18.422 1.00 1.58 B +ATOM 2906 1HD LYS B 40 19.504 46.532 20.129 1.00 1.83 B +ATOM 2907 2HD LYS B 40 20.629 47.641 19.341 1.00 1.84 B +ATOM 2908 1HE LYS B 40 19.176 49.527 19.790 1.00 2.41 B +ATOM 2909 2HE LYS B 40 17.915 48.463 20.410 1.00 2.37 B +ATOM 2910 1HZ LYS B 40 18.987 48.168 22.354 1.00 2.97 B +ATOM 2911 2HZ LYS B 40 19.686 49.668 21.965 1.00 3.02 B +ATOM 2912 3HZ LYS B 40 20.531 48.226 21.655 1.00 2.98 B +ATOM 2913 N SER B 41 19.978 44.913 14.348 1.00 0.18 B +ATOM 2914 CA SER B 41 20.427 43.884 13.407 1.00 0.17 B +ATOM 2915 C SER B 41 21.921 43.667 13.362 1.00 0.17 B +ATOM 2916 O SER B 41 22.751 44.519 13.647 1.00 0.18 B +ATOM 2917 CB SER B 41 20.094 44.362 11.988 1.00 0.17 B +ATOM 2918 OG SER B 41 18.688 44.467 11.857 1.00 0.18 B +ATOM 2919 H SER B 41 20.284 45.810 14.217 1.00 0.19 B +ATOM 2920 HA SER B 41 19.916 42.958 13.597 1.00 0.15 B +ATOM 2921 1HB SER B 41 20.540 45.330 11.819 1.00 0.19 B +ATOM 2922 2HB SER B 41 20.484 43.660 11.259 1.00 0.17 B +ATOM 2923 HG SER B 41 18.502 44.964 11.060 1.00 0.18 B +ATOM 2924 N ALA B 42 22.222 42.489 12.936 1.00 0.15 B +ATOM 2925 CA ALA B 42 23.597 42.052 12.740 1.00 0.15 B +ATOM 2926 C ALA B 42 23.679 40.991 11.637 1.00 0.14 B +ATOM 2927 O ALA B 42 22.814 40.139 11.500 1.00 0.13 B +ATOM 2928 CB ALA B 42 24.053 41.339 14.020 1.00 0.14 B +ATOM 2929 H ALA B 42 21.498 41.864 12.755 1.00 0.14 B +ATOM 2930 HA ALA B 42 24.238 42.899 12.529 1.00 0.16 B +ATOM 2931 1HB ALA B 42 24.141 42.052 14.823 1.00 0.15 B +ATOM 2932 2HB ALA B 42 25.008 40.861 13.852 1.00 0.14 B +ATOM 2933 3HB ALA B 42 23.321 40.588 14.282 1.00 0.13 B +ATOM 2934 N SER B 43 24.771 40.991 10.939 1.00 0.15 B +ATOM 2935 CA SER B 43 25.050 39.940 9.955 1.00 0.14 B +ATOM 2936 C SER B 43 25.211 38.629 10.753 1.00 0.13 B +ATOM 2937 O SER B 43 25.920 38.593 11.751 1.00 0.13 B +ATOM 2938 CB SER B 43 26.403 40.224 9.315 1.00 0.16 B +ATOM 2939 OG SER B 43 26.877 39.045 8.672 1.00 0.15 B +ATOM 2940 H SER B 43 25.449 41.666 11.115 1.00 0.16 B +ATOM 2941 HA SER B 43 24.277 39.898 9.202 1.00 0.14 B +ATOM 2942 1HB SER B 43 26.304 41.013 8.589 1.00 0.17 B +ATOM 2943 2HB SER B 43 27.100 40.531 10.084 1.00 0.16 B +ATOM 2944 HG SER B 43 26.391 38.935 7.853 1.00 0.15 B +ATOM 2945 N ALA B 44 24.595 37.562 10.350 1.00 0.12 B +ATOM 2946 CA ALA B 44 24.773 36.299 11.103 1.00 0.11 B +ATOM 2947 C ALA B 44 26.170 35.700 10.847 1.00 0.12 B +ATOM 2948 O ALA B 44 26.537 34.703 11.448 1.00 0.11 B +ATOM 2949 CB ALA B 44 23.723 35.328 10.588 1.00 0.10 B +ATOM 2950 H ALA B 44 24.020 37.586 9.554 1.00 0.12 B +ATOM 2951 HA ALA B 44 24.637 36.471 12.162 1.00 0.11 B +ATOM 2952 1HB ALA B 44 22.740 35.731 10.749 1.00 0.10 B +ATOM 2953 2HB ALA B 44 23.821 34.386 11.095 1.00 0.10 B +ATOM 2954 3HB ALA B 44 23.872 35.179 9.530 1.00 0.11 B +ATOM 2955 N LYS B 45 26.947 36.276 9.944 1.00 0.13 B +ATOM 2956 CA LYS B 45 28.289 35.699 9.638 1.00 0.14 B +ATOM 2957 C LYS B 45 29.348 36.460 10.412 1.00 0.15 B +ATOM 2958 O LYS B 45 30.533 36.318 10.149 1.00 0.16 B +ATOM 2959 CB LYS B 45 28.626 35.752 8.123 1.00 0.15 B +ATOM 2960 CG LYS B 45 27.594 34.951 7.278 1.00 0.15 B +ATOM 2961 CD LYS B 45 27.916 35.034 5.764 1.00 0.16 B +ATOM 2962 CE LYS B 45 26.702 34.545 4.945 1.00 0.16 B +ATOM 2963 NZ LYS B 45 27.107 34.401 3.509 1.00 0.17 B +ATOM 2964 H LYS B 45 26.638 37.073 9.475 1.00 0.13 B +ATOM 2965 HA LYS B 45 28.308 34.677 9.959 1.00 0.13 B +ATOM 2966 1HB LYS B 45 28.632 36.781 7.797 1.00 0.16 B +ATOM 2967 2HB LYS B 45 29.607 35.332 7.975 1.00 0.16 B +ATOM 2968 1HG LYS B 45 27.618 33.914 7.579 1.00 0.14 B +ATOM 2969 2HG LYS B 45 26.607 35.349 7.448 1.00 0.14 B +ATOM 2970 1HD LYS B 45 28.142 36.056 5.494 1.00 0.17 B +ATOM 2971 2HD LYS B 45 28.768 34.408 5.537 1.00 0.16 B +ATOM 2972 1HE LYS B 45 26.365 33.589 5.325 1.00 0.15 B +ATOM 2973 2HE LYS B 45 25.896 35.263 5.023 1.00 0.15 B +ATOM 2974 1HZ LYS B 45 26.442 34.923 2.901 1.00 0.17 B +ATOM 2975 2HZ LYS B 45 27.102 33.395 3.243 1.00 0.17 B +ATOM 2976 3HZ LYS B 45 28.063 34.787 3.381 1.00 0.18 B +ATOM 2977 N SER B 46 28.943 37.269 11.371 1.00 0.14 B +ATOM 2978 CA SER B 46 29.939 38.041 12.147 1.00 0.15 B +ATOM 2979 C SER B 46 29.634 37.961 13.638 1.00 0.15 B +ATOM 2980 O SER B 46 28.722 38.575 14.166 1.00 0.14 B +ATOM 2981 CB SER B 46 29.932 39.490 11.614 1.00 0.16 B +ATOM 2982 OG SER B 46 30.070 40.404 12.694 1.00 0.17 B +ATOM 2983 H SER B 46 27.986 37.362 11.573 1.00 0.14 B +ATOM 2984 HA SER B 46 30.920 37.609 12.011 1.00 0.16 B +ATOM 2985 1HB SER B 46 30.751 39.630 10.925 1.00 0.17 B +ATOM 2986 2HB SER B 46 29.001 39.672 11.095 1.00 0.16 B +ATOM 2987 HG SER B 46 30.862 40.174 13.180 1.00 0.17 B +ATOM 2988 N LEU B 47 30.443 37.183 14.303 1.00 0.15 B +ATOM 2989 CA LEU B 47 30.320 36.994 15.776 1.00 0.15 B +ATOM 2990 C LEU B 47 30.421 38.366 16.477 1.00 0.16 B +ATOM 2991 O LEU B 47 29.739 38.611 17.446 1.00 0.15 B +ATOM 2992 CB LEU B 47 31.462 36.039 16.219 1.00 0.15 B +ATOM 2993 CG LEU B 47 31.346 35.730 17.720 1.00 0.16 B +ATOM 2994 CD1 LEU B 47 30.166 34.780 17.986 1.00 0.19 B +ATOM 2995 CD2 LEU B 47 32.647 35.074 18.193 1.00 0.19 B +ATOM 2996 H LEU B 47 31.159 36.716 13.817 1.00 0.15 B +ATOM 2997 HA LEU B 47 29.361 36.555 16.019 1.00 0.14 B +ATOM 2998 1HB LEU B 47 31.402 35.122 15.653 1.00 0.15 B +ATOM 2999 2HB LEU B 47 32.414 36.512 16.027 1.00 0.17 B +ATOM 3000 HG LEU B 47 31.192 36.649 18.265 1.00 0.19 B +ATOM 3001 1HD1 LEU B 47 30.129 34.019 17.221 1.00 1.01 B +ATOM 3002 2HD1 LEU B 47 29.244 35.339 17.981 1.00 1.06 B +ATOM 3003 3HD1 LEU B 47 30.290 34.310 18.951 1.00 1.00 B +ATOM 3004 1HD2 LEU B 47 32.559 34.809 19.236 1.00 1.00 B +ATOM 3005 2HD2 LEU B 47 33.466 35.766 18.065 1.00 1.08 B +ATOM 3006 3HD2 LEU B 47 32.833 34.185 17.609 1.00 1.02 B +ATOM 3007 N PHE B 48 31.258 39.264 16.009 1.00 0.17 B +ATOM 3008 CA PHE B 48 31.365 40.600 16.695 1.00 0.18 B +ATOM 3009 C PHE B 48 30.035 41.391 16.690 1.00 0.17 B +ATOM 3010 O PHE B 48 29.617 41.868 17.727 1.00 0.18 B +ATOM 3011 CB PHE B 48 32.477 41.474 16.091 1.00 0.19 B +ATOM 3012 CG PHE B 48 32.601 42.748 16.892 1.00 0.22 B +ATOM 3013 CD1 PHE B 48 31.889 43.896 16.499 1.00 0.28 B +ATOM 3014 CD2 PHE B 48 33.424 42.786 18.034 1.00 0.28 B +ATOM 3015 CE1 PHE B 48 31.999 45.084 17.247 1.00 0.33 B +ATOM 3016 CE2 PHE B 48 33.536 43.975 18.781 1.00 0.34 B +ATOM 3017 CZ PHE B 48 32.823 45.123 18.388 1.00 0.34 B +ATOM 3018 H PHE B 48 31.816 39.061 15.232 1.00 0.17 B +ATOM 3019 HA PHE B 48 31.605 40.418 17.724 1.00 0.18 B +ATOM 3020 1HB PHE B 48 33.412 40.935 16.122 1.00 0.21 B +ATOM 3021 2HB PHE B 48 32.232 41.714 15.067 1.00 0.20 B +ATOM 3022 HD1 PHE B 48 31.260 43.865 15.624 1.00 0.34 B +ATOM 3023 HD2 PHE B 48 33.971 41.905 18.335 1.00 0.33 B +ATOM 3024 HE1 PHE B 48 31.453 45.965 16.945 1.00 0.41 B +ATOM 3025 HE2 PHE B 48 34.170 44.006 19.655 1.00 0.43 B +ATOM 3026 HZ PHE B 48 32.906 46.033 18.963 1.00 0.40 B +ATOM 3027 N LYS B 49 29.362 41.569 15.577 1.00 0.17 B +ATOM 3028 CA LYS B 49 28.107 42.347 15.610 1.00 0.17 B +ATOM 3029 C LYS B 49 27.033 41.586 16.342 1.00 0.16 B +ATOM 3030 O LYS B 49 26.141 42.152 16.942 1.00 0.16 B +ATOM 3031 CB LYS B 49 27.634 42.521 14.170 1.00 0.17 B +ATOM 3032 CG LYS B 49 28.723 43.192 13.319 1.00 0.19 B +ATOM 3033 CD LYS B 49 28.863 44.672 13.696 1.00 0.24 B +ATOM 3034 CE LYS B 49 29.721 45.383 12.648 1.00 0.36 B +ATOM 3035 NZ LYS B 49 30.166 46.702 13.181 1.00 1.13 B +ATOM 3036 H LYS B 49 29.673 41.203 14.721 1.00 0.17 B +ATOM 3037 HA LYS B 49 28.273 43.310 16.073 1.00 0.18 B +ATOM 3038 1HB LYS B 49 27.403 41.552 13.753 1.00 0.17 B +ATOM 3039 2HB LYS B 49 26.745 43.134 14.159 1.00 0.18 B +ATOM 3040 1HG LYS B 49 29.665 42.691 13.481 1.00 0.23 B +ATOM 3041 2HG LYS B 49 28.455 43.116 12.275 1.00 0.20 B +ATOM 3042 1HD LYS B 49 27.886 45.130 13.733 1.00 0.34 B +ATOM 3043 2HD LYS B 49 29.338 44.760 14.659 1.00 0.43 B +ATOM 3044 1HE LYS B 49 30.586 44.779 12.418 1.00 1.02 B +ATOM 3045 2HE LYS B 49 29.140 45.535 11.750 1.00 1.11 B +ATOM 3046 1HZ LYS B 49 30.080 47.424 12.438 1.00 1.71 B +ATOM 3047 2HZ LYS B 49 31.158 46.635 13.487 1.00 1.68 B +ATOM 3048 3HZ LYS B 49 29.570 46.968 13.990 1.00 1.70 B +ATOM 3049 N LEU B 50 27.084 40.306 16.251 1.00 0.15 B +ATOM 3050 CA LEU B 50 26.017 39.486 16.901 1.00 0.13 B +ATOM 3051 C LEU B 50 26.100 39.663 18.424 1.00 0.14 B +ATOM 3052 O LEU B 50 25.097 39.606 19.120 1.00 0.14 B +ATOM 3053 CB LEU B 50 26.315 38.035 16.494 1.00 0.12 B +ATOM 3054 CG LEU B 50 25.427 37.293 15.487 1.00 0.11 B +ATOM 3055 CD1 LEU B 50 25.854 35.800 15.606 1.00 0.11 B +ATOM 3056 CD2 LEU B 50 23.942 37.427 15.814 1.00 0.11 B +ATOM 3057 H LEU B 50 27.812 39.871 15.732 1.00 0.15 B +ATOM 3058 HA LEU B 50 25.044 39.802 16.590 1.00 0.13 B +ATOM 3059 1HB LEU B 50 27.300 38.028 16.064 1.00 0.13 B +ATOM 3060 2HB LEU B 50 26.352 37.446 17.399 1.00 0.12 B +ATOM 3061 HG LEU B 50 25.626 37.641 14.482 1.00 0.12 B +ATOM 3062 1HD1 LEU B 50 25.430 35.377 16.510 1.00 0.11 B +ATOM 3063 2HD1 LEU B 50 26.938 35.735 15.669 1.00 0.12 B +ATOM 3064 3HD1 LEU B 50 25.517 35.241 14.753 1.00 0.10 B +ATOM 3065 1HD2 LEU B 50 23.599 38.414 15.553 1.00 0.11 B +ATOM 3066 2HD2 LEU B 50 23.795 37.256 16.859 1.00 0.11 B +ATOM 3067 3HD2 LEU B 50 23.382 36.695 15.250 1.00 0.10 B +ATOM 3068 N GLN B 51 27.283 39.866 18.934 1.00 0.15 B +ATOM 3069 CA GLN B 51 27.460 40.018 20.397 1.00 0.16 B +ATOM 3070 C GLN B 51 26.825 41.312 20.859 1.00 0.17 B +ATOM 3071 O GLN B 51 26.716 41.550 22.039 1.00 0.17 B +ATOM 3072 CB GLN B 51 28.951 40.092 20.735 1.00 0.17 B +ATOM 3073 CG GLN B 51 29.567 38.696 20.612 1.00 0.17 B +ATOM 3074 CD GLN B 51 31.091 38.798 20.693 1.00 0.42 B +ATOM 3075 OE1 GLN B 51 31.656 39.841 20.431 1.00 0.78 B +ATOM 3076 NE2 GLN B 51 31.786 37.752 21.047 1.00 0.37 B +ATOM 3077 H GLN B 51 28.063 39.914 18.345 1.00 0.15 B +ATOM 3078 HA GLN B 51 27.022 39.168 20.908 1.00 0.15 B +ATOM 3079 1HB GLN B 51 29.444 40.767 20.052 1.00 0.18 B +ATOM 3080 2HB GLN B 51 29.079 40.444 21.745 1.00 0.18 B +ATOM 3081 1HG GLN B 51 29.207 38.076 21.421 1.00 0.30 B +ATOM 3082 2HG GLN B 51 29.284 38.256 19.673 1.00 0.32 B +ATOM 3083 1HE2 GLN B 51 31.330 36.910 21.259 1.00 0.27 B +ATOM 3084 2HE2 GLN B 51 32.762 37.807 21.102 1.00 0.59 B +ATOM 3085 N THR B 52 26.431 42.181 19.956 1.00 0.17 B +ATOM 3086 CA THR B 52 25.851 43.475 20.422 1.00 0.18 B +ATOM 3087 C THR B 52 24.324 43.373 20.553 1.00 0.18 B +ATOM 3088 O THR B 52 23.665 44.294 20.994 1.00 0.19 B +ATOM 3089 CB THR B 52 26.277 44.658 19.505 1.00 0.19 B +ATOM 3090 OG1 THR B 52 26.271 44.234 18.149 1.00 0.21 B +ATOM 3091 CG2 THR B 52 27.681 45.137 19.901 1.00 0.22 B +ATOM 3092 H THR B 52 26.528 41.983 18.999 1.00 0.16 B +ATOM 3093 HA THR B 52 26.222 43.664 21.414 1.00 0.19 B +ATOM 3094 HB THR B 52 25.578 45.472 19.626 1.00 0.21 B +ATOM 3095 HG1 THR B 52 25.467 43.731 18.000 1.00 0.95 B +ATOM 3096 1HG2 THR B 52 27.957 45.986 19.294 1.00 0.98 B +ATOM 3097 2HG2 THR B 52 28.390 44.338 19.749 1.00 1.00 B +ATOM 3098 3HG2 THR B 52 27.683 45.426 20.948 1.00 0.99 B +ATOM 3099 N LEU B 53 23.763 42.258 20.181 1.00 0.16 B +ATOM 3100 CA LEU B 53 22.307 42.054 20.274 1.00 0.16 B +ATOM 3101 C LEU B 53 21.956 41.348 21.593 1.00 0.16 B +ATOM 3102 O LEU B 53 22.761 40.643 22.169 1.00 0.16 B +ATOM 3103 CB LEU B 53 21.904 41.110 19.103 1.00 0.14 B +ATOM 3104 CG LEU B 53 21.829 41.905 17.787 1.00 0.14 B +ATOM 3105 CD1 LEU B 53 21.892 40.932 16.605 1.00 0.16 B +ATOM 3106 CD2 LEU B 53 20.506 42.709 17.705 1.00 0.13 B +ATOM 3107 H LEU B 53 24.311 41.542 19.811 1.00 0.15 B +ATOM 3108 HA LEU B 53 21.792 42.986 20.232 1.00 0.17 B +ATOM 3109 1HB LEU B 53 22.641 40.325 19.010 1.00 0.14 B +ATOM 3110 2HB LEU B 53 20.938 40.671 19.309 1.00 0.14 B +ATOM 3111 HG LEU B 53 22.670 42.583 17.734 1.00 0.14 B +ATOM 3112 1HD1 LEU B 53 21.699 41.469 15.689 1.00 0.16 B +ATOM 3113 2HD1 LEU B 53 21.146 40.162 16.734 1.00 0.16 B +ATOM 3114 3HD1 LEU B 53 22.866 40.482 16.563 1.00 0.17 B +ATOM 3115 1HD2 LEU B 53 20.148 42.944 18.695 1.00 0.13 B +ATOM 3116 2HD2 LEU B 53 19.752 42.132 17.189 1.00 0.12 B +ATOM 3117 3HD2 LEU B 53 20.680 43.628 17.163 1.00 0.13 B +ATOM 3118 N GLY B 54 20.735 41.502 22.042 1.00 0.16 B +ATOM 3119 CA GLY B 54 20.301 40.802 23.293 1.00 0.16 B +ATOM 3120 C GLY B 54 19.838 39.433 22.830 1.00 0.15 B +ATOM 3121 O GLY B 54 18.810 39.324 22.193 1.00 0.15 B +ATOM 3122 H GLY B 54 20.098 42.049 21.529 1.00 0.16 B +ATOM 3123 1HA GLY B 54 21.129 40.711 23.986 1.00 0.17 B +ATOM 3124 2HA GLY B 54 19.483 41.330 23.766 1.00 0.17 B +ATOM 3125 N LEU B 55 20.599 38.388 23.081 1.00 0.15 B +ATOM 3126 CA LEU B 55 20.181 37.064 22.604 1.00 0.14 B +ATOM 3127 C LEU B 55 20.097 36.177 23.838 1.00 0.14 B +ATOM 3128 O LEU B 55 20.627 35.078 23.864 1.00 0.14 B +ATOM 3129 CB LEU B 55 21.193 36.547 21.573 1.00 0.13 B +ATOM 3130 CG LEU B 55 21.364 37.399 20.300 1.00 0.12 B +ATOM 3131 CD1 LEU B 55 22.437 36.731 19.407 1.00 0.11 B +ATOM 3132 CD2 LEU B 55 20.054 37.481 19.508 1.00 0.11 B +ATOM 3133 H LEU B 55 21.451 38.491 23.562 1.00 0.15 B +ATOM 3134 HA LEU B 55 19.198 37.103 22.168 1.00 0.13 B +ATOM 3135 1HB LEU B 55 22.149 36.490 22.056 1.00 0.13 B +ATOM 3136 2HB LEU B 55 20.893 35.554 21.280 1.00 0.12 B +ATOM 3137 HG LEU B 55 21.695 38.391 20.563 1.00 0.13 B +ATOM 3138 1HD1 LEU B 55 21.975 36.019 18.732 1.00 0.10 B +ATOM 3139 2HD1 LEU B 55 23.166 36.212 20.018 1.00 0.12 B +ATOM 3140 3HD1 LEU B 55 22.936 37.490 18.839 1.00 0.11 B +ATOM 3141 1HD2 LEU B 55 19.342 38.082 20.048 1.00 0.12 B +ATOM 3142 2HD2 LEU B 55 19.658 36.487 19.363 1.00 0.11 B +ATOM 3143 3HD2 LEU B 55 20.249 37.932 18.542 1.00 0.11 B +ATOM 3144 N THR B 56 19.430 36.677 24.879 1.00 0.16 B +ATOM 3145 CA THR B 56 19.284 35.890 26.115 1.00 0.17 B +ATOM 3146 C THR B 56 18.105 34.917 25.963 1.00 0.17 B +ATOM 3147 O THR B 56 17.350 34.989 25.014 1.00 0.16 B +ATOM 3148 CB THR B 56 19.016 36.835 27.301 1.00 0.18 B +ATOM 3149 OG1 THR B 56 17.682 37.317 27.226 1.00 0.20 B +ATOM 3150 CG2 THR B 56 19.988 38.014 27.252 1.00 0.21 B +ATOM 3151 H THR B 56 19.038 37.580 24.832 1.00 0.16 B +ATOM 3152 HA THR B 56 20.189 35.340 26.286 1.00 0.17 B +ATOM 3153 HB THR B 56 19.154 36.299 28.227 1.00 0.22 B +ATOM 3154 HG1 THR B 56 17.179 36.910 27.935 1.00 0.96 B +ATOM 3155 1HG2 THR B 56 19.864 38.547 26.321 1.00 0.99 B +ATOM 3156 2HG2 THR B 56 21.002 37.650 27.326 1.00 1.04 B +ATOM 3157 3HG2 THR B 56 19.783 38.680 28.076 1.00 1.05 B +ATOM 3158 N GLN B 57 17.939 34.013 26.893 1.00 0.18 B +ATOM 3159 CA GLN B 57 16.813 33.048 26.806 1.00 0.18 B +ATOM 3160 C GLN B 57 15.484 33.780 26.738 1.00 0.18 B +ATOM 3161 O GLN B 57 15.256 34.733 27.464 1.00 0.19 B +ATOM 3162 CB GLN B 57 16.823 32.168 28.075 1.00 0.20 B +ATOM 3163 CG GLN B 57 15.698 31.138 27.979 1.00 0.20 B +ATOM 3164 CD GLN B 57 15.840 30.191 29.157 1.00 0.22 B +ATOM 3165 OE1 GLN B 57 15.520 29.016 29.068 1.00 0.22 B +ATOM 3166 NE2 GLN B 57 16.331 30.681 30.266 1.00 0.23 B +ATOM 3167 H GLN B 57 18.557 33.977 27.654 1.00 0.18 B +ATOM 3168 HA GLN B 57 16.921 32.434 25.931 1.00 0.17 B +ATOM 3169 1HB GLN B 57 17.772 31.665 28.165 1.00 0.20 B +ATOM 3170 2HB GLN B 57 16.667 32.788 28.947 1.00 0.20 B +ATOM 3171 1HG GLN B 57 14.739 31.641 28.028 1.00 0.20 B +ATOM 3172 2HG GLN B 57 15.774 30.589 27.052 1.00 0.19 B +ATOM 3173 1HE2 GLN B 57 16.586 31.629 30.302 1.00 0.22 B +ATOM 3174 2HE2 GLN B 57 16.448 30.114 31.054 1.00 0.24 B +ATOM 3175 N GLY B 58 14.574 33.321 25.895 1.00 0.18 B +ATOM 3176 CA GLY B 58 13.252 33.967 25.835 1.00 0.18 B +ATOM 3177 C GLY B 58 13.184 35.068 24.781 1.00 0.17 B +ATOM 3178 O GLY B 58 12.147 35.684 24.565 1.00 0.18 B +ATOM 3179 H GLY B 58 14.761 32.536 25.333 1.00 0.17 B +ATOM 3180 1HA GLY B 58 12.520 33.215 25.604 1.00 0.19 B +ATOM 3181 2HA GLY B 58 13.043 34.393 26.800 1.00 0.19 B +ATOM 3182 N THR B 59 14.272 35.333 24.139 1.00 0.16 B +ATOM 3183 CA THR B 59 14.298 36.393 23.106 1.00 0.15 B +ATOM 3184 C THR B 59 13.828 35.854 21.745 1.00 0.14 B +ATOM 3185 O THR B 59 14.310 34.838 21.292 1.00 0.14 B +ATOM 3186 CB THR B 59 15.761 36.889 22.938 1.00 0.15 B +ATOM 3187 OG1 THR B 59 16.191 37.523 24.139 1.00 0.16 B +ATOM 3188 CG2 THR B 59 15.819 37.896 21.778 1.00 0.14 B +ATOM 3189 H THR B 59 15.088 34.836 24.344 1.00 0.16 B +ATOM 3190 HA THR B 59 13.666 37.214 23.418 1.00 0.16 B +ATOM 3191 HB THR B 59 16.407 36.050 22.723 1.00 0.14 B +ATOM 3192 HG1 THR B 59 15.547 37.332 24.824 1.00 0.17 B +ATOM 3193 1HG2 THR B 59 14.942 38.529 21.805 1.00 0.15 B +ATOM 3194 2HG2 THR B 59 15.848 37.365 20.838 1.00 0.13 B +ATOM 3195 3HG2 THR B 59 16.699 38.505 21.872 1.00 0.14 B +ATOM 3196 N VAL B 60 12.938 36.561 21.059 1.00 0.15 B +ATOM 3197 CA VAL B 60 12.492 36.133 19.716 1.00 0.14 B +ATOM 3198 C VAL B 60 13.360 36.857 18.711 1.00 0.13 B +ATOM 3199 O VAL B 60 13.391 38.083 18.703 1.00 0.13 B +ATOM 3200 CB VAL B 60 11.020 36.566 19.486 1.00 0.15 B +ATOM 3201 CG1 VAL B 60 10.555 36.204 18.066 1.00 0.14 B +ATOM 3202 CG2 VAL B 60 10.107 35.952 20.545 1.00 0.16 B +ATOM 3203 H VAL B 60 12.589 37.396 21.421 1.00 0.15 B +ATOM 3204 HA VAL B 60 12.594 35.079 19.606 1.00 0.13 B +ATOM 3205 HB VAL B 60 10.965 37.640 19.589 1.00 0.15 B +ATOM 3206 1HG1 VAL B 60 9.598 36.669 17.866 1.00 0.15 B +ATOM 3207 2HG1 VAL B 60 10.466 35.134 17.961 1.00 0.14 B +ATOM 3208 3HG1 VAL B 60 11.280 36.572 17.363 1.00 0.14 B +ATOM 3209 1HG2 VAL B 60 9.097 36.309 20.395 1.00 0.17 B +ATOM 3210 2HG2 VAL B 60 10.450 36.260 21.524 1.00 0.16 B +ATOM 3211 3HG2 VAL B 60 10.128 34.879 20.476 1.00 0.16 B +ATOM 3212 N VAL B 61 14.059 36.157 17.835 1.00 0.12 B +ATOM 3213 CA VAL B 61 14.864 36.932 16.833 1.00 0.11 B +ATOM 3214 C VAL B 61 14.293 36.732 15.446 1.00 0.11 B +ATOM 3215 O VAL B 61 13.603 35.745 15.209 1.00 0.11 B +ATOM 3216 CB VAL B 61 16.312 36.441 16.765 1.00 0.10 B +ATOM 3217 CG1 VAL B 61 17.074 36.774 18.062 1.00 0.11 B +ATOM 3218 CG2 VAL B 61 16.281 34.931 16.524 1.00 0.10 B +ATOM 3219 H VAL B 61 14.043 35.166 17.832 1.00 0.11 B +ATOM 3220 HA VAL B 61 14.853 37.977 17.090 1.00 0.12 B +ATOM 3221 HB VAL B 61 16.808 36.920 15.929 1.00 0.10 B +ATOM 3222 1HG1 VAL B 61 16.567 37.565 18.594 1.00 0.12 B +ATOM 3223 2HG1 VAL B 61 18.074 37.101 17.813 1.00 0.10 B +ATOM 3224 3HG1 VAL B 61 17.131 35.900 18.694 1.00 0.11 B +ATOM 3225 1HG2 VAL B 61 15.815 34.724 15.572 1.00 0.09 B +ATOM 3226 2HG2 VAL B 61 15.714 34.457 17.310 1.00 0.10 B +ATOM 3227 3HG2 VAL B 61 17.286 34.549 16.520 1.00 0.09 B +ATOM 3228 N THR B 62 14.625 37.620 14.502 1.00 0.11 B +ATOM 3229 CA THR B 62 14.149 37.382 13.113 1.00 0.11 B +ATOM 3230 C THR B 62 15.386 37.021 12.291 1.00 0.11 B +ATOM 3231 O THR B 62 16.382 37.717 12.330 1.00 0.11 B +ATOM 3232 CB THR B 62 13.423 38.601 12.484 1.00 0.13 B +ATOM 3233 OG1 THR B 62 12.316 38.915 13.324 1.00 0.14 B +ATOM 3234 CG2 THR B 62 12.914 38.197 11.088 1.00 0.13 B +ATOM 3235 H THR B 62 15.210 38.388 14.715 1.00 0.11 B +ATOM 3236 HA THR B 62 13.462 36.550 13.125 1.00 0.11 B +ATOM 3237 HB THR B 62 14.081 39.443 12.409 1.00 0.13 B +ATOM 3238 HG1 THR B 62 11.542 38.456 12.985 1.00 0.14 B +ATOM 3239 1HG2 THR B 62 12.218 38.936 10.722 1.00 0.14 B +ATOM 3240 2HG2 THR B 62 12.415 37.239 11.154 1.00 0.13 B +ATOM 3241 3HG2 THR B 62 13.748 38.116 10.405 1.00 0.13 B +ATOM 3242 N ILE B 63 15.323 35.952 11.540 1.00 0.10 B +ATOM 3243 CA ILE B 63 16.459 35.529 10.672 1.00 0.10 B +ATOM 3244 C ILE B 63 15.924 35.795 9.251 1.00 0.11 B +ATOM 3245 O ILE B 63 14.906 35.258 8.877 1.00 0.11 B +ATOM 3246 CB ILE B 63 16.865 34.022 10.831 1.00 0.09 B +ATOM 3247 CG1 ILE B 63 17.198 33.728 12.319 1.00 0.09 B +ATOM 3248 CG2 ILE B 63 18.059 33.733 9.891 1.00 0.09 B +ATOM 3249 CD1 ILE B 63 17.608 32.259 12.559 1.00 0.09 B +ATOM 3250 H ILE B 63 14.499 35.439 11.517 1.00 0.10 B +ATOM 3251 HA ILE B 63 17.318 36.148 10.885 1.00 0.10 B +ATOM 3252 HB ILE B 63 16.038 33.399 10.520 1.00 0.10 B +ATOM 3253 1HG1 ILE B 63 18.000 34.371 12.640 1.00 0.08 B +ATOM 3254 2HG1 ILE B 63 16.318 33.939 12.910 1.00 0.09 B +ATOM 3255 1HG2 ILE B 63 17.686 33.573 8.887 1.00 0.10 B +ATOM 3256 2HG2 ILE B 63 18.586 32.852 10.216 1.00 0.09 B +ATOM 3257 3HG2 ILE B 63 18.735 34.577 9.882 1.00 0.09 B +ATOM 3258 1HD1 ILE B 63 16.886 31.597 12.116 1.00 0.09 B +ATOM 3259 2HD1 ILE B 63 17.650 32.071 13.626 1.00 0.09 B +ATOM 3260 3HD1 ILE B 63 18.579 32.075 12.129 1.00 0.09 B +ATOM 3261 N SER B 64 16.588 36.634 8.493 1.00 0.12 B +ATOM 3262 CA SER B 64 16.183 36.994 7.099 1.00 0.13 B +ATOM 3263 C SER B 64 17.357 36.727 6.197 1.00 0.13 B +ATOM 3264 O SER B 64 18.506 36.929 6.580 1.00 0.13 B +ATOM 3265 CB SER B 64 15.827 38.499 6.933 1.00 0.14 B +ATOM 3266 OG SER B 64 15.323 39.025 8.147 1.00 0.14 B +ATOM 3267 H SER B 64 17.389 37.034 8.856 1.00 0.11 B +ATOM 3268 HA SER B 64 15.360 36.392 6.798 1.00 0.13 B +ATOM 3269 1HB SER B 64 16.707 39.061 6.657 1.00 0.15 B +ATOM 3270 2HB SER B 64 15.096 38.613 6.147 1.00 0.15 B +ATOM 3271 HG SER B 64 16.074 39.219 8.713 1.00 0.14 B +ATOM 3272 N ALA B 65 17.104 36.323 4.990 1.00 0.14 B +ATOM 3273 CA ALA B 65 18.265 36.095 4.081 1.00 0.15 B +ATOM 3274 C ALA B 65 17.898 36.569 2.710 1.00 0.16 B +ATOM 3275 O ALA B 65 16.735 36.574 2.324 1.00 0.17 B +ATOM 3276 CB ALA B 65 18.665 34.633 3.955 1.00 0.14 B +ATOM 3277 H ALA B 65 16.170 36.199 4.685 1.00 0.14 B +ATOM 3278 HA ALA B 65 19.114 36.647 4.452 1.00 0.15 B +ATOM 3279 1HB ALA B 65 17.798 34.040 3.710 1.00 0.14 B +ATOM 3280 2HB ALA B 65 19.085 34.293 4.888 1.00 0.13 B +ATOM 3281 3HB ALA B 65 19.405 34.530 3.171 1.00 0.15 B +ATOM 3282 N GLU B 66 18.891 36.937 1.961 1.00 0.17 B +ATOM 3283 CA GLU B 66 18.615 37.396 0.571 1.00 0.19 B +ATOM 3284 C GLU B 66 19.730 36.869 -0.297 1.00 0.20 B +ATOM 3285 O GLU B 66 20.875 37.281 -0.180 1.00 0.20 B +ATOM 3286 CB GLU B 66 18.606 38.934 0.607 1.00 0.20 B +ATOM 3287 CG GLU B 66 17.597 39.684 -0.288 1.00 0.21 B +ATOM 3288 CD GLU B 66 17.462 39.109 -1.688 1.00 0.22 B +ATOM 3289 OE1 GLU B 66 18.262 39.442 -2.552 1.00 0.23 B +ATOM 3290 OE2 GLU B 66 16.512 38.377 -1.881 1.00 0.22 B +ATOM 3291 H GLU B 66 19.814 36.899 2.318 1.00 0.17 B +ATOM 3292 HA GLU B 66 17.673 37.002 0.225 1.00 0.19 B +ATOM 3293 1HB GLU B 66 18.396 39.225 1.623 1.00 0.19 B +ATOM 3294 2HB GLU B 66 19.598 39.284 0.364 1.00 0.20 B +ATOM 3295 1HG GLU B 66 16.648 39.662 0.170 1.00 0.21 B +ATOM 3296 2HG GLU B 66 17.915 40.717 -0.360 1.00 0.22 B +ATOM 3297 N GLY B 67 19.425 35.957 -1.164 1.00 0.20 B +ATOM 3298 CA GLY B 67 20.507 35.436 -2.019 1.00 0.21 B +ATOM 3299 C GLY B 67 20.029 34.156 -2.681 1.00 0.21 B +ATOM 3300 O GLY B 67 18.888 33.755 -2.568 1.00 0.21 B +ATOM 3301 H GLY B 67 18.498 35.624 -1.255 1.00 0.20 B +ATOM 3302 1HA GLY B 67 20.773 36.174 -2.768 1.00 0.22 B +ATOM 3303 2HA GLY B 67 21.377 35.218 -1.418 1.00 0.20 B +ATOM 3304 N GLU B 68 20.935 33.536 -3.350 1.00 0.22 B +ATOM 3305 CA GLU B 68 20.711 32.275 -4.068 1.00 0.23 B +ATOM 3306 C GLU B 68 20.142 31.173 -3.184 1.00 0.22 B +ATOM 3307 O GLU B 68 19.299 30.436 -3.659 1.00 0.22 B +ATOM 3308 CB GLU B 68 22.102 31.787 -4.531 1.00 0.23 B +ATOM 3309 CG GLU B 68 22.077 31.007 -5.847 1.00 0.25 B +ATOM 3310 CD GLU B 68 23.504 31.001 -6.399 1.00 0.26 B +ATOM 3311 OE1 GLU B 68 24.399 30.748 -5.606 1.00 0.25 B +ATOM 3312 OE2 GLU B 68 23.678 31.278 -7.577 1.00 0.27 B +ATOM 3313 H GLU B 68 21.825 33.926 -3.388 1.00 0.22 B +ATOM 3314 HA GLU B 68 20.069 32.447 -4.918 1.00 0.23 B +ATOM 3315 1HB GLU B 68 22.740 32.649 -4.650 1.00 0.24 B +ATOM 3316 2HB GLU B 68 22.532 31.152 -3.763 1.00 0.23 B +ATOM 3317 1HG GLU B 68 21.762 29.989 -5.660 1.00 0.25 B +ATOM 3318 2HG GLU B 68 21.414 31.477 -6.551 1.00 0.25 B +ATOM 3319 N ASP B 69 20.601 30.990 -1.932 1.00 0.20 B +ATOM 3320 CA ASP B 69 20.024 29.843 -1.157 1.00 0.20 B +ATOM 3321 C ASP B 69 19.284 30.403 0.025 1.00 0.18 B +ATOM 3322 O ASP B 69 19.334 29.849 1.109 1.00 0.17 B +ATOM 3323 CB ASP B 69 21.163 28.906 -0.694 1.00 0.20 B +ATOM 3324 CG ASP B 69 22.301 29.706 -0.020 1.00 0.19 B +ATOM 3325 OD1 ASP B 69 22.058 30.827 0.412 1.00 0.18 B +ATOM 3326 OD2 ASP B 69 23.403 29.176 0.051 1.00 0.19 B +ATOM 3327 H ASP B 69 21.304 31.578 -1.542 1.00 0.20 B +ATOM 3328 HA ASP B 69 19.337 29.285 -1.783 1.00 0.20 B +ATOM 3329 1HB ASP B 69 20.769 28.189 0.011 1.00 0.19 B +ATOM 3330 2HB ASP B 69 21.560 28.379 -1.551 1.00 0.21 B +ATOM 3331 N GLU B 70 18.630 31.531 -0.149 1.00 0.18 B +ATOM 3332 CA GLU B 70 17.973 32.150 1.040 1.00 0.17 B +ATOM 3333 C GLU B 70 16.915 31.349 1.803 1.00 0.17 B +ATOM 3334 O GLU B 70 16.749 31.565 2.995 1.00 0.15 B +ATOM 3335 CB GLU B 70 17.418 33.500 0.593 1.00 0.18 B +ATOM 3336 CG GLU B 70 16.199 33.364 -0.350 1.00 0.19 B +ATOM 3337 CD GLU B 70 15.802 34.749 -0.903 1.00 0.20 B +ATOM 3338 OE1 GLU B 70 16.693 35.470 -1.324 1.00 0.20 B +ATOM 3339 OE2 GLU B 70 14.618 35.063 -0.902 1.00 0.20 B +ATOM 3340 H GLU B 70 18.612 31.995 -1.035 1.00 0.19 B +ATOM 3341 HA GLU B 70 18.728 32.315 1.784 1.00 0.16 B +ATOM 3342 1HB GLU B 70 17.121 34.057 1.467 1.00 0.17 B +ATOM 3343 2HB GLU B 70 18.198 34.041 0.079 1.00 0.18 B +ATOM 3344 1HG GLU B 70 16.451 32.717 -1.176 1.00 0.19 B +ATOM 3345 2HG GLU B 70 15.366 32.950 0.192 1.00 0.18 B +ATOM 3346 N GLN B 71 16.179 30.492 1.206 1.00 0.17 B +ATOM 3347 CA GLN B 71 15.119 29.765 2.004 1.00 0.17 B +ATOM 3348 C GLN B 71 15.771 28.642 2.834 1.00 0.17 B +ATOM 3349 O GLN B 71 15.469 28.439 3.995 1.00 0.16 B +ATOM 3350 CB GLN B 71 13.944 29.180 1.160 1.00 0.18 B +ATOM 3351 CG GLN B 71 13.728 29.752 -0.280 1.00 0.20 B +ATOM 3352 CD GLN B 71 12.376 30.498 -0.366 1.00 0.20 B +ATOM 3353 OE1 GLN B 71 12.265 31.586 0.163 1.00 0.19 B +ATOM 3354 NE2 GLN B 71 11.427 30.084 -1.185 1.00 0.21 B +ATOM 3355 H GLN B 71 16.276 30.343 0.256 1.00 0.18 B +ATOM 3356 HA GLN B 71 14.712 30.443 2.707 1.00 0.16 B +ATOM 3357 1HB GLN B 71 14.106 28.117 1.063 1.00 0.19 B +ATOM 3358 2HB GLN B 71 13.034 29.320 1.732 1.00 0.18 B +ATOM 3359 1HG GLN B 71 14.530 30.398 -0.551 1.00 0.19 B +ATOM 3360 2HG GLN B 71 13.681 28.915 -0.964 1.00 0.20 B +ATOM 3361 1HE2 GLN B 71 11.609 29.410 -1.852 1.00 0.22 B +ATOM 3362 2HE2 GLN B 71 10.505 30.258 -0.960 1.00 0.21 B +ATOM 3363 N LYS B 72 16.656 27.934 2.225 1.00 0.17 B +ATOM 3364 CA LYS B 72 17.375 26.846 2.870 1.00 0.17 B +ATOM 3365 C LYS B 72 18.199 27.462 3.991 1.00 0.16 B +ATOM 3366 O LYS B 72 18.319 26.898 5.057 1.00 0.16 B +ATOM 3367 CB LYS B 72 18.355 26.160 1.898 1.00 0.19 B +ATOM 3368 CG LYS B 72 18.606 24.736 2.440 1.00 0.19 B +ATOM 3369 CD LYS B 72 19.641 23.986 1.580 1.00 0.21 B +ATOM 3370 CE LYS B 72 21.014 24.023 2.246 1.00 0.20 B +ATOM 3371 NZ LYS B 72 21.027 23.108 3.427 1.00 0.20 B +ATOM 3372 H LYS B 72 16.858 28.143 1.311 1.00 0.18 B +ATOM 3373 HA LYS B 72 16.661 26.114 3.230 1.00 0.18 B +ATOM 3374 1HB LYS B 72 17.919 26.109 0.909 1.00 0.19 B +ATOM 3375 2HB LYS B 72 19.292 26.701 1.854 1.00 0.18 B +ATOM 3376 1HG LYS B 72 18.951 24.805 3.465 1.00 0.18 B +ATOM 3377 2HG LYS B 72 17.671 24.191 2.427 1.00 0.20 B +ATOM 3378 1HD LYS B 72 19.335 22.958 1.465 1.00 0.22 B +ATOM 3379 2HD LYS B 72 19.708 24.449 0.608 1.00 0.21 B +ATOM 3380 1HE LYS B 72 21.772 23.716 1.543 1.00 0.21 B +ATOM 3381 2HE LYS B 72 21.208 25.016 2.554 1.00 0.19 B +ATOM 3382 1HZ LYS B 72 20.652 23.605 4.262 1.00 0.19 B +ATOM 3383 2HZ LYS B 72 22.003 22.798 3.618 1.00 0.21 B +ATOM 3384 3HZ LYS B 72 20.433 22.279 3.226 1.00 0.21 B +ATOM 3385 N ALA B 73 18.810 28.627 3.743 1.00 0.15 B +ATOM 3386 CA ALA B 73 19.652 29.223 4.810 1.00 0.14 B +ATOM 3387 C ALA B 73 18.807 29.550 6.049 1.00 0.13 B +ATOM 3388 O ALA B 73 19.191 29.239 7.159 1.00 0.13 B +ATOM 3389 CB ALA B 73 20.334 30.492 4.259 1.00 0.14 B +ATOM 3390 H ALA B 73 18.728 29.082 2.867 1.00 0.16 B +ATOM 3391 HA ALA B 73 20.407 28.510 5.103 1.00 0.14 B +ATOM 3392 1HB ALA B 73 19.603 31.281 4.157 1.00 0.14 B +ATOM 3393 2HB ALA B 73 20.769 30.278 3.294 1.00 0.15 B +ATOM 3394 3HB ALA B 73 21.108 30.805 4.939 1.00 0.14 B +ATOM 3395 N VAL B 74 17.676 30.170 5.873 1.00 0.13 B +ATOM 3396 CA VAL B 74 16.807 30.541 7.045 1.00 0.12 B +ATOM 3397 C VAL B 74 16.243 29.267 7.650 1.00 0.13 B +ATOM 3398 O VAL B 74 16.155 29.130 8.866 1.00 0.12 B +ATOM 3399 CB VAL B 74 15.705 31.532 6.593 1.00 0.12 B +ATOM 3400 CG1 VAL B 74 14.668 31.781 7.705 1.00 0.12 B +ATOM 3401 CG2 VAL B 74 16.361 32.865 6.167 1.00 0.12 B +ATOM 3402 H VAL B 74 17.393 30.403 4.970 1.00 0.14 B +ATOM 3403 HA VAL B 74 17.409 31.014 7.794 1.00 0.11 B +ATOM 3404 HB VAL B 74 15.203 31.105 5.751 1.00 0.13 B +ATOM 3405 1HG1 VAL B 74 13.953 32.520 7.367 1.00 0.12 B +ATOM 3406 2HG1 VAL B 74 15.162 32.142 8.594 1.00 0.11 B +ATOM 3407 3HG1 VAL B 74 14.150 30.859 7.928 1.00 0.12 B +ATOM 3408 1HG2 VAL B 74 15.810 33.291 5.341 1.00 0.13 B +ATOM 3409 2HG2 VAL B 74 17.383 32.689 5.858 1.00 0.12 B +ATOM 3410 3HG2 VAL B 74 16.356 33.560 6.993 1.00 0.12 B +ATOM 3411 N GLU B 75 15.871 28.332 6.806 1.00 0.14 B +ATOM 3412 CA GLU B 75 15.294 27.046 7.326 1.00 0.15 B +ATOM 3413 C GLU B 75 16.283 26.387 8.243 1.00 0.15 B +ATOM 3414 O GLU B 75 15.953 25.933 9.326 1.00 0.15 B +ATOM 3415 CB GLU B 75 14.881 26.071 6.189 1.00 0.16 B +ATOM 3416 CG GLU B 75 13.539 26.619 5.658 1.00 0.17 B +ATOM 3417 CD GLU B 75 13.027 25.980 4.367 1.00 0.18 B +ATOM 3418 OE1 GLU B 75 13.613 25.028 3.877 1.00 0.19 B +ATOM 3419 OE2 GLU B 75 12.027 26.495 3.882 1.00 0.18 B +ATOM 3420 H GLU B 75 15.953 28.493 5.842 1.00 0.14 B +ATOM 3421 HA GLU B 75 14.416 27.289 7.895 1.00 0.15 B +ATOM 3422 1HB GLU B 75 15.622 26.067 5.405 1.00 0.17 B +ATOM 3423 2HB GLU B 75 14.744 25.074 6.587 1.00 0.17 B +ATOM 3424 1HG GLU B 75 12.794 26.470 6.418 1.00 0.17 B +ATOM 3425 2HG GLU B 75 13.650 27.681 5.490 1.00 0.16 B +ATOM 3426 N HIS B 76 17.492 26.324 7.819 1.00 0.15 B +ATOM 3427 CA HIS B 76 18.525 25.686 8.637 1.00 0.15 B +ATOM 3428 C HIS B 76 18.900 26.490 9.861 1.00 0.13 B +ATOM 3429 O HIS B 76 19.221 25.910 10.884 1.00 0.14 B +ATOM 3430 CB HIS B 76 19.771 25.441 7.750 1.00 0.15 B +ATOM 3431 CG HIS B 76 19.368 24.390 6.747 1.00 0.17 B +ATOM 3432 ND1 HIS B 76 20.129 23.266 6.459 1.00 0.18 B +ATOM 3433 CD2 HIS B 76 18.234 24.270 5.991 1.00 0.17 B +ATOM 3434 CE1 HIS B 76 19.435 22.533 5.561 1.00 0.19 B +ATOM 3435 NE2 HIS B 76 18.278 23.105 5.247 1.00 0.19 B +ATOM 3436 H HIS B 76 17.721 26.684 6.936 1.00 0.15 B +ATOM 3437 HA HIS B 76 18.155 24.745 8.992 1.00 0.16 B +ATOM 3438 1HB HIS B 76 20.052 26.356 7.239 1.00 0.15 B +ATOM 3439 2HB HIS B 76 20.596 25.086 8.349 1.00 0.16 B +ATOM 3440 HD2 HIS B 76 17.424 24.966 5.986 1.00 0.17 B +ATOM 3441 HE1 HIS B 76 19.776 21.597 5.145 1.00 0.21 B +ATOM 3442 N LEU B 77 18.922 27.789 9.794 1.00 0.12 B +ATOM 3443 CA LEU B 77 19.387 28.553 10.985 1.00 0.11 B +ATOM 3444 C LEU B 77 18.312 28.674 12.023 1.00 0.11 B +ATOM 3445 O LEU B 77 18.603 28.822 13.199 1.00 0.11 B +ATOM 3446 CB LEU B 77 19.939 29.927 10.535 1.00 0.10 B +ATOM 3447 CG LEU B 77 21.229 29.750 9.700 1.00 0.11 B +ATOM 3448 CD1 LEU B 77 21.642 31.122 9.180 1.00 0.10 B +ATOM 3449 CD2 LEU B 77 22.399 29.243 10.560 1.00 0.11 B +ATOM 3450 H LEU B 77 18.682 28.265 8.967 1.00 0.12 B +ATOM 3451 HA LEU B 77 20.172 28.001 11.462 1.00 0.12 B +ATOM 3452 1HB LEU B 77 19.197 30.433 9.932 1.00 0.10 B +ATOM 3453 2HB LEU B 77 20.162 30.527 11.402 1.00 0.10 B +ATOM 3454 HG LEU B 77 21.046 29.073 8.872 1.00 0.12 B +ATOM 3455 1HD1 LEU B 77 20.829 31.564 8.630 1.00 0.10 B +ATOM 3456 2HD1 LEU B 77 22.506 31.019 8.541 1.00 0.11 B +ATOM 3457 3HD1 LEU B 77 21.893 31.751 10.023 1.00 0.10 B +ATOM 3458 1HD2 LEU B 77 23.329 29.402 10.028 1.00 0.12 B +ATOM 3459 2HD2 LEU B 77 22.291 28.193 10.768 1.00 0.12 B +ATOM 3460 3HD2 LEU B 77 22.424 29.799 11.486 1.00 0.10 B +ATOM 3461 N VAL B 78 17.091 28.596 11.620 1.00 0.11 B +ATOM 3462 CA VAL B 78 16.008 28.692 12.580 1.00 0.12 B +ATOM 3463 C VAL B 78 16.003 27.377 13.351 1.00 0.13 B +ATOM 3464 O VAL B 78 15.791 27.343 14.554 1.00 0.13 B +ATOM 3465 CB VAL B 78 14.735 28.939 11.757 1.00 0.12 B +ATOM 3466 CG1 VAL B 78 13.539 28.310 12.469 1.00 0.13 B +ATOM 3467 CG2 VAL B 78 14.463 30.445 11.623 1.00 0.11 B +ATOM 3468 H VAL B 78 16.889 28.468 10.669 1.00 0.12 B +ATOM 3469 HA VAL B 78 16.182 29.506 13.268 1.00 0.11 B +ATOM 3470 HB VAL B 78 14.849 28.499 10.774 1.00 0.12 B +ATOM 3471 1HG1 VAL B 78 12.624 28.657 12.012 1.00 0.13 B +ATOM 3472 2HG1 VAL B 78 13.556 28.604 13.509 1.00 0.13 B +ATOM 3473 3HG1 VAL B 78 13.597 27.237 12.395 1.00 0.14 B +ATOM 3474 1HG2 VAL B 78 13.447 30.586 11.307 1.00 0.12 B +ATOM 3475 2HG2 VAL B 78 15.127 30.877 10.895 1.00 0.11 B +ATOM 3476 3HG2 VAL B 78 14.602 30.929 12.580 1.00 0.11 B +ATOM 3477 N LYS B 79 16.249 26.299 12.641 1.00 0.14 B +ATOM 3478 CA LYS B 79 16.268 24.971 13.286 1.00 0.15 B +ATOM 3479 C LYS B 79 17.490 24.920 14.197 1.00 0.15 B +ATOM 3480 O LYS B 79 17.394 24.574 15.362 1.00 0.16 B +ATOM 3481 CB LYS B 79 16.265 23.894 12.222 1.00 0.17 B +ATOM 3482 CG LYS B 79 16.173 22.539 12.911 1.00 0.18 B +ATOM 3483 CD LYS B 79 15.783 21.467 11.871 1.00 0.20 B +ATOM 3484 CE LYS B 79 16.881 20.402 11.748 1.00 0.21 B +ATOM 3485 NZ LYS B 79 17.160 20.233 10.304 1.00 0.21 B +ATOM 3486 H LYS B 79 16.416 26.388 11.677 1.00 0.14 B +ATOM 3487 HA LYS B 79 15.386 24.860 13.897 1.00 0.16 B +ATOM 3488 1HB LYS B 79 15.406 24.040 11.578 1.00 0.17 B +ATOM 3489 2HB LYS B 79 17.171 23.947 11.636 1.00 0.16 B +ATOM 3490 1HG LYS B 79 17.129 22.317 13.359 1.00 0.18 B +ATOM 3491 2HG LYS B 79 15.427 22.571 13.692 1.00 0.18 B +ATOM 3492 1HD LYS B 79 14.851 21.000 12.163 1.00 0.20 B +ATOM 3493 2HD LYS B 79 15.640 21.927 10.898 1.00 0.19 B +ATOM 3494 1HE LYS B 79 17.787 20.713 12.250 1.00 0.20 B +ATOM 3495 2HE LYS B 79 16.540 19.469 12.169 1.00 0.22 B +ATOM 3496 1HZ LYS B 79 16.263 20.263 9.778 1.00 0.21 B +ATOM 3497 2HZ LYS B 79 17.632 19.326 10.143 1.00 0.22 B +ATOM 3498 3HZ LYS B 79 17.771 21.012 9.980 1.00 0.20 B +ATOM 3499 N LEU B 80 18.638 25.300 13.704 1.00 0.15 B +ATOM 3500 CA LEU B 80 19.809 25.322 14.581 1.00 0.15 B +ATOM 3501 C LEU B 80 19.541 26.193 15.829 1.00 0.14 B +ATOM 3502 O LEU B 80 19.814 25.796 16.949 1.00 0.15 B +ATOM 3503 CB LEU B 80 20.977 25.916 13.778 1.00 0.14 B +ATOM 3504 CG LEU B 80 22.248 25.864 14.593 1.00 0.14 B +ATOM 3505 CD1 LEU B 80 22.514 24.445 15.113 1.00 0.16 B +ATOM 3506 CD2 LEU B 80 23.416 26.304 13.731 1.00 0.14 B +ATOM 3507 H LEU B 80 18.721 25.579 12.765 1.00 0.14 B +ATOM 3508 HA LEU B 80 20.038 24.325 14.889 1.00 0.16 B +ATOM 3509 1HB LEU B 80 21.117 25.351 12.870 1.00 0.14 B +ATOM 3510 2HB LEU B 80 20.756 26.945 13.529 1.00 0.13 B +ATOM 3511 HG LEU B 80 22.133 26.530 15.379 1.00 0.14 B +ATOM 3512 1HD1 LEU B 80 21.872 24.240 15.947 1.00 0.16 B +ATOM 3513 2HD1 LEU B 80 23.543 24.353 15.418 1.00 0.16 B +ATOM 3514 3HD1 LEU B 80 22.312 23.736 14.331 1.00 0.17 B +ATOM 3515 1HD2 LEU B 80 23.257 27.319 13.404 1.00 0.13 B +ATOM 3516 2HD2 LEU B 80 23.485 25.652 12.877 1.00 0.15 B +ATOM 3517 3HD2 LEU B 80 24.331 26.246 14.305 1.00 0.14 B +ATOM 3518 N MET B 81 19.009 27.376 15.650 1.00 0.13 B +ATOM 3519 CA MET B 81 18.772 28.275 16.803 1.00 0.12 B +ATOM 3520 C MET B 81 17.807 27.701 17.833 1.00 0.13 B +ATOM 3521 O MET B 81 17.933 27.941 19.021 1.00 0.14 B +ATOM 3522 CB MET B 81 18.237 29.656 16.365 1.00 0.11 B +ATOM 3523 CG MET B 81 18.560 30.632 17.519 1.00 0.11 B +ATOM 3524 SD MET B 81 18.693 32.312 16.876 1.00 0.09 B +ATOM 3525 CE MET B 81 20.484 32.566 17.066 1.00 0.09 B +ATOM 3526 H MET B 81 18.775 27.669 14.752 1.00 0.12 B +ATOM 3527 HA MET B 81 19.714 28.415 17.296 1.00 0.12 B +ATOM 3528 1HB MET B 81 18.726 29.978 15.453 1.00 0.10 B +ATOM 3529 2HB MET B 81 17.167 29.616 16.212 1.00 0.11 B +ATOM 3530 1HG MET B 81 17.774 30.582 18.257 1.00 0.11 B +ATOM 3531 2HG MET B 81 19.498 30.360 17.992 1.00 0.11 B +ATOM 3532 1HE MET B 81 20.730 33.570 16.748 1.00 0.09 B +ATOM 3533 2HE MET B 81 21.026 31.859 16.457 1.00 0.09 B +ATOM 3534 3HE MET B 81 20.764 32.435 18.102 1.00 0.10 B +ATOM 3535 N ALA B 82 16.837 26.983 17.400 1.00 0.14 B +ATOM 3536 CA ALA B 82 15.837 26.413 18.361 1.00 0.15 B +ATOM 3537 C ALA B 82 16.461 25.188 19.064 1.00 0.17 B +ATOM 3538 O ALA B 82 16.140 24.892 20.199 1.00 0.18 B +ATOM 3539 CB ALA B 82 14.538 26.054 17.626 1.00 0.16 B +ATOM 3540 H ALA B 82 16.751 26.816 16.441 1.00 0.14 B +ATOM 3541 HA ALA B 82 15.612 27.152 19.117 1.00 0.15 B +ATOM 3542 1HB ALA B 82 14.159 26.931 17.119 1.00 0.15 B +ATOM 3543 2HB ALA B 82 13.804 25.712 18.341 1.00 0.17 B +ATOM 3544 3HB ALA B 82 14.731 25.276 16.906 1.00 0.16 B +ATOM 3545 N GLU B 83 17.366 24.497 18.390 1.00 0.17 B +ATOM 3546 CA GLU B 83 18.059 23.308 18.950 1.00 0.19 B +ATOM 3547 C GLU B 83 19.156 23.708 19.954 1.00 0.19 B +ATOM 3548 O GLU B 83 19.446 23.005 20.896 1.00 0.20 B +ATOM 3549 CB GLU B 83 18.873 22.627 17.841 1.00 0.19 B +ATOM 3550 CG GLU B 83 18.067 21.572 17.098 1.00 0.20 B +ATOM 3551 CD GLU B 83 18.747 21.236 15.761 1.00 0.20 B +ATOM 3552 OE1 GLU B 83 19.692 21.925 15.393 1.00 0.19 B +ATOM 3553 OE2 GLU B 83 18.303 20.297 15.124 1.00 0.21 B +ATOM 3554 H GLU B 83 17.604 24.775 17.490 1.00 0.16 B +ATOM 3555 HA GLU B 83 17.327 22.619 19.351 1.00 0.20 B +ATOM 3556 1HB GLU B 83 19.198 23.381 17.142 1.00 0.18 B +ATOM 3557 2HB GLU B 83 19.751 22.148 18.267 1.00 0.20 B +ATOM 3558 1HG GLU B 83 18.023 20.678 17.704 1.00 0.21 B +ATOM 3559 2HG GLU B 83 17.074 21.937 16.916 1.00 0.20 B +ATOM 3560 N LEU B 84 19.834 24.791 19.676 1.00 0.17 B +ATOM 3561 CA LEU B 84 20.966 25.223 20.523 1.00 0.17 B +ATOM 3562 C LEU B 84 20.582 25.387 22.015 1.00 0.18 B +ATOM 3563 O LEU B 84 19.632 26.008 22.441 1.00 0.18 B +ATOM 3564 CB LEU B 84 21.588 26.445 19.840 1.00 0.16 B +ATOM 3565 CG LEU B 84 22.725 26.110 18.848 1.00 0.16 B +ATOM 3566 CD1 LEU B 84 22.733 24.651 18.365 1.00 0.17 B +ATOM 3567 CD2 LEU B 84 22.539 27.020 17.654 1.00 0.14 B +ATOM 3568 H LEU B 84 19.614 25.315 18.875 1.00 0.16 B +ATOM 3569 HA LEU B 84 21.688 24.444 20.575 1.00 0.18 B +ATOM 3570 1HB LEU B 84 20.797 26.964 19.316 1.00 0.15 B +ATOM 3571 2HB LEU B 84 21.978 27.104 20.600 1.00 0.15 B +ATOM 3572 HG LEU B 84 23.674 26.324 19.303 1.00 0.16 B +ATOM 3573 1HD1 LEU B 84 21.737 24.355 18.077 1.00 0.17 B +ATOM 3574 2HD1 LEU B 84 23.094 24.003 19.143 1.00 0.18 B +ATOM 3575 3HD1 LEU B 84 23.398 24.570 17.535 1.00 0.17 B +ATOM 3576 1HD2 LEU B 84 21.612 26.771 17.189 1.00 0.14 B +ATOM 3577 2HD2 LEU B 84 23.349 26.884 16.964 1.00 0.14 B +ATOM 3578 3HD2 LEU B 84 22.497 28.045 17.972 1.00 0.13 B +ATOM 3579 N GLU B 85 21.427 24.691 22.731 1.00 0.19 B +ATOM 3580 CA GLU B 85 21.525 24.453 24.184 1.00 0.21 B +ATOM 3581 C GLU B 85 22.437 25.489 24.855 1.00 0.20 B +ATOM 3582 CB GLU B 85 22.141 23.025 24.360 1.00 0.22 B +ATOM 3583 CG GLU B 85 22.868 22.434 23.118 1.00 0.22 B +ATOM 3584 CD GLU B 85 24.090 23.197 22.572 1.00 0.21 B +ATOM 3585 OE1 GLU B 85 24.772 23.914 23.293 1.00 0.21 B +ATOM 3586 OE2 GLU B 85 24.340 22.985 21.394 1.00 0.21 B +ATOM 3587 H GLU B 85 22.091 24.246 22.217 1.00 0.20 B +ATOM 3588 HA GLU B 85 20.562 24.488 24.655 1.00 0.21 B +ATOM 3589 1HB GLU B 85 22.827 23.024 25.187 1.00 0.23 B +ATOM 3590 2HB GLU B 85 21.329 22.348 24.599 1.00 0.23 B +ATOM 3591 1HG GLU B 85 23.217 21.453 23.393 1.00 0.24 B +ATOM 3592 2HG GLU B 85 22.156 22.328 22.322 1.00 0.22 B +TER 3593 GLU B 385 +END diff --git a/examples/thirdparty/prodigy/prodigy-protein-ligand-test.cfg b/examples/thirdparty/prodigy/prodigy-protein-ligand-test.cfg new file mode 100644 index 000000000..89abcd16a --- /dev/null +++ b/examples/thirdparty/prodigy/prodigy-protein-ligand-test.cfg @@ -0,0 +1,5 @@ +run_dir = "run-prodigy-prot-lig" +molecules = "data/prot-lig.pdb" +[topoaa] +[prodigy] +scoring_mode = "ligand" diff --git a/examples/thirdparty/prodigy/prodigy-protein-protein-test.cfg b/examples/thirdparty/prodigy/prodigy-protein-protein-test.cfg new file mode 100644 index 000000000..be7221384 --- /dev/null +++ b/examples/thirdparty/prodigy/prodigy-protein-protein-test.cfg @@ -0,0 +1,10 @@ + +run_dir = "run-prodigy-prot-prot" +molecules = [ + "data/prot-prot.pdb", + "data/homotrimer.pdb", + ] +postprocess=false +clean=false +[topoaa] +[prodigy] From f72c208980aa5cca727ded90cf7d18326ad5c2e5 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Wed, 2 Oct 2024 10:13:38 +0200 Subject: [PATCH 03/16] using prodigy as library (v3) --- .../modules/scoring/prodigy/__init__.py | 2 +- .../modules/scoring/prodigy/defaults.yaml | 37 ++- .../modules/scoring/prodigy/prodigy.py | 11 +- .../modules/scoring/prodigy/prodigyv2.py | 11 +- .../modules/scoring/prodigy/prodigyv3.py | 284 ++++++++++++++++++ 5 files changed, 325 insertions(+), 20 deletions(-) create mode 100644 src/haddock/modules/scoring/prodigy/prodigyv3.py diff --git a/src/haddock/modules/scoring/prodigy/__init__.py b/src/haddock/modules/scoring/prodigy/__init__.py index d7b49cece..ef36f387b 100644 --- a/src/haddock/modules/scoring/prodigy/__init__.py +++ b/src/haddock/modules/scoring/prodigy/__init__.py @@ -11,7 +11,7 @@ from haddock.libs.libontology import PDBFile from haddock.modules import get_engine from haddock.modules.scoring import ScoringModule -from haddock.modules.scoring.prodigy.prodigy import AnyProdigyJob, CheckInstall +from haddock.modules.scoring.prodigy.prodigyv3 import AnyProdigyJob, CheckInstall RECIPE_PATH = Path(__file__).resolve().parent diff --git a/src/haddock/modules/scoring/prodigy/defaults.yaml b/src/haddock/modules/scoring/prodigy/defaults.yaml index da43ac84f..2ea14e2f5 100644 --- a/src/haddock/modules/scoring/prodigy/defaults.yaml +++ b/src/haddock/modules/scoring/prodigy/defaults.yaml @@ -1,8 +1,8 @@ scoring_mode: default: protein type: string - minchars: 1 - maxchars: 20 + minchars: 6 + maxchars: 7 choices: - protein - ligand @@ -12,6 +12,36 @@ scoring_mode: molecule is involved. group: scoring explevel: easy +chains: + default: ["A", "B"] + type: list + minitems: 2 + maxitems: 2 + title: Chains to be scored. + short: Chains to be scored. + long: Chains to be scored. + group: scoring + explevel: easy +ligand_resname: + default: UNK + type: string + minchars: 1 + maxchars: 3 + title: Residue name of the ligand + short: Residue name of the ligand + long: Residue name of the ligand to score. Only used for prodigy-ligand. + group: scoring + explevel: easy +ligand_chain: + default: B + type: string + minchars: 1 + maxchars: 1 + title: Chain of the ligand + short: Chain of the ligand + long: Chain of the ligand to score. Only used for prodigy-ligand. + group: scoring + explevel: easy distance_cutoff: default: .nan type: float @@ -34,6 +64,7 @@ accessibility_cutoff: title: Add text short: Add text long: Add text + Not used in prodigy-lig. group: scoring explevel: expert temperature: @@ -54,4 +85,4 @@ to_pkd: short: Add text long: Add text group: conversion - explevel: expert \ No newline at end of file + explevel: easy \ No newline at end of file diff --git a/src/haddock/modules/scoring/prodigy/prodigy.py b/src/haddock/modules/scoring/prodigy/prodigy.py index 179e2f551..969c95818 100644 --- a/src/haddock/modules/scoring/prodigy/prodigy.py +++ b/src/haddock/modules/scoring/prodigy/prodigy.py @@ -30,7 +30,7 @@ def __init__(self): """ try: self.run_helps() - except FileNotFoundError: + except ModuleNotFoundError: raise ModuleError( "Issue detected with the installation of Prodigy. " "Consider installing it with: " @@ -40,13 +40,8 @@ def __init__(self): @staticmethod def run_helps() -> None: """Run prodigy CLI with help.""" - for ext in ("",):#"-lig"): - prodigy_help = subprocess.Popen( - [f"prodigy{ext}", "--help"], - stdout=subprocess.PIPE, - stderr=subprocess.PIPE, - ) - _help_string = prodigy_help.stdout.read().decode('utf-8') + import prodigy + #import prodigy_lig return None diff --git a/src/haddock/modules/scoring/prodigy/prodigyv2.py b/src/haddock/modules/scoring/prodigy/prodigyv2.py index 179e2f551..969c95818 100644 --- a/src/haddock/modules/scoring/prodigy/prodigyv2.py +++ b/src/haddock/modules/scoring/prodigy/prodigyv2.py @@ -30,7 +30,7 @@ def __init__(self): """ try: self.run_helps() - except FileNotFoundError: + except ModuleNotFoundError: raise ModuleError( "Issue detected with the installation of Prodigy. " "Consider installing it with: " @@ -40,13 +40,8 @@ def __init__(self): @staticmethod def run_helps() -> None: """Run prodigy CLI with help.""" - for ext in ("",):#"-lig"): - prodigy_help = subprocess.Popen( - [f"prodigy{ext}", "--help"], - stdout=subprocess.PIPE, - stderr=subprocess.PIPE, - ) - _help_string = prodigy_help.stdout.read().decode('utf-8') + import prodigy + #import prodigy_lig return None diff --git a/src/haddock/modules/scoring/prodigy/prodigyv3.py b/src/haddock/modules/scoring/prodigy/prodigyv3.py new file mode 100644 index 000000000..9682b43bb --- /dev/null +++ b/src/haddock/modules/scoring/prodigy/prodigyv3.py @@ -0,0 +1,284 @@ +"""Set of functionalities to run prodigy.""" + +from abc import ABC, abstractmethod + +import numpy as np + +from haddock.core.exceptions import ModuleError +from haddock.core.typing import FilePath, Optional, ParamDict, Union +from haddock.libs.libontology import PDBFile + + +# Define conversion constants +R_GAZ_CONST = 8.314 +CALS_TO_JOULES = 4.184 +KELVIN_TO_CELCIUS = 273.15 + + +class CheckInstall: + """Verify that installation of prodigy is ok.""" + + def __init__(self): + """Verify that installation of prodigy is ok. + + Raises + ------ + ModuleError + Raised when prodigy subprocess failed. + """ + try: + self.run_helps() + except ModuleNotFoundError: + raise ModuleError( + "Issue detected with the installation of Prodigy. " + "Consider installing it with: " + "pip install prodigy-prot prodigy-lig" + ) + + @staticmethod + def run_helps() -> None: + """Run prodigy CLI with help.""" + import prodigy_prot.predict_IC + #import prodigy_lig.prodigy_lig + return None + + +class ProdigyWorker(ABC): + def __init__(self, model: FilePath, params: ParamDict): + # Use by both prodigy -prot and -lig + self.model = model + self.topKd = params["to_pkd"] + self.temperature = params["temperature"] + self.dist_cutoff = self.set_distance_cutoff(params["distance_cutoff"]) + self.chains = params["chains"] + # Only used by prodigy-prot + self.acc_cutoff = params["accessibility_cutoff"] + # Only used by prodigy-lig + self.lig_resname = params["ligand_resname"] + self.lig_chain = params["ligand_chain"] + # Output values + self.score = None + self.error = None + + def _run(self) -> None: + """Main computation function.""" + self.score = self.pkd_converter(self.evaluate_complex()) + + def run(self) -> None: + """Wrapper of the run function.""" + try: + self._run() + except ModuleError as error: + self.error = error + + def pkd_converter(self, deltaG: float) -> float: + """Decide if deltaG must be converted to pKd. + + Parameters + ---------- + deltaG : float + Input DeltaG value + + Returns + ------- + score : float + The converted DeltaG to pKd if self.topKd is true, + else the input DeltaG. + """ + if self.topKd: + score = self.deltaG_to_pKd( + deltaG, + kelvins=self.temperature + KELVIN_TO_CELCIUS, + ) + else: + score = deltaG + return round(score, 3) + + @staticmethod + def deltaG_to_pKd(deltaG: float, kelvins: float = 298.3) -> float: + """Convert a deltaG (in Kcal/mol) to pKd. + + Parameters + ---------- + deltaG : float + DeltaG value (in Kcal/mol) + kelvins : float, optional + Temperature at which to perform the conversion. + By default 298.3 (25 degrees Celcius) + + Returns + ------- + pKd : float + The corresponding pKd value at given temperature. + """ + # Convert Kcals to joules + deltaG_joules = deltaG * CALS_TO_JOULES * 1000 + # Use formula + Kd = np.exp(-deltaG_joules / (R_GAZ_CONST * kelvins)) + # Convert to pKd + _pKd = np.log10(Kd) + # Reduce number of decimals + pKd = round(_pKd, 2) + return -pKd + + @abstractmethod + def evaluate_complex(self) -> None: + pass + + @abstractmethod + def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + pass + + +class ProdigyProtein(ProdigyWorker): + def __init__(self, model: FilePath, params: ParamDict): + super().__init__(model, params) + + def evaluate_complex(self) -> float: + from prodigy_prot.predict_IC import parse_structure, Prodigy + structure, _n_chains, _n_res = parse_structure(self.model) + prodigy = Prodigy(structure, self.chains, self.temperature) + prodigy.predict( + distance_cutoff=self.dist_cutoff, + acc_threshold=self.acc_cutoff, + ) + return prodigy.ba_val + + @staticmethod + def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + """Set distance cutoff to use for analysis of contacts. + + Parameters + ---------- + _dist_cutoff : Optional[float] + Distance set by the user. Can be None if undefined. + + Returns + ------- + dist_cutoff : float + The distance cutoff to use for this run. + Set to default software value (5.5) if undefined. + """ + # User defined value + if not np.isnan(_dist_cutoff): + dist_cutoff = _dist_cutoff + # Not defined case + else: + dist_cutoff = 5.5 + return dist_cutoff + + +class ProdigyLigand(ProdigyWorker): + def __init__(self, model: FilePath, params: ParamDict): + super().__init__(model, params) + + def evaluate_complex(self) -> float: + from prodigy_lig.prodigy_lig import ( + basename, + extract_electrostatics, + FastMMCIFParser, + PDBParser, + ProdigyLig, + splitext, + ) + fname, s_ext = splitext(basename(self.model)) + if s_ext in (".pdb", ".ent", ): + parser = PDBParser(QUIET=1) + elif s_ext == ".cif": + parser = FastMMCIFParser(QUIET=1) + + with open(self.model) as in_file: + # try to set electrostatics from input file if not provided by user + electrostatics = False + try: + electrostatics = extract_electrostatics(in_file) + except Exception: + pass + prodigy_lig = ProdigyLig( + parser.get_structure(fname, in_file), + chains=[ + ":".join(self.chains), + f"{self.lig_chain}:{self.lig_resname}", + ], + electrostatics=electrostatics, + cutoff=self.dist_cutoff, + ) + prodigy_lig.predict() + if prodigy_lig.dg_elec: + return prodigy_lig.dg_elec + return prodigy_lig.dg + + @staticmethod + def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + """Set distance cutoff to use for analysis of contacts. + + Parameters + ---------- + _dist_cutoff : Optional[float] + Distance set by the user. Can be None if undefined. + + Returns + ------- + dist_cutoff : float + The distance cutoff to use for this run. + Set to default software value (10.5) if undefined. + """ + # User defined value + if not np.isnan(_dist_cutoff): + dist_cutoff = _dist_cutoff + # Not defined case + else: + dist_cutoff = 10.5 + return dist_cutoff + + +class ModelScore: + """Simple class for holding score for a model.""" + + def __init__(self, model_index: int): + self.index = model_index + self.score = None + self.error = None + + +class AnyProdigyJob: + """Managing the computation of prodigy scores within haddock3.""" + + def __init__(self, model: PDBFile, params: ParamDict, index: int = 1): + worker = self.get_worker(params["scoring_mode"]) + self.worker = worker(model.rel_path, params) + self.score = ModelScore(index) + + def _run(self) -> ModelScore: + """Main computation function.""" + try: + self.worker.run() + except Exception as e: + print(e) + else: + self.score.score = self.worker.score + self.score.error = self.worker.error + return self.score + + def run(self) -> ModelScore: + """Wrapper to the _run function.""" + return self._run() + + @staticmethod + def get_worker(mode: str) -> Union[ProdigyProtein, ProdigyLigand]: + """Find appropriated class that will handle the computation. + + Parameters + ---------- + mode : str + Prodigy scoring mode, either protein or ligand + + Returns + ------- + Union[ProdigyProt, ProdigyLig] + The prodigy class that will handle the computation + """ + if mode == "protein": + return ProdigyProtein + else: + return ProdigyLigand From 52024eaff4bcf8ea764b11c7d131d37691743761 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Wed, 2 Oct 2024 10:14:32 +0200 Subject: [PATCH 04/16] update examples with ligands --- .../prodigy/data/ligand-prodrg.param | 137 +++++++++++++++ .../thirdparty/prodigy/data/ligand-prodrg.top | 161 ++++++++++++++++++ .../prodigy/prodigy-protein-ligand-test.cfg | 7 + 3 files changed, 305 insertions(+) create mode 100644 examples/thirdparty/prodigy/data/ligand-prodrg.param create mode 100644 examples/thirdparty/prodigy/data/ligand-prodrg.top diff --git a/examples/thirdparty/prodigy/data/ligand-prodrg.param b/examples/thirdparty/prodigy/data/ligand-prodrg.param new file mode 100644 index 000000000..74de15e0d --- /dev/null +++ b/examples/thirdparty/prodigy/data/ligand-prodrg.param @@ -0,0 +1,137 @@ +! Put in this file your ligand parameters if needed +! +! +! This file was generated by PRODRG version 070118.0614 +! PRODRG written/copyrighted by Daan van Aalten +! and Alexander Schuettelkopf +! +! Questions/comments to dava@davapc1.bioch.dundee.ac.uk +! +! When using this software in a publication, cite: +! A. W. Schuettelkopf and D. M. F. van Aalten (2004). +! PRODRG - a tool for high-throughput crystallography +! of protein-ligand complexes. +! Acta Crystallogr. D60, 1355--1363. +! +! +! *** NOTE *** IF YOU USE MORE THAN ONE PRODRG-GENERATED TOPOLOGY IN CNS, +! PLEASE CAREFULLY READ THE FAQ AS THIS MAY CAUSE PROBLEMS +! +! +set echo=off message=on end + +evaluate ($pd_x = 1.0) + +eval ($pd_v=$pd_x* 16000.0) BOND CA82 CA81 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND CA81 CA8 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND CA8 CA9 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND CA8 OA7 $pd_v 1.435 +eval ($pd_v=$pd_x* 16000.0) BOND CA9 CA91 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND OA7 CA6 $pd_v 1.435 +eval ($pd_v=$pd_x* 20000.0) BOND CA6 CA7 $pd_v 1.390 +eval ($pd_v=$pd_x* 16000.0) BOND CA6 CA5 $pd_v 1.530 +eval ($pd_v=$pd_x* 20000.0) BOND CA7 CA2 $pd_v 1.390 +eval ($pd_v=$pd_x* 16000.0) BOND CA2 CA1 $pd_v 1.530 +eval ($pd_v=$pd_x* 16000.0) BOND CA2 CA3 $pd_v 1.530 +eval ($pd_v=$pd_x* 20000.0) BOND CA1 OA1B $pd_v 1.250 +eval ($pd_v=$pd_x* 20000.0) BOND CA1 OA1A $pd_v 1.250 +eval ($pd_v=$pd_x* 16000.0) BOND CA3 CA4 $pd_v 1.530 +eval ($pd_v=$pd_x* 18000.0) BOND CA4 NA4 $pd_v 1.470 +eval ($pd_v=$pd_x* 16000.0) BOND CA4 CA5 $pd_v 1.530 +eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAB $pd_v 1.000 +eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAC $pd_v 1.000 +eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAA $pd_v 1.000 +eval ($pd_v=$pd_x* 18000.0) BOND CA5 NA5 $pd_v 1.470 +eval ($pd_v=$pd_x* 17900.0) BOND NA5 HAAD $pd_v 1.000 +eval ($pd_v=$pd_x* 20000.0) BOND NA5 CA10 $pd_v 1.330 +eval ($pd_v=$pd_x* 16000.0) BOND CA10 CA11 $pd_v 1.530 +eval ($pd_v=$pd_x* 24000.0) BOND CA10 OA10 $pd_v 1.230 + +eval ($pd_v=$pd_x* 880.0) ANGLE CA82 CA81 CA8 $pd_v 111.000 +eval ($pd_v=$pd_x* 480.0) ANGLE CA81 CA8 CA9 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE CA81 CA8 OA7 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE CA9 CA8 OA7 $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA8 CA9 CA91 $pd_v 111.000 +eval ($pd_v=$pd_x* 640.0) ANGLE CA8 OA7 CA6 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE OA7 CA6 CA7 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE OA7 CA6 CA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE CA7 CA6 CA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 800.0) ANGLE CA6 CA7 CA2 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA7 CA2 CA1 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA7 CA2 CA3 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA1 CA2 CA3 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA2 CA1 OA1B $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA2 CA1 OA1A $pd_v 120.000 +eval ($pd_v=$pd_x* 960.0) ANGLE OA1B CA1 OA1A $pd_v 126.000 +eval ($pd_v=$pd_x* 880.0) ANGLE CA2 CA3 CA4 $pd_v 111.000 +eval ($pd_v=$pd_x* 880.0) ANGLE CA3 CA4 NA4 $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA3 CA4 CA5 $pd_v 111.000 +eval ($pd_v=$pd_x* 880.0) ANGLE NA4 CA4 CA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAB $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAC $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAA $pd_v 109.500 +eval ($pd_v=$pd_x* 640.0) ANGLE HAAB NA4 HAAC $pd_v 109.500 +eval ($pd_v=$pd_x* 640.0) ANGLE HAAB NA4 HAAA $pd_v 109.500 +eval ($pd_v=$pd_x* 640.0) ANGLE HAAC NA4 HAAA $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA6 CA5 CA4 $pd_v 111.000 +eval ($pd_v=$pd_x* 880.0) ANGLE CA6 CA5 NA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA4 CA5 NA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA5 NA5 HAAD $pd_v 115.000 +eval ($pd_v=$pd_x* 960.0) ANGLE CA5 NA5 CA10 $pd_v 122.000 +eval ($pd_v=$pd_x* 560.0) ANGLE HAAD NA5 CA10 $pd_v 123.000 +eval ($pd_v=$pd_x* 960.0) ANGLE NA5 CA10 CA11 $pd_v 115.000 +eval ($pd_v=$pd_x* 960.0) ANGLE NA5 CA10 OA10 $pd_v 124.000 +eval ($pd_v=$pd_x* 960.0) ANGLE CA11 CA10 OA10 $pd_v 121.000 + +eval ($pd_v=$pd_x* 800.0) IMPR CA2 CA7 CA3 CA1 $pd_v 0 0.000 +eval ($pd_v=$pd_x* 800.0) IMPR CA1 CA2 OA1A OA1B $pd_v 0 0.000 +eval ($pd_v=$pd_x* 800.0) IMPR NA5 CA5 HAAD CA10 $pd_v 0 0.000 +eval ($pd_v=$pd_x* 800.0) IMPR CA10 NA5 CA11 OA10 $pd_v 0 0.000 +eval ($pd_v=$pd_x* 400.0) IMPR CA8 CA81 CA9 OA7 $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR CA6 OA7 CA7 CA5 $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR CA4 CA3 NA4 CA5 $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR NA4 CA4 HAAC HAAB $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR CA5 CA6 NA5 CA4 $pd_v 0 35.264 + +eval ($pd_v=$pd_x* 19.6) DIHE OA7 CA8 CA81 CA82 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 19.6) DIHE CA81 CA8 CA9 CA91 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 8.1) DIHE CA81 CA8 OA7 CA6 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 8.1) DIHE CA5 CA6 OA7 CA8 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 1000.0) DIHE OA7 CA6 CA7 CA2 $pd_v 2 180.000 +eval ($pd_v=$pd_x* 19.6) DIHE OA7 CA6 CA5 NA5 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 1000.0) DIHE CA3 CA2 CA7 CA6 $pd_v 2 180.000 +eval ($pd_v=$pd_x* 19.6) DIHE CA7 CA2 CA1 OA1A $pd_v 2 180.000 +eval ($pd_v=$pd_x* 0.1) DIHE CA7 CA2 CA3 CA4 $pd_v 6 0.000 +eval ($pd_v=$pd_x* 19.6) DIHE CA2 CA3 CA4 CA5 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 8.1) DIHE CA3 CA4 NA4 HAAA $pd_v 3 0.000 +eval ($pd_v=$pd_x* 19.6) DIHE NA5 CA5 CA4 CA3 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 0.1) DIHE CA6 CA5 NA5 CA10 $pd_v 6 180.000 +eval ($pd_v=$pd_x* 640.0) DIHE OA10 CA10 NA5 CA5 $pd_v 2 180.000 + + +NONBONDED CA82 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA81 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA8 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA9 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA91 0.10000 3.29633 0.10000 3.02906 +NONBONDED OA7 0.10000 2.58361 0.10000 2.31634 +NONBONDED CA6 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA7 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA2 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA1 0.10000 3.29633 0.10000 3.02906 +NONBONDED OA1B 0.10000 2.58361 0.10000 2.31634 +NONBONDED OA1A 0.10000 2.58361 0.10000 2.31634 +NONBONDED CA3 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA4 0.10000 3.29633 0.10000 3.02906 +NONBONDED NA4 0.10000 2.67270 0.10000 2.40543 +NONBONDED HAAB 0.10000 1.42544 0.10000 1.15817 +NONBONDED HAAC 0.10000 1.42544 0.10000 1.15817 +NONBONDED HAAA 0.10000 1.42544 0.10000 1.15817 +NONBONDED CA5 0.10000 3.29633 0.10000 3.02906 +NONBONDED NA5 0.10000 2.67270 0.10000 2.40543 +NONBONDED HAAD 0.10000 1.42544 0.10000 1.15817 +NONBONDED CA10 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA11 0.10000 3.29633 0.10000 3.02906 +NONBONDED OA10 0.10000 2.58361 0.10000 2.31634 + +set echo=on message=on end diff --git a/examples/thirdparty/prodigy/data/ligand-prodrg.top b/examples/thirdparty/prodigy/data/ligand-prodrg.top new file mode 100644 index 000000000..9f58ce52d --- /dev/null +++ b/examples/thirdparty/prodigy/data/ligand-prodrg.top @@ -0,0 +1,161 @@ +! Put in this file your ligand topology if needed +! +! +! This file was generated by PRODRG version 070118.0614 +! PRODRG written/copyrighted by Daan van Aalten +! and Alexander Schuettelkopf +! +! Questions/comments to dava@davapc1.bioch.dundee.ac.uk +! +! When using this software in a publication, cite: +! A. W. Schuettelkopf and D. M. F. van Aalten (2004). +! PRODRG - a tool for high-throughput crystallography +! of protein-ligand complexes. +! Acta Crystallogr. D60, 1355--1363. +! +! +! *** NOTE *** IF YOU USE MORE THAN ONE PRODRG-GENERATED TOPOLOGY IN CNS, +! PLEASE CAREFULLY READ THE FAQ AS THIS MAY CAUSE PROBLEMS +! +! +set echo=false end +AUTOGENERATE ANGLES=FALSE END +MASS CA82 15.0350 ! equivalent to CH3 +MASS CA81 14.0270 ! equivalent to CH2 +MASS CA8 13.0190 ! equivalent to CS1 +MASS CA9 14.0270 ! equivalent to CH2 +MASS CA91 15.0350 ! equivalent to CH3 +MASS OA7 15.9994 ! equivalent to OS +MASS CA6 13.0190 ! equivalent to CS1 +MASS CA7 13.0190 ! equivalent to CR61 +MASS CA2 12.0110 ! equivalent to CB +MASS CA1 12.0110 ! equivalent to C +MASS OA1B 15.9994 ! equivalent to OM +MASS OA1A 15.9994 ! equivalent to OM +MASS CA3 14.0270 ! equivalent to CH2 +MASS CA4 13.0190 ! equivalent to CH1 +MASS NA4 14.0067 ! equivalent to NL +MASS HAAB 1.0080 ! equivalent to H +MASS HAAC 1.0080 ! equivalent to H +MASS HAAA 1.0080 ! equivalent to H +MASS CA5 13.0190 ! equivalent to CH1 +MASS NA5 14.0067 ! equivalent to N +MASS HAAD 1.0080 ! equivalent to H +MASS CA10 12.0110 ! equivalent to C +MASS CA11 15.0350 ! equivalent to CH3 +MASS OA10 15.9994 ! equivalent to O + +Residue G39 +GROUP + ATOM C82 TYPE= CA82 CHARGE= 0.024 END + ATOM C81 TYPE= CA81 CHARGE= 0.062 END + ATOM C8 TYPE= CA8 CHARGE= 0.211 END + ATOM C9 TYPE= CA9 CHARGE= 0.061 END + ATOM C91 TYPE= CA91 CHARGE= 0.024 END + ATOM O7 TYPE= OA7 CHARGE=-0.182 END + ATOM C6 TYPE= CA6 CHARGE= 0.211 END + ATOM C7 TYPE= CA7 CHARGE=-0.008 END + ATOM C2 TYPE= CA2 CHARGE=-0.022 END + ATOM C1 TYPE= CA1 CHARGE= 0.361 END + ATOM O1B TYPE= OA1B CHARGE=-0.756 END + ATOM O1A TYPE= OA1A CHARGE=-0.756 END + ATOM C3 TYPE= CA3 CHARGE= 0.062 END + ATOM C4 TYPE= CA4 CHARGE= 0.124 END + ATOM N4 TYPE= NA4 CHARGE= 0.646 END + ATOM HAB TYPE= HAAB CHARGE= 0.000 END + ATOM HAC TYPE= HAAC CHARGE= 0.001 END + ATOM HAA TYPE= HAAA CHARGE= 0.000 END + ATOM C5 TYPE= CA5 CHARGE= 0.124 END + ATOM N5 TYPE= NA5 CHARGE= 0.132 END + ATOM H07 TYPE= HAAD CHARGE= 0.000 END + ATOM C10 TYPE= CA10 CHARGE= 0.361 END + ATOM C11 TYPE= CA11 CHARGE= 0.024 END + ATOM O10 TYPE= OA10 CHARGE=-0.704 END + + BOND C82 C81 + BOND C81 C8 + BOND C8 C9 + BOND C8 O7 + BOND C9 C91 + BOND O7 C6 + BOND C6 C7 + BOND C6 C5 + BOND C7 C2 + BOND C2 C1 + BOND C2 C3 + BOND C1 O1B + BOND C1 O1A + BOND C3 C4 + BOND C4 N4 + BOND C4 C5 + BOND N4 HAB + BOND N4 HAC + BOND N4 HAA + BOND C5 N5 + BOND N5 H07 + BOND N5 C10 + BOND C10 C11 + BOND C10 O10 + + ANGLE C82 C81 C8 + ANGLE C81 C8 C9 + ANGLE C81 C8 O7 + ANGLE C9 C8 O7 + ANGLE C8 C9 C91 + ANGLE C8 O7 C6 + ANGLE O7 C6 C7 + ANGLE O7 C6 C5 + ANGLE C7 C6 C5 + ANGLE C6 C7 C2 + ANGLE C7 C2 C1 + ANGLE C7 C2 C3 + ANGLE C1 C2 C3 + ANGLE C2 C1 O1B + ANGLE C2 C1 O1A + ANGLE O1B C1 O1A + ANGLE C2 C3 C4 + ANGLE C3 C4 N4 + ANGLE C3 C4 C5 + ANGLE N4 C4 C5 + ANGLE C4 N4 HAB + ANGLE C4 N4 HAC + ANGLE C4 N4 HAA + ANGLE HAB N4 HAC + ANGLE HAB N4 HAA + ANGLE HAC N4 HAA + ANGLE C6 C5 C4 + ANGLE C6 C5 N5 + ANGLE C4 C5 N5 + ANGLE C5 N5 H07 + ANGLE C5 N5 C10 + ANGLE H07 N5 C10 + ANGLE N5 C10 C11 + ANGLE N5 C10 O10 + ANGLE C11 C10 O10 + + IMPROPER C2 C7 C3 C1 + IMPROPER C1 C2 O1A O1B + IMPROPER N5 C5 H07 C10 + IMPROPER C10 N5 C11 O10 + IMPROPER C8 C81 C9 O7 + IMPROPER C6 O7 C7 C5 + IMPROPER C4 C3 N4 C5 + IMPROPER N4 C4 HAC HAB + IMPROPER C5 C6 N5 C4 + + DIHEDRAL O7 C8 C81 C82 + DIHEDRAL C81 C8 C9 C91 + DIHEDRAL C81 C8 O7 C6 + DIHEDRAL C5 C6 O7 C8 + DIHEDRAL O7 C6 C7 C2 + DIHEDRAL O7 C6 C5 N5 + DIHEDRAL C3 C2 C7 C6 + DIHEDRAL C7 C2 C1 O1A + DIHEDRAL C7 C2 C3 C4 + DIHEDRAL C2 C3 C4 C5 + DIHEDRAL C3 C4 N4 HAA + DIHEDRAL N5 C5 C4 C3 + DIHEDRAL C6 C5 N5 C10 + DIHEDRAL O10 C10 N5 C5 +END +set echo=true end diff --git a/examples/thirdparty/prodigy/prodigy-protein-ligand-test.cfg b/examples/thirdparty/prodigy/prodigy-protein-ligand-test.cfg index 89abcd16a..8c0d6253b 100644 --- a/examples/thirdparty/prodigy/prodigy-protein-ligand-test.cfg +++ b/examples/thirdparty/prodigy/prodigy-protein-ligand-test.cfg @@ -1,5 +1,12 @@ run_dir = "run-prodigy-prot-lig" molecules = "data/prot-lig.pdb" + [topoaa] +ligand_param_fname = "data/ligand-prodrg.param" +ligand_top_fname = "data/ligand-prodrg.top" +delenph = false + [prodigy] scoring_mode = "ligand" +ligand_resname = "G39" + From 66691fd4d9c5e8e5330eadc09bc0ed7b06509e56 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Wed, 2 Oct 2024 10:46:15 +0200 Subject: [PATCH 05/16] lint and types fixes --- .../modules/scoring/prodigy/__init__.py | 7 +- .../modules/scoring/prodigy/prodigyv3.py | 71 ++++++++++++++----- 2 files changed, 57 insertions(+), 21 deletions(-) diff --git a/src/haddock/modules/scoring/prodigy/__init__.py b/src/haddock/modules/scoring/prodigy/__init__.py index ef36f387b..8c4f7de11 100644 --- a/src/haddock/modules/scoring/prodigy/__init__.py +++ b/src/haddock/modules/scoring/prodigy/__init__.py @@ -24,8 +24,11 @@ class HaddockModule(ScoringModule): name = RECIPE_PATH.name def __init__( - self, order: int, path: Path, initial_params: FilePath = DEFAULT_CONFIG - ) -> None: + self, + order: int, + path: Path, + initial_params: FilePath = DEFAULT_CONFIG, + ) -> None: super().__init__(order, path, initial_params) @classmethod diff --git a/src/haddock/modules/scoring/prodigy/prodigyv3.py b/src/haddock/modules/scoring/prodigy/prodigyv3.py index 9682b43bb..23ce969e3 100644 --- a/src/haddock/modules/scoring/prodigy/prodigyv3.py +++ b/src/haddock/modules/scoring/prodigy/prodigyv3.py @@ -4,6 +4,7 @@ import numpy as np +from haddock import log from haddock.core.exceptions import ModuleError from haddock.core.typing import FilePath, Optional, ParamDict, Union from haddock.libs.libontology import PDBFile @@ -38,13 +39,15 @@ def __init__(self): @staticmethod def run_helps() -> None: """Run prodigy CLI with help.""" - import prodigy_prot.predict_IC - #import prodigy_lig.prodigy_lig + import prodigy_prot.predict_IC # noqa : F401 + #import prodigy_lig.prodigy_lig # noqa : F401 return None class ProdigyWorker(ABC): - def __init__(self, model: FilePath, params: ParamDict): + """Superclass of Prodigy Worker.""" + + def __init__(self, model: FilePath, params: ParamDict) -> None: # Use by both prodigy -prot and -lig self.model = model self.topKd = params["to_pkd"] @@ -57,15 +60,15 @@ def __init__(self, model: FilePath, params: ParamDict): self.lig_resname = params["ligand_resname"] self.lig_chain = params["ligand_chain"] # Output values - self.score = None - self.error = None + self.score: Optional[float] = None + self.error: Optional[Exception] = None def _run(self) -> None: - """Main computation function.""" + """Evaluate complex and compute score.""" self.score = self.pkd_converter(self.evaluate_complex()) def run(self) -> None: - """Wrapper of the run function.""" + """Execute the _run method.""" try: self._run() except ModuleError as error: @@ -122,19 +125,32 @@ def deltaG_to_pKd(deltaG: float, kelvins: float = 298.3) -> float: return -pKd @abstractmethod - def evaluate_complex(self) -> None: + def evaluate_complex(self) -> float: + """Logic to evaluate a complex using prodigy.""" pass + @staticmethod @abstractmethod def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + """Logic to set the distance cutoff.""" pass class ProdigyProtein(ProdigyWorker): - def __init__(self, model: FilePath, params: ParamDict): + """Class managing the computation of protein-protein with prodigy.""" + + def __init__(self, model: FilePath, params: ParamDict) -> None: + """Instanciate the class with superclass.""" super().__init__(model, params) def evaluate_complex(self) -> float: + """Evaluate a complex with prodigy-prot. + + Returns + ------- + deltaG : float + The computed DeltaG of the input complex. + """ from prodigy_prot.predict_IC import parse_structure, Prodigy structure, _n_chains, _n_res = parse_structure(self.model) prodigy = Prodigy(structure, self.chains, self.temperature) @@ -142,7 +158,8 @@ def evaluate_complex(self) -> float: distance_cutoff=self.dist_cutoff, acc_threshold=self.acc_cutoff, ) - return prodigy.ba_val + deltaG = prodigy.ba_val + return deltaG @staticmethod def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: @@ -169,10 +186,20 @@ def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: class ProdigyLigand(ProdigyWorker): - def __init__(self, model: FilePath, params: ParamDict): + """Class managing the computation of protein-ligand with prodigy.""" + + def __init__(self, model: FilePath, params: ParamDict) -> None: + """Instanciate the class with superclass.""" super().__init__(model, params) def evaluate_complex(self) -> float: + """Evaluate a complex with prodigy-lig. + + Returns + ------- + deltaG : float + The computed DeltaG of the input complex. + """ from prodigy_lig.prodigy_lig import ( basename, extract_electrostatics, @@ -204,9 +231,8 @@ def evaluate_complex(self) -> float: cutoff=self.dist_cutoff, ) prodigy_lig.predict() - if prodigy_lig.dg_elec: - return prodigy_lig.dg_elec - return prodigy_lig.dg + deltaG = prodigy_lig.dg_elec if prodigy_lig.dg_elec else prodigy_lig.dg + return deltaG @staticmethod def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: @@ -235,7 +261,8 @@ def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: class ModelScore: """Simple class for holding score for a model.""" - def __init__(self, model_index: int): + def __init__(self, model_index: int) -> None: + """Initiate models scores.""" self.index = model_index self.score = None self.error = None @@ -244,24 +271,30 @@ def __init__(self, model_index: int): class AnyProdigyJob: """Managing the computation of prodigy scores within haddock3.""" - def __init__(self, model: PDBFile, params: ParamDict, index: int = 1): + def __init__( + self, + model: PDBFile, + params: ParamDict, + index: int = 1, + ) -> None: + """Initiate a worker.""" worker = self.get_worker(params["scoring_mode"]) self.worker = worker(model.rel_path, params) self.score = ModelScore(index) def _run(self) -> ModelScore: - """Main computation function.""" + """Run the worker and retrieve output values.""" try: self.worker.run() except Exception as e: - print(e) + log.error(e) else: self.score.score = self.worker.score self.score.error = self.worker.error return self.score def run(self) -> ModelScore: - """Wrapper to the _run function.""" + """Execute the _run method.""" return self._run() @staticmethod From 40dfb50feab165ece6944ebdb5004d3de3599743 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Wed, 2 Oct 2024 12:19:43 +0200 Subject: [PATCH 06/16] remove intermediate versions --- .../modules/scoring/prodigy/__init__.py | 8 +- .../modules/scoring/prodigy/prodigy.py | 241 +++++++------ .../modules/scoring/prodigy/prodigyv2.py | 322 ------------------ .../modules/scoring/prodigy/prodigyv3.py | 317 ----------------- 4 files changed, 122 insertions(+), 766 deletions(-) delete mode 100644 src/haddock/modules/scoring/prodigy/prodigyv2.py delete mode 100644 src/haddock/modules/scoring/prodigy/prodigyv3.py diff --git a/src/haddock/modules/scoring/prodigy/__init__.py b/src/haddock/modules/scoring/prodigy/__init__.py index 8c4f7de11..8d096647b 100644 --- a/src/haddock/modules/scoring/prodigy/__init__.py +++ b/src/haddock/modules/scoring/prodigy/__init__.py @@ -11,7 +11,7 @@ from haddock.libs.libontology import PDBFile from haddock.modules import get_engine from haddock.modules.scoring import ScoringModule -from haddock.modules.scoring.prodigy.prodigyv3 import AnyProdigyJob, CheckInstall +from haddock.modules.scoring.prodigy.prodigy import ProdigyJob, CheckInstall RECIPE_PATH = Path(__file__).resolve().parent @@ -46,17 +46,17 @@ def _run(self) -> None: self.finish_with_error(e) # Pool of Prodigy jobs to be executed - jobs: list[AnyProdigyJob] = [] + jobs: list[ProdigyJob] = [] self.output_models: list[PDBFile] = [] for mi, model in enumerate(models_to_score): self.output_models.append(model) - prodigy_worker = AnyProdigyJob( + prodigy_job = ProdigyJob( model, self.params, index=mi, ) - jobs.append(prodigy_worker) + jobs.append(prodigy_job) # Run CNS Jobs self.log(f"Running {len(jobs)} Prodigy Jobs") diff --git a/src/haddock/modules/scoring/prodigy/prodigy.py b/src/haddock/modules/scoring/prodigy/prodigy.py index 969c95818..373405a7d 100644 --- a/src/haddock/modules/scoring/prodigy/prodigy.py +++ b/src/haddock/modules/scoring/prodigy/prodigy.py @@ -1,11 +1,10 @@ """Set of functionalities to run prodigy.""" - -import subprocess from abc import ABC, abstractmethod import numpy as np +from haddock import log from haddock.core.exceptions import ModuleError from haddock.core.typing import FilePath, Optional, ParamDict, Union from haddock.libs.libontology import PDBFile @@ -40,56 +39,63 @@ def __init__(self): @staticmethod def run_helps() -> None: """Run prodigy CLI with help.""" - import prodigy - #import prodigy_lig + import prodigy_prot.predict_IC # noqa : F401 + #import prodigy_lig.prodigy_lig # noqa : F401 return None class ProdigyWorker(ABC): - def __init__(self, model: FilePath, params: ParamDict): + """Superclass of Prodigy Worker.""" + + def __init__(self, model: FilePath, params: ParamDict) -> None: + # Use by both prodigy -prot and -lig self.model = model self.topKd = params["to_pkd"] self.temperature = params["temperature"] - self.acc_cutoff = params["accessibility_cutoff"] self.dist_cutoff = self.set_distance_cutoff(params["distance_cutoff"]) - self.score = None - self.error = None + self.chains = params["chains"] + # Only used by prodigy-prot + self.acc_cutoff = params["accessibility_cutoff"] + # Only used by prodigy-lig + self.lig_resname = params["ligand_resname"] + self.lig_chain = params["ligand_chain"] + # Output values + self.score: Optional[float] = None + self.error: Optional[Exception] = None def _run(self) -> None: - """Main computation function.""" - prodigy_stdout = self.evaluate_complex() - deltaG = self.extract_deltaG(prodigy_stdout) - self.score = self.pkd_converter(deltaG) + """Evaluate complex and compute score.""" + self.score = self.pkd_converter(self.evaluate_complex()) def run(self) -> None: - """Wrapper of the run function.""" + """Execute the _run method.""" try: self._run() except ModuleError as error: self.error = error - - def evaluate_complex(self) -> str: - """Run prodigy and return stdout. + + def pkd_converter(self, deltaG: float) -> float: + """Decide if deltaG must be converted to pKd. + + Parameters + ---------- + deltaG : float + Input DeltaG value Returns ------- - prodigy_stdout : str - Standard output of prodigy (in quiet mode). + score : float + The converted DeltaG to pKd if self.topKd is true, + else the input DeltaG. """ - # Build command line - cmd_ = self.gen_cmd_line() - # Subprocess run - prodigy_stdout = self.subprocess_run(cmd_) - return prodigy_stdout - - def pkd_converter(self, deltaG: float) -> float: if self.topKd: - return self.deltaG_to_pKd( + score = self.deltaG_to_pKd( deltaG, kelvins=self.temperature + KELVIN_TO_CELCIUS, ) else: - return deltaG + score = deltaG + return round(score, 3) @staticmethod def deltaG_to_pKd(deltaG: float, kelvins: float = 298.3) -> float: @@ -118,51 +124,42 @@ def deltaG_to_pKd(deltaG: float, kelvins: float = 298.3) -> float: pKd = round(_pKd, 2) return -pKd - @staticmethod - def subprocess_run(cmd_: list[Union[str, FilePath]]) -> Optional[str]: - print(" ".join([str(v) for v in cmd_])) - # Run it - run = subprocess.Popen( - cmd_, - stdout=subprocess.PIPE, - stderr=subprocess.PIPE, - ) - # Check that run went smooth - stderr = run.stderr.read().decode("utf-8") - if stderr != "": - raise ModuleError(stderr) - # Gather standard output - stdout = run.stdout.read().decode("utf-8") - return stdout - @abstractmethod - def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + def evaluate_complex(self) -> float: + """Logic to evaluate a complex using prodigy.""" pass + @staticmethod @abstractmethod - def extract_deltaG(stdout: str) -> str: + def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: + """Logic to set the distance cutoff.""" pass - @abstractmethod - def gen_cmd_line(self) -> list[Union[str, FilePath]]: - pass +class ProdigyProtein(ProdigyWorker): + """Class managing the computation of protein-protein with prodigy.""" -class ProdigyProt(ProdigyWorker): - def __init__(self, model: FilePath, params: ParamDict): + def __init__(self, model: FilePath, params: ParamDict) -> None: + """Instanciate the class with superclass.""" super().__init__(model, params) - def gen_cmd_line(self) -> list[Union[str, FilePath]]: - # Build command line - cmd_ = [ - "prodigy", - self.model, - "--distance-cutoff", str(self.dist_cutoff), - "--acc-threshold", str(self.acc_cutoff), - "--temperature", str(self.temperature), - "--quiet", - ] - return cmd_ + def evaluate_complex(self) -> float: + """Evaluate a complex with prodigy-prot. + + Returns + ------- + deltaG : float + The computed DeltaG of the input complex. + """ + from prodigy_prot.predict_IC import parse_structure, Prodigy + structure, _n_chains, _n_res = parse_structure(self.model) + prodigy = Prodigy(structure, self.chains, self.temperature) + prodigy.predict( + distance_cutoff=self.dist_cutoff, + acc_threshold=self.acc_cutoff, + ) + deltaG = prodigy.ba_val + return deltaG @staticmethod def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: @@ -187,40 +184,55 @@ def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: dist_cutoff = 5.5 return dist_cutoff - @staticmethod - def extract_deltaG(prodigy_predictions: str) -> float: - """Extract score from prodigy-prot - This function is ment to be used when the flag --quiet is used. +class ProdigyLigand(ProdigyWorker): + """Class managing the computation of protein-ligand with prodigy.""" - Parameters - ---------- - prodigy_predictions : str - Standard output of prodigy (prodigy-protein) + def __init__(self, model: FilePath, params: ParamDict) -> None: + """Instanciate the class with superclass.""" + super().__init__(model, params) + + def evaluate_complex(self) -> float: + """Evaluate a complex with prodigy-lig. Returns ------- - deltaG: float - The predicted deltaG + deltaG : float + The computed DeltaG of the input complex. """ - deltaG_str = prodigy_predictions.strip().split()[-1] - deltaG = float(deltaG_str) - return round(deltaG, 3) - - -class ProdigyLig(ProdigyWorker): - def __init__(self, model: FilePath, params: ParamDict): - super().__init__(model, params) - - def gen_cmd_line(self) -> list[Union[str, FilePath]]: - # Build command line - cmd_ = [ - "prodigy_lig", - "--chains", ",".join(chains), f"{ligchain}:{ligname}", - "--distance_cutoff", self.dist_cutoff, - "--input_file", self.model, - ] - return cmd_ + from prodigy_lig.prodigy_lig import ( + basename, + extract_electrostatics, + FastMMCIFParser, + PDBParser, + ProdigyLig, + splitext, + ) + fname, s_ext = splitext(basename(self.model)) + if s_ext in (".pdb", ".ent", ): + parser = PDBParser(QUIET=1) + elif s_ext == ".cif": + parser = FastMMCIFParser(QUIET=1) + + with open(self.model) as in_file: + # try to set electrostatics from input file if not provided by user + electrostatics = False + try: + electrostatics = extract_electrostatics(in_file) + except Exception: + pass + prodigy_lig = ProdigyLig( + parser.get_structure(fname, in_file), + chains=[ + ":".join(self.chains), + f"{self.lig_chain}:{self.lig_resname}", + ], + electrostatics=electrostatics, + cutoff=self.dist_cutoff, + ) + prodigy_lig.predict() + deltaG = prodigy_lig.dg_elec if prodigy_lig.dg_elec else prodigy_lig.dg + return deltaG @staticmethod def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: @@ -245,65 +257,48 @@ def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: dist_cutoff = 10.5 return dist_cutoff - @staticmethod - def extract_deltaG(prodigy_predictions: str) -> float: - """Extract delatG from prodigy-lig predictions. - - Parameters - ---------- - prodigy_lig_predictions : str - Standard output of prodigy-lig. - - Returns - ------- - deltaG : float - The predicted deltaG - """ - # Point line and value - prediction_lines = prodigy_predictions.split('\n') - second_line = prediction_lines[1].strip() - predicted_DG_string = second_line.split()[-1] - # Cast to float - _deltaG = float(predicted_DG_string) - # Reduce number of decimals - deltaG = round(_deltaG, 2) - return deltaG - class ModelScore: """Simple class for holding score for a model.""" - def __init__(self, model_index: int): + def __init__(self, model_index: int) -> None: + """Initiate models scores.""" self.index = model_index self.score = None self.error = None -class AnyProdigyJob: +class ProdigyJob: """Managing the computation of prodigy scores within haddock3.""" - def __init__(self, model: PDBFile, params: ParamDict, index: int = 1): + def __init__( + self, + model: PDBFile, + params: ParamDict, + index: int = 1, + ) -> None: + """Initiate a worker.""" worker = self.get_worker(params["scoring_mode"]) self.worker = worker(model.rel_path, params) self.score = ModelScore(index) def _run(self) -> ModelScore: - """Main computation function.""" + """Run the worker and retrieve output values.""" try: self.worker.run() except Exception as e: - print(e) + log.error(e) else: self.score.score = self.worker.score self.score.error = self.worker.error return self.score def run(self) -> ModelScore: - """Wrapper to the _run function.""" + """Execute the _run method.""" return self._run() @staticmethod - def get_worker(mode: str) -> Union[ProdigyProt, ProdigyLig]: + def get_worker(mode: str) -> Union[ProdigyProtein, ProdigyLigand]: """Find appropriated class that will handle the computation. Parameters @@ -317,6 +312,6 @@ def get_worker(mode: str) -> Union[ProdigyProt, ProdigyLig]: The prodigy class that will handle the computation """ if mode == "protein": - return ProdigyProt + return ProdigyProtein else: - return ProdigyLig + return ProdigyLigand diff --git a/src/haddock/modules/scoring/prodigy/prodigyv2.py b/src/haddock/modules/scoring/prodigy/prodigyv2.py deleted file mode 100644 index 969c95818..000000000 --- a/src/haddock/modules/scoring/prodigy/prodigyv2.py +++ /dev/null @@ -1,322 +0,0 @@ -"""Set of functionalities to run prodigy.""" - - -import subprocess -from abc import ABC, abstractmethod - -import numpy as np - -from haddock.core.exceptions import ModuleError -from haddock.core.typing import FilePath, Optional, ParamDict, Union -from haddock.libs.libontology import PDBFile - - -# Define conversion constants -R_GAZ_CONST = 8.314 -CALS_TO_JOULES = 4.184 -KELVIN_TO_CELCIUS = 273.15 - - -class CheckInstall: - """Verify that installation of prodigy is ok.""" - - def __init__(self): - """Verify that installation of prodigy is ok. - - Raises - ------ - ModuleError - Raised when prodigy subprocess failed. - """ - try: - self.run_helps() - except ModuleNotFoundError: - raise ModuleError( - "Issue detected with the installation of Prodigy. " - "Consider installing it with: " - "pip install prodigy-prot prodigy-lig" - ) - - @staticmethod - def run_helps() -> None: - """Run prodigy CLI with help.""" - import prodigy - #import prodigy_lig - return None - - -class ProdigyWorker(ABC): - def __init__(self, model: FilePath, params: ParamDict): - self.model = model - self.topKd = params["to_pkd"] - self.temperature = params["temperature"] - self.acc_cutoff = params["accessibility_cutoff"] - self.dist_cutoff = self.set_distance_cutoff(params["distance_cutoff"]) - self.score = None - self.error = None - - def _run(self) -> None: - """Main computation function.""" - prodigy_stdout = self.evaluate_complex() - deltaG = self.extract_deltaG(prodigy_stdout) - self.score = self.pkd_converter(deltaG) - - def run(self) -> None: - """Wrapper of the run function.""" - try: - self._run() - except ModuleError as error: - self.error = error - - def evaluate_complex(self) -> str: - """Run prodigy and return stdout. - - Returns - ------- - prodigy_stdout : str - Standard output of prodigy (in quiet mode). - """ - # Build command line - cmd_ = self.gen_cmd_line() - # Subprocess run - prodigy_stdout = self.subprocess_run(cmd_) - return prodigy_stdout - - def pkd_converter(self, deltaG: float) -> float: - if self.topKd: - return self.deltaG_to_pKd( - deltaG, - kelvins=self.temperature + KELVIN_TO_CELCIUS, - ) - else: - return deltaG - - @staticmethod - def deltaG_to_pKd(deltaG: float, kelvins: float = 298.3) -> float: - """Convert a deltaG (in Kcal/mol) to pKd. - - Parameters - ---------- - deltaG : float - DeltaG value (in Kcal/mol) - kelvins : float, optional - Temperature at which to perform the conversion. - By default 298.3 (25 degrees Celcius) - - Returns - ------- - pKd : float - The corresponding pKd value at given temperature. - """ - # Convert Kcals to joules - deltaG_joules = deltaG * CALS_TO_JOULES * 1000 - # Use formula - Kd = np.exp(-deltaG_joules / (R_GAZ_CONST * kelvins)) - # Convert to pKd - _pKd = np.log10(Kd) - # Reduce number of decimals - pKd = round(_pKd, 2) - return -pKd - - @staticmethod - def subprocess_run(cmd_: list[Union[str, FilePath]]) -> Optional[str]: - print(" ".join([str(v) for v in cmd_])) - # Run it - run = subprocess.Popen( - cmd_, - stdout=subprocess.PIPE, - stderr=subprocess.PIPE, - ) - # Check that run went smooth - stderr = run.stderr.read().decode("utf-8") - if stderr != "": - raise ModuleError(stderr) - # Gather standard output - stdout = run.stdout.read().decode("utf-8") - return stdout - - @abstractmethod - def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: - pass - - @abstractmethod - def extract_deltaG(stdout: str) -> str: - pass - - @abstractmethod - def gen_cmd_line(self) -> list[Union[str, FilePath]]: - pass - - -class ProdigyProt(ProdigyWorker): - def __init__(self, model: FilePath, params: ParamDict): - super().__init__(model, params) - - def gen_cmd_line(self) -> list[Union[str, FilePath]]: - # Build command line - cmd_ = [ - "prodigy", - self.model, - "--distance-cutoff", str(self.dist_cutoff), - "--acc-threshold", str(self.acc_cutoff), - "--temperature", str(self.temperature), - "--quiet", - ] - return cmd_ - - @staticmethod - def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: - """Set distance cutoff to use for analysis of contacts. - - Parameters - ---------- - _dist_cutoff : Optional[float] - Distance set by the user. Can be None if undefined. - - Returns - ------- - dist_cutoff : float - The distance cutoff to use for this run. - Set to default software value (5.5) if undefined. - """ - # User defined value - if not np.isnan(_dist_cutoff): - dist_cutoff = _dist_cutoff - # Not defined case - else: - dist_cutoff = 5.5 - return dist_cutoff - - @staticmethod - def extract_deltaG(prodigy_predictions: str) -> float: - """Extract score from prodigy-prot - - This function is ment to be used when the flag --quiet is used. - - Parameters - ---------- - prodigy_predictions : str - Standard output of prodigy (prodigy-protein) - - Returns - ------- - deltaG: float - The predicted deltaG - """ - deltaG_str = prodigy_predictions.strip().split()[-1] - deltaG = float(deltaG_str) - return round(deltaG, 3) - - -class ProdigyLig(ProdigyWorker): - def __init__(self, model: FilePath, params: ParamDict): - super().__init__(model, params) - - def gen_cmd_line(self) -> list[Union[str, FilePath]]: - # Build command line - cmd_ = [ - "prodigy_lig", - "--chains", ",".join(chains), f"{ligchain}:{ligname}", - "--distance_cutoff", self.dist_cutoff, - "--input_file", self.model, - ] - return cmd_ - - @staticmethod - def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: - """Set distance cutoff to use for analysis of contacts. - - Parameters - ---------- - _dist_cutoff : Optional[float] - Distance set by the user. Can be None if undefined. - - Returns - ------- - dist_cutoff : float - The distance cutoff to use for this run. - Set to default software value (10.5) if undefined. - """ - # User defined value - if not np.isnan(_dist_cutoff): - dist_cutoff = _dist_cutoff - # Not defined case - else: - dist_cutoff = 10.5 - return dist_cutoff - - @staticmethod - def extract_deltaG(prodigy_predictions: str) -> float: - """Extract delatG from prodigy-lig predictions. - - Parameters - ---------- - prodigy_lig_predictions : str - Standard output of prodigy-lig. - - Returns - ------- - deltaG : float - The predicted deltaG - """ - # Point line and value - prediction_lines = prodigy_predictions.split('\n') - second_line = prediction_lines[1].strip() - predicted_DG_string = second_line.split()[-1] - # Cast to float - _deltaG = float(predicted_DG_string) - # Reduce number of decimals - deltaG = round(_deltaG, 2) - return deltaG - - -class ModelScore: - """Simple class for holding score for a model.""" - - def __init__(self, model_index: int): - self.index = model_index - self.score = None - self.error = None - - -class AnyProdigyJob: - """Managing the computation of prodigy scores within haddock3.""" - - def __init__(self, model: PDBFile, params: ParamDict, index: int = 1): - worker = self.get_worker(params["scoring_mode"]) - self.worker = worker(model.rel_path, params) - self.score = ModelScore(index) - - def _run(self) -> ModelScore: - """Main computation function.""" - try: - self.worker.run() - except Exception as e: - print(e) - else: - self.score.score = self.worker.score - self.score.error = self.worker.error - return self.score - - def run(self) -> ModelScore: - """Wrapper to the _run function.""" - return self._run() - - @staticmethod - def get_worker(mode: str) -> Union[ProdigyProt, ProdigyLig]: - """Find appropriated class that will handle the computation. - - Parameters - ---------- - mode : str - Prodigy scoring mode, either protein or ligand - - Returns - ------- - Union[ProdigyProt, ProdigyLig] - The prodigy class that will handle the computation - """ - if mode == "protein": - return ProdigyProt - else: - return ProdigyLig diff --git a/src/haddock/modules/scoring/prodigy/prodigyv3.py b/src/haddock/modules/scoring/prodigy/prodigyv3.py deleted file mode 100644 index 23ce969e3..000000000 --- a/src/haddock/modules/scoring/prodigy/prodigyv3.py +++ /dev/null @@ -1,317 +0,0 @@ -"""Set of functionalities to run prodigy.""" - -from abc import ABC, abstractmethod - -import numpy as np - -from haddock import log -from haddock.core.exceptions import ModuleError -from haddock.core.typing import FilePath, Optional, ParamDict, Union -from haddock.libs.libontology import PDBFile - - -# Define conversion constants -R_GAZ_CONST = 8.314 -CALS_TO_JOULES = 4.184 -KELVIN_TO_CELCIUS = 273.15 - - -class CheckInstall: - """Verify that installation of prodigy is ok.""" - - def __init__(self): - """Verify that installation of prodigy is ok. - - Raises - ------ - ModuleError - Raised when prodigy subprocess failed. - """ - try: - self.run_helps() - except ModuleNotFoundError: - raise ModuleError( - "Issue detected with the installation of Prodigy. " - "Consider installing it with: " - "pip install prodigy-prot prodigy-lig" - ) - - @staticmethod - def run_helps() -> None: - """Run prodigy CLI with help.""" - import prodigy_prot.predict_IC # noqa : F401 - #import prodigy_lig.prodigy_lig # noqa : F401 - return None - - -class ProdigyWorker(ABC): - """Superclass of Prodigy Worker.""" - - def __init__(self, model: FilePath, params: ParamDict) -> None: - # Use by both prodigy -prot and -lig - self.model = model - self.topKd = params["to_pkd"] - self.temperature = params["temperature"] - self.dist_cutoff = self.set_distance_cutoff(params["distance_cutoff"]) - self.chains = params["chains"] - # Only used by prodigy-prot - self.acc_cutoff = params["accessibility_cutoff"] - # Only used by prodigy-lig - self.lig_resname = params["ligand_resname"] - self.lig_chain = params["ligand_chain"] - # Output values - self.score: Optional[float] = None - self.error: Optional[Exception] = None - - def _run(self) -> None: - """Evaluate complex and compute score.""" - self.score = self.pkd_converter(self.evaluate_complex()) - - def run(self) -> None: - """Execute the _run method.""" - try: - self._run() - except ModuleError as error: - self.error = error - - def pkd_converter(self, deltaG: float) -> float: - """Decide if deltaG must be converted to pKd. - - Parameters - ---------- - deltaG : float - Input DeltaG value - - Returns - ------- - score : float - The converted DeltaG to pKd if self.topKd is true, - else the input DeltaG. - """ - if self.topKd: - score = self.deltaG_to_pKd( - deltaG, - kelvins=self.temperature + KELVIN_TO_CELCIUS, - ) - else: - score = deltaG - return round(score, 3) - - @staticmethod - def deltaG_to_pKd(deltaG: float, kelvins: float = 298.3) -> float: - """Convert a deltaG (in Kcal/mol) to pKd. - - Parameters - ---------- - deltaG : float - DeltaG value (in Kcal/mol) - kelvins : float, optional - Temperature at which to perform the conversion. - By default 298.3 (25 degrees Celcius) - - Returns - ------- - pKd : float - The corresponding pKd value at given temperature. - """ - # Convert Kcals to joules - deltaG_joules = deltaG * CALS_TO_JOULES * 1000 - # Use formula - Kd = np.exp(-deltaG_joules / (R_GAZ_CONST * kelvins)) - # Convert to pKd - _pKd = np.log10(Kd) - # Reduce number of decimals - pKd = round(_pKd, 2) - return -pKd - - @abstractmethod - def evaluate_complex(self) -> float: - """Logic to evaluate a complex using prodigy.""" - pass - - @staticmethod - @abstractmethod - def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: - """Logic to set the distance cutoff.""" - pass - - -class ProdigyProtein(ProdigyWorker): - """Class managing the computation of protein-protein with prodigy.""" - - def __init__(self, model: FilePath, params: ParamDict) -> None: - """Instanciate the class with superclass.""" - super().__init__(model, params) - - def evaluate_complex(self) -> float: - """Evaluate a complex with prodigy-prot. - - Returns - ------- - deltaG : float - The computed DeltaG of the input complex. - """ - from prodigy_prot.predict_IC import parse_structure, Prodigy - structure, _n_chains, _n_res = parse_structure(self.model) - prodigy = Prodigy(structure, self.chains, self.temperature) - prodigy.predict( - distance_cutoff=self.dist_cutoff, - acc_threshold=self.acc_cutoff, - ) - deltaG = prodigy.ba_val - return deltaG - - @staticmethod - def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: - """Set distance cutoff to use for analysis of contacts. - - Parameters - ---------- - _dist_cutoff : Optional[float] - Distance set by the user. Can be None if undefined. - - Returns - ------- - dist_cutoff : float - The distance cutoff to use for this run. - Set to default software value (5.5) if undefined. - """ - # User defined value - if not np.isnan(_dist_cutoff): - dist_cutoff = _dist_cutoff - # Not defined case - else: - dist_cutoff = 5.5 - return dist_cutoff - - -class ProdigyLigand(ProdigyWorker): - """Class managing the computation of protein-ligand with prodigy.""" - - def __init__(self, model: FilePath, params: ParamDict) -> None: - """Instanciate the class with superclass.""" - super().__init__(model, params) - - def evaluate_complex(self) -> float: - """Evaluate a complex with prodigy-lig. - - Returns - ------- - deltaG : float - The computed DeltaG of the input complex. - """ - from prodigy_lig.prodigy_lig import ( - basename, - extract_electrostatics, - FastMMCIFParser, - PDBParser, - ProdigyLig, - splitext, - ) - fname, s_ext = splitext(basename(self.model)) - if s_ext in (".pdb", ".ent", ): - parser = PDBParser(QUIET=1) - elif s_ext == ".cif": - parser = FastMMCIFParser(QUIET=1) - - with open(self.model) as in_file: - # try to set electrostatics from input file if not provided by user - electrostatics = False - try: - electrostatics = extract_electrostatics(in_file) - except Exception: - pass - prodigy_lig = ProdigyLig( - parser.get_structure(fname, in_file), - chains=[ - ":".join(self.chains), - f"{self.lig_chain}:{self.lig_resname}", - ], - electrostatics=electrostatics, - cutoff=self.dist_cutoff, - ) - prodigy_lig.predict() - deltaG = prodigy_lig.dg_elec if prodigy_lig.dg_elec else prodigy_lig.dg - return deltaG - - @staticmethod - def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: - """Set distance cutoff to use for analysis of contacts. - - Parameters - ---------- - _dist_cutoff : Optional[float] - Distance set by the user. Can be None if undefined. - - Returns - ------- - dist_cutoff : float - The distance cutoff to use for this run. - Set to default software value (10.5) if undefined. - """ - # User defined value - if not np.isnan(_dist_cutoff): - dist_cutoff = _dist_cutoff - # Not defined case - else: - dist_cutoff = 10.5 - return dist_cutoff - - -class ModelScore: - """Simple class for holding score for a model.""" - - def __init__(self, model_index: int) -> None: - """Initiate models scores.""" - self.index = model_index - self.score = None - self.error = None - - -class AnyProdigyJob: - """Managing the computation of prodigy scores within haddock3.""" - - def __init__( - self, - model: PDBFile, - params: ParamDict, - index: int = 1, - ) -> None: - """Initiate a worker.""" - worker = self.get_worker(params["scoring_mode"]) - self.worker = worker(model.rel_path, params) - self.score = ModelScore(index) - - def _run(self) -> ModelScore: - """Run the worker and retrieve output values.""" - try: - self.worker.run() - except Exception as e: - log.error(e) - else: - self.score.score = self.worker.score - self.score.error = self.worker.error - return self.score - - def run(self) -> ModelScore: - """Execute the _run method.""" - return self._run() - - @staticmethod - def get_worker(mode: str) -> Union[ProdigyProtein, ProdigyLigand]: - """Find appropriated class that will handle the computation. - - Parameters - ---------- - mode : str - Prodigy scoring mode, either protein or ligand - - Returns - ------- - Union[ProdigyProt, ProdigyLig] - The prodigy class that will handle the computation - """ - if mode == "protein": - return ProdigyProtein - else: - return ProdigyLigand From 1935b5185ba2d06d7558e2b3bfab0fc13068a95a Mon Sep 17 00:00:00 2001 From: VGPReys Date: Thu, 3 Oct 2024 16:17:30 +0200 Subject: [PATCH 07/16] prodigy as core scoring module --- .../prodigy/data/homotrimer.pdb | 0 .../prodigy/data/ligand-prodrg.param | 0 .../prodigy/data/ligand-prodrg.top | 0 .../prodigy/data/prot-lig.pdb | 0 .../prodigy/data/prot-prot.pdb | 0 .../prodigy/prodigy-protein-ligand-test.cfg | 0 .../prodigy/prodigy-protein-protein-test.cfg | 0 .../run-prodigy-prot-lig/0_topoaa/io.json | 85 + .../run-prodigy-prot-lig/0_topoaa/params.cfg | 19 + .../0_topoaa/prot-lig_haddock.pdb.gz | Bin 0 -> 97630 bytes .../0_topoaa/prot-lig_haddock.psf.gz | Bin 0 -> 129720 bytes .../run-prodigy-prot-lig/1_prodigy/io.json | 89 + .../run-prodigy-prot-lig/1_prodigy/params.cfg | 16 + .../1_prodigy/prodigy.tsv | 2 + .../data/0_topoaa/ligand-prodrg.param | 137 + .../data/0_topoaa/ligand-prodrg.top | 161 + .../data/0_topoaa/prot-lig.pdb | 2984 ++ .../data/configurations/README.txt | 6 + .../data/configurations/cleaned_input.toml | 12 + .../enhanced_haddock_params.json | 56 + .../enhanced_haddock_params.toml | 47 + .../data/configurations/raw_input.toml | 12 + .../0_topoaa/homotrimer_haddock.pdb | 3487 ++ .../0_topoaa/homotrimer_haddock.psf | 26846 ++++++++++++++++ .../run-prodigy-prot-prot/0_topoaa/io.json | 147 + .../run-prodigy-prot-prot/0_topoaa/params.cfg | 34 + .../0_topoaa/prot-prot_haddock.pdb | 2154 ++ .../0_topoaa/prot-prot_haddock.psf | 16430 ++++++++++ .../run-prodigy-prot-prot/1_prodigy/io.json | 193 + .../1_prodigy/params.cfg | 20 + .../1_prodigy/prodigy.tsv | 3 + .../data/0_topoaa/homotrimer.pdb | 2842 ++ .../data/0_topoaa/prot-prot.pdb | 3620 +++ .../data/configurations/README.txt | 6 + .../data/configurations/cleaned_input.toml | 10 + .../enhanced_haddock_params.json | 65 + .../enhanced_haddock_params.toml | 54 + .../data/configurations/raw_input.toml | 10 + pyproject.toml | 4 +- 39 files changed, 59550 insertions(+), 1 deletion(-) rename examples/{thirdparty => scoring}/prodigy/data/homotrimer.pdb (100%) rename examples/{thirdparty => scoring}/prodigy/data/ligand-prodrg.param (100%) rename examples/{thirdparty => scoring}/prodigy/data/ligand-prodrg.top (100%) rename examples/{thirdparty => scoring}/prodigy/data/prot-lig.pdb (100%) rename examples/{thirdparty => scoring}/prodigy/data/prot-prot.pdb (100%) rename examples/{thirdparty => scoring}/prodigy/prodigy-protein-ligand-test.cfg (100%) rename examples/{thirdparty => scoring}/prodigy/prodigy-protein-protein-test.cfg (100%) create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/io.json create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/params.cfg create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/prot-lig_haddock.pdb.gz create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/prot-lig_haddock.psf.gz create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/io.json create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/params.cfg create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/prodigy.tsv create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.param create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.top create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/prot-lig.pdb create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/README.txt create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/cleaned_input.toml create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.json create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.toml create mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/raw_input.toml create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.pdb create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.psf create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/io.json create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/params.cfg create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.pdb create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.psf create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/io.json create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/params.cfg create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/prodigy.tsv create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/homotrimer.pdb create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/prot-prot.pdb create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/README.txt create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/cleaned_input.toml create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.json create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.toml create mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/raw_input.toml diff --git a/examples/thirdparty/prodigy/data/homotrimer.pdb b/examples/scoring/prodigy/data/homotrimer.pdb similarity index 100% rename from examples/thirdparty/prodigy/data/homotrimer.pdb rename to examples/scoring/prodigy/data/homotrimer.pdb diff --git a/examples/thirdparty/prodigy/data/ligand-prodrg.param b/examples/scoring/prodigy/data/ligand-prodrg.param similarity index 100% rename from examples/thirdparty/prodigy/data/ligand-prodrg.param rename to examples/scoring/prodigy/data/ligand-prodrg.param diff --git a/examples/thirdparty/prodigy/data/ligand-prodrg.top b/examples/scoring/prodigy/data/ligand-prodrg.top similarity index 100% rename from examples/thirdparty/prodigy/data/ligand-prodrg.top rename to examples/scoring/prodigy/data/ligand-prodrg.top diff --git a/examples/thirdparty/prodigy/data/prot-lig.pdb b/examples/scoring/prodigy/data/prot-lig.pdb similarity index 100% rename from examples/thirdparty/prodigy/data/prot-lig.pdb rename to examples/scoring/prodigy/data/prot-lig.pdb diff --git a/examples/thirdparty/prodigy/data/prot-prot.pdb b/examples/scoring/prodigy/data/prot-prot.pdb similarity index 100% rename from examples/thirdparty/prodigy/data/prot-prot.pdb rename to examples/scoring/prodigy/data/prot-prot.pdb diff --git a/examples/thirdparty/prodigy/prodigy-protein-ligand-test.cfg b/examples/scoring/prodigy/prodigy-protein-ligand-test.cfg similarity index 100% rename from examples/thirdparty/prodigy/prodigy-protein-ligand-test.cfg rename to examples/scoring/prodigy/prodigy-protein-ligand-test.cfg diff --git a/examples/thirdparty/prodigy/prodigy-protein-protein-test.cfg b/examples/scoring/prodigy/prodigy-protein-protein-test.cfg similarity index 100% rename from examples/thirdparty/prodigy/prodigy-protein-protein-test.cfg rename to examples/scoring/prodigy/prodigy-protein-protein-test.cfg diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/io.json b/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/io.json new file mode 100644 index 000000000..cef245fbf --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/io.json @@ -0,0 +1,85 @@ +{ + "input": [], + "output": [ + { + "0": { + "clt_id": null, + "clt_model_rank": null, + "clt_rank": null, + "created": "2024-10-02 10:05:57", + "file_name": "prot-lig_haddock.pdb", + "file_type": { + "py/reduce": [ + { + "py/type": "haddock.libs.libontology.Format" + }, + { + "py/tuple": [ + "pdb" + ] + } + ] + }, + "full_name": "prot-lig_haddock.pdb", + "len": NaN, + "md5": null, + "ori_name": "prot-lig", + "path": "/Users/vreys/Desktop/HADDOCK3/haddock3-dev/examples/thirdparty/prodigy/run-prodigy-prot-lig/0_topoaa", + "py/object": "haddock.libs.libontology.PDBFile", + "rel_path": { + "py/reduce": [ + { + "py/type": "pathlib.PosixPath" + }, + { + "py/tuple": [ + "..", + "0_topoaa", + "prot-lig_haddock.pdb" + ] + } + ] + }, + "restr_fname": null, + "score": NaN, + "seed": null, + "topology": { + "created": "2024-10-02 10:05:57", + "file_name": "prot-lig_haddock.psf", + "file_type": { + "py/reduce": [ + { + "py/type": "haddock.libs.libontology.Format" + }, + { + "py/tuple": [ + "psf" + ] + } + ] + }, + "full_name": "prot-lig_haddock.psf", + "md5": null, + "path": "/Users/vreys/Desktop/HADDOCK3/haddock3-dev/examples/thirdparty/prodigy/run-prodigy-prot-lig/0_topoaa", + "py/object": "haddock.libs.libontology.TopologyFile", + "rel_path": { + "py/reduce": [ + { + "py/type": "pathlib.PosixPath" + }, + { + "py/tuple": [ + "..", + "0_topoaa", + "prot-lig_haddock.psf" + ] + } + ] + }, + "restr_fname": null + }, + "unw_energies": null + } + } + ] +} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/params.cfg b/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/params.cfg new file mode 100644 index 000000000..9d92624da --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/params.cfg @@ -0,0 +1,19 @@ +[topoaa] +autohis = true +delenph = false +log_level = "quiet" +iniseed = 917 +ligand_param_fname = "data/0_topoaa/ligand-prodrg.param" +ligand_top_fname = "data/0_topoaa/ligand-prodrg.top" +limit = true +set_bfactor = true +tolerance = 0 +cyclicpept_dist = 2.0 +disulphide_dist = 2.2 + +[topoaa.mol1] +cyclicpept = false +nhisd = 0 +hisd_1 = nan +nhise = 0 +hise_1 = nan diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/prot-lig_haddock.pdb.gz b/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/prot-lig_haddock.pdb.gz new file mode 100644 index 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"clt_rank": null, + "created": "2024-10-02 10:05:57", + "file_name": "prot-lig_haddock.pdb", + "file_type": { + "py/reduce": [ + { + "py/type": "haddock.libs.libontology.Format" + }, + { + "py/tuple": [ + "pdb" + ] + } + ] + }, + "full_name": "prot-lig_haddock.pdb", + "len": NaN, + "md5": null, + "ori_name": "prot-lig", + "path": "/Users/vreys/Desktop/HADDOCK3/haddock3-dev/examples/thirdparty/prodigy/run-prodigy-prot-lig/0_topoaa", + "py/object": "haddock.libs.libontology.PDBFile", + "rel_path": { + "py/reduce": [ + { + "py/type": "pathlib.PosixPath" + }, + { + "py/tuple": [ + "..", + "0_topoaa", + "prot-lig_haddock.pdb" + ] + } + ] + }, + "restr_fname": null, + "score": null, + "seed": null, + "topology": { + "created": "2024-10-02 10:05:57", + "file_name": "prot-lig_haddock.psf", + "file_type": { + "py/reduce": [ + { + "py/type": "haddock.libs.libontology.Format" + }, + { + "py/tuple": [ + "psf" + ] + } + ] + }, + "full_name": "prot-lig_haddock.psf", + "md5": null, + "path": "/Users/vreys/Desktop/HADDOCK3/haddock3-dev/examples/thirdparty/prodigy/run-prodigy-prot-lig/0_topoaa", + "py/object": "haddock.libs.libontology.TopologyFile", + "rel_path": { + "py/reduce": [ + { + "py/type": "pathlib.PosixPath" + }, + { + "py/tuple": [ + "..", + "0_topoaa", + "prot-lig_haddock.psf" + ] + } + ] + }, + "restr_fname": null + }, + "unw_energies": null + } + } + ], + "output": [ + { + "py/id": 3 + } + ] +} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/params.cfg b/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/params.cfg new file mode 100644 index 000000000..ede8f56fe --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/params.cfg @@ -0,0 +1,16 @@ +[prodigy] +ncores = 4 +max_cpus = true +mode = "local" +queue_limit = 100 +clean = true +offline = false +debug = false +scoring_mode = "ligand" +chains = [ "A", "B",] +ligand_resname = "G39" +ligand_chain = "B" +distance_cutoff = nan +accessibility_cutoff = 0.05 +temperature = 25.0 +to_pkd = true diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/prodigy.tsv b/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/prodigy.tsv new file mode 100644 index 000000000..19c327958 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/prodigy.tsv @@ -0,0 +1,2 @@ +structure original_name md5 score +prot-lig_haddock.pdb prot-lig None None diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.param b/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.param new file mode 100644 index 000000000..74de15e0d --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.param @@ -0,0 +1,137 @@ +! Put in this file your ligand parameters if needed +! +! +! This file was generated by PRODRG version 070118.0614 +! PRODRG written/copyrighted by Daan van Aalten +! and Alexander Schuettelkopf +! +! Questions/comments to dava@davapc1.bioch.dundee.ac.uk +! +! When using this software in a publication, cite: +! A. W. Schuettelkopf and D. M. F. van Aalten (2004). +! PRODRG - a tool for high-throughput crystallography +! of protein-ligand complexes. +! Acta Crystallogr. D60, 1355--1363. +! +! +! *** NOTE *** IF YOU USE MORE THAN ONE PRODRG-GENERATED TOPOLOGY IN CNS, +! PLEASE CAREFULLY READ THE FAQ AS THIS MAY CAUSE PROBLEMS +! +! +set echo=off message=on end + +evaluate ($pd_x = 1.0) + +eval ($pd_v=$pd_x* 16000.0) BOND CA82 CA81 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND CA81 CA8 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND CA8 CA9 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND CA8 OA7 $pd_v 1.435 +eval ($pd_v=$pd_x* 16000.0) BOND CA9 CA91 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND OA7 CA6 $pd_v 1.435 +eval ($pd_v=$pd_x* 20000.0) BOND CA6 CA7 $pd_v 1.390 +eval ($pd_v=$pd_x* 16000.0) BOND CA6 CA5 $pd_v 1.530 +eval ($pd_v=$pd_x* 20000.0) BOND CA7 CA2 $pd_v 1.390 +eval ($pd_v=$pd_x* 16000.0) BOND CA2 CA1 $pd_v 1.530 +eval ($pd_v=$pd_x* 16000.0) BOND CA2 CA3 $pd_v 1.530 +eval ($pd_v=$pd_x* 20000.0) BOND CA1 OA1B $pd_v 1.250 +eval ($pd_v=$pd_x* 20000.0) BOND CA1 OA1A $pd_v 1.250 +eval ($pd_v=$pd_x* 16000.0) BOND CA3 CA4 $pd_v 1.530 +eval ($pd_v=$pd_x* 18000.0) BOND CA4 NA4 $pd_v 1.470 +eval ($pd_v=$pd_x* 16000.0) BOND CA4 CA5 $pd_v 1.530 +eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAB $pd_v 1.000 +eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAC $pd_v 1.000 +eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAA $pd_v 1.000 +eval ($pd_v=$pd_x* 18000.0) BOND CA5 NA5 $pd_v 1.470 +eval ($pd_v=$pd_x* 17900.0) BOND NA5 HAAD $pd_v 1.000 +eval ($pd_v=$pd_x* 20000.0) BOND NA5 CA10 $pd_v 1.330 +eval ($pd_v=$pd_x* 16000.0) BOND CA10 CA11 $pd_v 1.530 +eval ($pd_v=$pd_x* 24000.0) BOND CA10 OA10 $pd_v 1.230 + +eval ($pd_v=$pd_x* 880.0) ANGLE CA82 CA81 CA8 $pd_v 111.000 +eval ($pd_v=$pd_x* 480.0) ANGLE CA81 CA8 CA9 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE CA81 CA8 OA7 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE CA9 CA8 OA7 $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA8 CA9 CA91 $pd_v 111.000 +eval ($pd_v=$pd_x* 640.0) ANGLE CA8 OA7 CA6 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE OA7 CA6 CA7 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE OA7 CA6 CA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE CA7 CA6 CA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 800.0) ANGLE CA6 CA7 CA2 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA7 CA2 CA1 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA7 CA2 CA3 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA1 CA2 CA3 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA2 CA1 OA1B $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA2 CA1 OA1A $pd_v 120.000 +eval ($pd_v=$pd_x* 960.0) ANGLE OA1B CA1 OA1A $pd_v 126.000 +eval ($pd_v=$pd_x* 880.0) ANGLE CA2 CA3 CA4 $pd_v 111.000 +eval ($pd_v=$pd_x* 880.0) ANGLE CA3 CA4 NA4 $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA3 CA4 CA5 $pd_v 111.000 +eval ($pd_v=$pd_x* 880.0) ANGLE NA4 CA4 CA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAB $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAC $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAA $pd_v 109.500 +eval ($pd_v=$pd_x* 640.0) ANGLE HAAB NA4 HAAC $pd_v 109.500 +eval ($pd_v=$pd_x* 640.0) ANGLE HAAB NA4 HAAA $pd_v 109.500 +eval ($pd_v=$pd_x* 640.0) ANGLE HAAC NA4 HAAA $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA6 CA5 CA4 $pd_v 111.000 +eval ($pd_v=$pd_x* 880.0) ANGLE CA6 CA5 NA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA4 CA5 NA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA5 NA5 HAAD $pd_v 115.000 +eval ($pd_v=$pd_x* 960.0) ANGLE CA5 NA5 CA10 $pd_v 122.000 +eval ($pd_v=$pd_x* 560.0) ANGLE HAAD NA5 CA10 $pd_v 123.000 +eval ($pd_v=$pd_x* 960.0) ANGLE NA5 CA10 CA11 $pd_v 115.000 +eval ($pd_v=$pd_x* 960.0) ANGLE NA5 CA10 OA10 $pd_v 124.000 +eval ($pd_v=$pd_x* 960.0) ANGLE CA11 CA10 OA10 $pd_v 121.000 + +eval ($pd_v=$pd_x* 800.0) IMPR CA2 CA7 CA3 CA1 $pd_v 0 0.000 +eval ($pd_v=$pd_x* 800.0) IMPR CA1 CA2 OA1A OA1B $pd_v 0 0.000 +eval ($pd_v=$pd_x* 800.0) IMPR NA5 CA5 HAAD CA10 $pd_v 0 0.000 +eval ($pd_v=$pd_x* 800.0) IMPR CA10 NA5 CA11 OA10 $pd_v 0 0.000 +eval ($pd_v=$pd_x* 400.0) IMPR CA8 CA81 CA9 OA7 $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR CA6 OA7 CA7 CA5 $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR CA4 CA3 NA4 CA5 $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR NA4 CA4 HAAC HAAB $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR CA5 CA6 NA5 CA4 $pd_v 0 35.264 + +eval ($pd_v=$pd_x* 19.6) DIHE OA7 CA8 CA81 CA82 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 19.6) DIHE CA81 CA8 CA9 CA91 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 8.1) DIHE CA81 CA8 OA7 CA6 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 8.1) DIHE CA5 CA6 OA7 CA8 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 1000.0) DIHE OA7 CA6 CA7 CA2 $pd_v 2 180.000 +eval ($pd_v=$pd_x* 19.6) DIHE OA7 CA6 CA5 NA5 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 1000.0) DIHE CA3 CA2 CA7 CA6 $pd_v 2 180.000 +eval ($pd_v=$pd_x* 19.6) DIHE CA7 CA2 CA1 OA1A $pd_v 2 180.000 +eval ($pd_v=$pd_x* 0.1) DIHE CA7 CA2 CA3 CA4 $pd_v 6 0.000 +eval ($pd_v=$pd_x* 19.6) DIHE CA2 CA3 CA4 CA5 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 8.1) DIHE CA3 CA4 NA4 HAAA $pd_v 3 0.000 +eval ($pd_v=$pd_x* 19.6) DIHE NA5 CA5 CA4 CA3 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 0.1) DIHE CA6 CA5 NA5 CA10 $pd_v 6 180.000 +eval ($pd_v=$pd_x* 640.0) DIHE OA10 CA10 NA5 CA5 $pd_v 2 180.000 + + +NONBONDED CA82 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA81 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA8 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA9 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA91 0.10000 3.29633 0.10000 3.02906 +NONBONDED OA7 0.10000 2.58361 0.10000 2.31634 +NONBONDED CA6 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA7 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA2 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA1 0.10000 3.29633 0.10000 3.02906 +NONBONDED OA1B 0.10000 2.58361 0.10000 2.31634 +NONBONDED OA1A 0.10000 2.58361 0.10000 2.31634 +NONBONDED CA3 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA4 0.10000 3.29633 0.10000 3.02906 +NONBONDED NA4 0.10000 2.67270 0.10000 2.40543 +NONBONDED HAAB 0.10000 1.42544 0.10000 1.15817 +NONBONDED HAAC 0.10000 1.42544 0.10000 1.15817 +NONBONDED HAAA 0.10000 1.42544 0.10000 1.15817 +NONBONDED CA5 0.10000 3.29633 0.10000 3.02906 +NONBONDED NA5 0.10000 2.67270 0.10000 2.40543 +NONBONDED HAAD 0.10000 1.42544 0.10000 1.15817 +NONBONDED CA10 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA11 0.10000 3.29633 0.10000 3.02906 +NONBONDED OA10 0.10000 2.58361 0.10000 2.31634 + +set echo=on message=on end diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.top b/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.top new file mode 100644 index 000000000..9f58ce52d --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.top @@ -0,0 +1,161 @@ +! Put in this file your ligand topology if needed +! +! +! This file was generated by PRODRG version 070118.0614 +! PRODRG written/copyrighted by Daan van Aalten +! and Alexander Schuettelkopf +! +! Questions/comments to dava@davapc1.bioch.dundee.ac.uk +! +! When using this software in a publication, cite: +! A. W. Schuettelkopf and D. M. F. van Aalten (2004). +! PRODRG - a tool for high-throughput crystallography +! of protein-ligand complexes. +! Acta Crystallogr. D60, 1355--1363. +! +! +! *** NOTE *** IF YOU USE MORE THAN ONE PRODRG-GENERATED TOPOLOGY IN CNS, +! PLEASE CAREFULLY READ THE FAQ AS THIS MAY CAUSE PROBLEMS +! +! +set echo=false end +AUTOGENERATE ANGLES=FALSE END +MASS CA82 15.0350 ! equivalent to CH3 +MASS CA81 14.0270 ! equivalent to CH2 +MASS CA8 13.0190 ! equivalent to CS1 +MASS CA9 14.0270 ! equivalent to CH2 +MASS CA91 15.0350 ! equivalent to CH3 +MASS OA7 15.9994 ! equivalent to OS +MASS CA6 13.0190 ! equivalent to CS1 +MASS CA7 13.0190 ! equivalent to CR61 +MASS CA2 12.0110 ! equivalent to CB +MASS CA1 12.0110 ! equivalent to C +MASS OA1B 15.9994 ! equivalent to OM +MASS OA1A 15.9994 ! equivalent to OM +MASS CA3 14.0270 ! equivalent to CH2 +MASS CA4 13.0190 ! equivalent to CH1 +MASS NA4 14.0067 ! equivalent to NL +MASS HAAB 1.0080 ! equivalent to H +MASS HAAC 1.0080 ! equivalent to H +MASS HAAA 1.0080 ! equivalent to H +MASS CA5 13.0190 ! equivalent to CH1 +MASS NA5 14.0067 ! equivalent to N +MASS HAAD 1.0080 ! equivalent to H +MASS CA10 12.0110 ! equivalent to C +MASS CA11 15.0350 ! equivalent to CH3 +MASS OA10 15.9994 ! equivalent to O + +Residue G39 +GROUP + ATOM C82 TYPE= CA82 CHARGE= 0.024 END + ATOM C81 TYPE= CA81 CHARGE= 0.062 END + ATOM C8 TYPE= CA8 CHARGE= 0.211 END + ATOM C9 TYPE= CA9 CHARGE= 0.061 END + ATOM C91 TYPE= CA91 CHARGE= 0.024 END + ATOM O7 TYPE= OA7 CHARGE=-0.182 END + ATOM C6 TYPE= CA6 CHARGE= 0.211 END + ATOM C7 TYPE= CA7 CHARGE=-0.008 END + ATOM C2 TYPE= CA2 CHARGE=-0.022 END + ATOM C1 TYPE= CA1 CHARGE= 0.361 END + ATOM O1B TYPE= OA1B CHARGE=-0.756 END + ATOM O1A TYPE= OA1A CHARGE=-0.756 END + ATOM C3 TYPE= CA3 CHARGE= 0.062 END + ATOM C4 TYPE= CA4 CHARGE= 0.124 END + ATOM N4 TYPE= NA4 CHARGE= 0.646 END + ATOM HAB TYPE= HAAB CHARGE= 0.000 END + ATOM HAC TYPE= HAAC CHARGE= 0.001 END + ATOM HAA TYPE= HAAA CHARGE= 0.000 END + ATOM C5 TYPE= CA5 CHARGE= 0.124 END + ATOM N5 TYPE= NA5 CHARGE= 0.132 END + ATOM H07 TYPE= HAAD CHARGE= 0.000 END + ATOM C10 TYPE= CA10 CHARGE= 0.361 END + ATOM C11 TYPE= CA11 CHARGE= 0.024 END + ATOM O10 TYPE= OA10 CHARGE=-0.704 END + + BOND C82 C81 + BOND C81 C8 + BOND C8 C9 + BOND C8 O7 + BOND C9 C91 + BOND O7 C6 + BOND C6 C7 + BOND C6 C5 + BOND C7 C2 + BOND C2 C1 + BOND C2 C3 + BOND C1 O1B + BOND C1 O1A + BOND C3 C4 + BOND C4 N4 + BOND C4 C5 + BOND N4 HAB + BOND N4 HAC + BOND N4 HAA + BOND C5 N5 + BOND N5 H07 + BOND N5 C10 + BOND C10 C11 + BOND C10 O10 + + ANGLE C82 C81 C8 + ANGLE C81 C8 C9 + ANGLE C81 C8 O7 + ANGLE C9 C8 O7 + ANGLE C8 C9 C91 + ANGLE C8 O7 C6 + ANGLE O7 C6 C7 + ANGLE O7 C6 C5 + ANGLE C7 C6 C5 + ANGLE C6 C7 C2 + ANGLE C7 C2 C1 + ANGLE C7 C2 C3 + ANGLE C1 C2 C3 + ANGLE C2 C1 O1B + ANGLE C2 C1 O1A + ANGLE O1B C1 O1A + ANGLE C2 C3 C4 + ANGLE C3 C4 N4 + ANGLE C3 C4 C5 + ANGLE N4 C4 C5 + ANGLE C4 N4 HAB + ANGLE C4 N4 HAC + ANGLE C4 N4 HAA + ANGLE HAB N4 HAC + ANGLE HAB N4 HAA + ANGLE HAC N4 HAA + ANGLE C6 C5 C4 + ANGLE C6 C5 N5 + ANGLE C4 C5 N5 + ANGLE C5 N5 H07 + ANGLE C5 N5 C10 + ANGLE H07 N5 C10 + ANGLE N5 C10 C11 + ANGLE N5 C10 O10 + ANGLE C11 C10 O10 + + IMPROPER C2 C7 C3 C1 + IMPROPER C1 C2 O1A O1B + IMPROPER N5 C5 H07 C10 + IMPROPER C10 N5 C11 O10 + IMPROPER C8 C81 C9 O7 + IMPROPER C6 O7 C7 C5 + IMPROPER C4 C3 N4 C5 + IMPROPER N4 C4 HAC HAB + IMPROPER C5 C6 N5 C4 + + DIHEDRAL O7 C8 C81 C82 + DIHEDRAL C81 C8 C9 C91 + DIHEDRAL C81 C8 O7 C6 + DIHEDRAL C5 C6 O7 C8 + DIHEDRAL O7 C6 C7 C2 + DIHEDRAL O7 C6 C5 N5 + DIHEDRAL C3 C2 C7 C6 + DIHEDRAL C7 C2 C1 O1A + DIHEDRAL C7 C2 C3 C4 + DIHEDRAL C2 C3 C4 C5 + DIHEDRAL C3 C4 N4 HAA + DIHEDRAL N5 C5 C4 C3 + DIHEDRAL C6 C5 N5 C10 + DIHEDRAL O10 C10 N5 C5 +END +set echo=true end diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/prot-lig.pdb b/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/prot-lig.pdb new file mode 100644 index 000000000..14dfff9e6 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/prot-lig.pdb @@ -0,0 +1,2984 @@ +ATOM 1 N VAL A 83 -0.603 65.642 77.183 1.00 23.27 +ATOM 2 CA VAL A 83 -0.883 67.005 76.630 1.00 24.70 +ATOM 3 C VAL A 83 -1.221 68.015 77.732 1.00 24.24 +ATOM 4 O VAL A 83 -1.851 67.665 78.731 1.00 23.78 +ATOM 5 CB VAL A 83 -2.050 66.965 75.617 1.00 25.58 +ATOM 6 CG1 VAL A 83 -2.332 68.365 75.094 1.00 27.08 +ATOM 7 CG2 VAL A 83 -1.694 66.047 74.443 1.00 26.86 +ATOM 8 N LYS A 84 -0.803 69.266 77.541 1.00 23.15 +ATOM 9 CA LYS A 84 -1.047 70.312 78.526 1.00 23.28 +ATOM 10 C LYS A 84 -2.520 70.643 78.728 1.00 22.34 +ATOM 11 O LYS A 84 -3.329 70.575 77.803 1.00 21.41 +ATOM 12 CB LYS A 84 -0.293 71.609 78.170 1.00 25.35 +ATOM 13 CG LYS A 84 1.234 71.495 78.128 1.00 27.98 +ATOM 14 CD LYS A 84 1.687 70.672 76.908 1.00 32.17 +ATOM 15 CE LYS A 84 3.218 70.699 76.721 1.00 35.02 +ATOM 16 NZ LYS A 84 3.669 69.985 75.468 1.00 32.46 +ATOM 17 N LEU A 85 -2.836 70.998 79.971 1.00 21.36 +ATOM 18 CA LEU A 85 -4.174 71.377 80.412 1.00 21.17 +ATOM 19 C LEU A 85 -4.571 72.749 79.852 1.00 21.63 +ATOM 20 O LEU A 85 -4.184 73.775 80.412 1.00 21.68 +ATOM 21 CB LEU A 85 -4.180 71.472 81.940 1.00 19.23 +ATOM 22 CG LEU A 85 -4.907 70.504 82.871 1.00 18.81 +ATOM 23 CD1 LEU A 85 -4.718 69.052 82.431 1.00 17.36 +ATOM 24 CD2 LEU A 85 -4.375 70.727 84.283 1.00 15.43 +ATOM 25 N ALA A 86 -5.324 72.783 78.758 1.00 22.41 +ATOM 26 CA ALA A 86 -5.764 74.068 78.209 1.00 23.07 +ATOM 27 C ALA A 86 -6.644 74.681 79.283 1.00 24.49 +ATOM 28 O ALA A 86 -7.432 73.968 79.940 1.00 26.72 +ATOM 29 CB ALA A 86 -6.582 73.860 76.947 1.00 21.36 +ATOM 30 N GLY A 87 -6.521 75.983 79.490 1.00 23.88 +ATOM 31 CA GLY A 87 -7.356 76.603 80.502 1.00 23.40 +ATOM 32 C GLY A 87 -8.233 77.644 79.853 1.00 23.10 +ATOM 33 O GLY A 87 -8.455 78.701 80.430 1.00 24.54 +ATOM 34 N ASN A 88 -8.734 77.345 78.658 1.00 22.81 +ATOM 35 CA ASN A 88 -9.557 78.291 77.901 1.00 23.45 +ATOM 36 C ASN A 88 -11.049 78.272 78.232 1.00 22.82 +ATOM 37 O ASN A 88 -11.773 79.227 77.934 1.00 22.04 +ATOM 38 CB ASN A 88 -9.371 78.065 76.388 1.00 23.46 +ATOM 39 CG ASN A 88 -9.739 76.650 75.945 1.00 25.27 +ATOM 40 OD1 ASN A 88 -9.875 76.376 74.744 1.00 26.52 +ATOM 41 ND2 ASN A 88 -9.889 75.744 76.907 1.00 24.57 +ATOM 42 N SER A 89 -11.496 77.184 78.850 1.00 22.01 +ATOM 43 CA SER A 89 -12.890 77.003 79.222 1.00 20.48 +ATOM 44 C SER A 89 -13.275 77.864 80.437 1.00 20.16 +ATOM 45 O SER A 89 -12.389 78.389 81.123 1.00 18.19 +ATOM 46 CB SER A 89 -13.118 75.525 79.503 1.00 20.37 +ATOM 47 OG SER A 89 -14.284 75.325 80.256 1.00 24.18 +ATOM 48 N SER A 90 -14.584 78.019 80.683 1.00 18.16 +ATOM 49 CA SER A 90 -15.089 78.818 81.809 1.00 18.71 +ATOM 50 C SER A 90 -15.584 77.952 82.951 1.00 18.51 +ATOM 51 O SER A 90 -15.737 76.750 82.795 1.00 17.89 +ATOM 52 CB SER A 90 -16.253 79.718 81.376 1.00 18.61 +ATOM 53 OG SER A 90 -15.818 80.825 80.605 1.00 21.87 +ATOM 54 N LEU A 91 -15.839 78.573 84.099 1.00 18.93 +ATOM 55 CA LEU A 91 -16.343 77.836 85.246 1.00 20.24 +ATOM 56 C LEU A 91 -17.727 77.294 84.928 1.00 21.74 +ATOM 57 O LEU A 91 -18.540 77.973 84.281 1.00 22.26 +ATOM 58 CB LEU A 91 -16.443 78.728 86.482 1.00 19.23 +ATOM 59 CG LEU A 91 -15.139 79.157 87.148 1.00 20.38 +ATOM 60 CD1 LEU A 91 -15.461 79.926 88.422 1.00 19.78 +ATOM 61 CD2 LEU A 91 -14.286 77.934 87.469 1.00 21.05 +ATOM 62 N CYS A 92 -17.988 76.072 85.388 1.00 22.34 +ATOM 63 CA CYS A 92 -19.276 75.421 85.167 1.00 23.87 +ATOM 64 C CYS A 92 -20.379 76.025 86.033 1.00 22.62 +ATOM 65 O CYS A 92 -20.200 76.259 87.231 1.00 22.68 +ATOM 66 CB CYS A 92 -19.208 73.924 85.499 1.00 24.29 +ATOM 67 SG CYS A 92 -17.950 72.903 84.654 1.00 28.63 +ATOM 68 N PRO A 93 -21.543 76.283 85.432 1.00 22.29 +ATOM 69 CA PRO A 93 -22.665 76.848 86.192 1.00 21.47 +ATOM 70 C PRO A 93 -23.051 75.833 87.276 1.00 20.56 +ATOM 71 O PRO A 93 -23.027 74.633 87.025 1.00 20.96 +ATOM 72 CB PRO A 93 -23.747 77.016 85.124 1.00 21.42 +ATOM 73 CG PRO A 93 -23.387 75.953 84.102 1.00 21.53 +ATOM 74 CD PRO A 93 -21.897 76.087 84.016 1.00 21.41 +ATOM 75 N ILE A 94 -23.410 76.306 88.467 1.00 19.54 +ATOM 76 CA ILE A 94 -23.755 75.413 89.576 1.00 18.82 +ATOM 77 C ILE A 94 -24.907 75.922 90.443 1.00 18.69 +ATOM 78 O ILE A 94 -25.173 77.126 90.499 1.00 19.16 +ATOM 79 CB ILE A 94 -22.543 75.231 90.521 1.00 18.77 +ATOM 80 CG1 ILE A 94 -22.121 76.607 91.064 1.00 18.20 +ATOM 81 CG2 ILE A 94 -21.393 74.553 89.789 1.00 16.48 +ATOM 82 CD1 ILE A 94 -20.922 76.594 92.003 1.00 19.30 +ATOM 83 N ASN A 95 -25.561 75.007 91.151 1.00 17.85 +ATOM 84 CA ASN A 95 -26.661 75.382 92.034 1.00 17.80 +ATOM 85 C ASN A 95 -26.351 75.192 93.516 1.00 16.85 +ATOM 86 O ASN A 95 -26.893 75.894 94.356 1.00 18.58 +ATOM 87 CB ASN A 95 -27.918 74.600 91.657 1.00 18.29 +ATOM 88 CG ASN A 95 -28.406 74.950 90.270 1.00 18.81 +ATOM 89 OD1 ASN A 95 -28.697 76.115 89.985 1.00 20.87 +ATOM 90 ND2 ASN A 95 -28.481 73.958 89.395 1.00 16.41 +ATOM 91 N GLY A 96 -25.468 74.252 93.831 1.00 16.59 +ATOM 92 CA GLY A 96 -25.111 73.989 95.216 1.00 15.59 +ATOM 93 C GLY A 96 -23.809 73.213 95.304 1.00 16.10 +ATOM 94 O GLY A 96 -23.030 73.221 94.355 1.00 15.13 +ATOM 95 N TRP A 97 -23.565 72.533 96.421 1.00 14.71 +ATOM 96 CA TRP A 97 -22.320 71.792 96.572 1.00 13.24 +ATOM 97 C TRP A 97 -22.503 70.374 97.104 1.00 12.70 +ATOM 98 O TRP A 97 -23.161 70.160 98.114 1.00 13.47 +ATOM 99 CB TRP A 97 -21.382 72.573 97.488 1.00 13.31 +ATOM 100 CG TRP A 97 -21.232 73.988 97.069 1.00 12.85 +ATOM 101 CD1 TRP A 97 -22.087 75.026 97.338 1.00 12.77 +ATOM 102 CD2 TRP A 97 -20.202 74.523 96.237 1.00 13.15 +ATOM 103 NE1 TRP A 97 -21.650 76.173 96.721 1.00 12.28 +ATOM 104 CE2 TRP A 97 -20.494 75.891 96.036 1.00 14.86 +ATOM 105 CE3 TRP A 97 -19.058 73.978 95.633 1.00 12.71 +ATOM 106 CZ2 TRP A 97 -19.679 76.723 95.253 1.00 15.46 +ATOM 107 CZ3 TRP A 97 -18.250 74.805 94.856 1.00 13.67 +ATOM 108 CH2 TRP A 97 -18.566 76.162 94.673 1.00 12.77 +ATOM 109 N ALA A 98 -21.910 69.408 96.415 1.00 12.12 +ATOM 110 CA ALA A 98 -22.016 68.013 96.813 1.00 11.95 +ATOM 111 C ALA A 98 -20.751 67.550 97.524 1.00 12.20 +ATOM 112 O ALA A 98 -19.644 67.910 97.136 1.00 12.01 +ATOM 113 CB ALA A 98 -22.275 67.153 95.595 1.00 11.01 +ATOM 114 N VAL A 99 -20.922 66.743 98.564 1.00 12.65 +ATOM 115 CA VAL A 99 -19.781 66.243 99.322 1.00 14.64 +ATOM 116 C VAL A 99 -18.885 65.404 98.439 1.00 13.18 +ATOM 117 O VAL A 99 -19.359 64.549 97.708 1.00 12.64 +ATOM 118 CB VAL A 99 -20.202 65.356 100.485 1.00 15.97 +ATOM 119 CG1 VAL A 99 -19.354 65.693 101.700 1.00 15.79 +ATOM 120 CG2 VAL A 99 -21.686 65.519 100.760 1.00 19.35 +ATOM 121 N TYR A 100 -17.585 65.637 98.533 1.00 13.63 +ATOM 122 CA TYR A 100 -16.639 64.906 97.718 1.00 14.52 +ATOM 123 C TYR A 100 -15.803 63.930 98.553 1.00 15.51 +ATOM 124 O TYR A 100 -15.587 62.787 98.130 1.00 15.83 +ATOM 125 CB TYR A 100 -15.742 65.898 96.968 1.00 13.53 +ATOM 126 CG TYR A 100 -14.919 65.285 95.858 1.00 14.01 +ATOM 127 CD1 TYR A 100 -15.522 64.571 94.824 1.00 13.99 +ATOM 128 CD2 TYR A 100 -13.539 65.423 95.838 1.00 14.32 +ATOM 129 CE1 TYR A 100 -14.767 64.009 93.802 1.00 11.98 +ATOM 130 CE2 TYR A 100 -12.774 64.867 94.817 1.00 13.82 +ATOM 131 CZ TYR A 100 -13.391 64.160 93.805 1.00 14.31 +ATOM 132 OH TYR A 100 -12.618 63.581 92.812 1.00 15.72 +ATOM 133 N SER A 101 -15.357 64.365 99.735 1.00 13.51 +ATOM 134 CA SER A 101 -14.539 63.503 100.590 1.00 12.62 +ATOM 135 C SER A 101 -14.416 63.900 102.068 1.00 13.97 +ATOM 136 O SER A 101 -14.744 65.019 102.476 1.00 14.57 +ATOM 137 CB SER A 101 -13.128 63.407 100.015 1.00 11.77 +ATOM 138 OG SER A 101 -12.451 64.647 100.141 1.00 11.08 +ATOM 139 N LYS A 102 -13.918 62.962 102.861 1.00 13.04 +ATOM 140 CA LYS A 102 -13.698 63.181 104.283 1.00 14.72 +ATOM 141 C LYS A 102 -12.652 62.157 104.725 1.00 14.61 +ATOM 142 O LYS A 102 -12.870 60.955 104.596 1.00 16.89 +ATOM 143 CB LYS A 102 -15.000 62.996 105.070 1.00 13.78 +ATOM 144 CG LYS A 102 -14.871 63.366 106.540 1.00 14.11 +ATOM 145 CD LYS A 102 -16.194 63.259 107.267 1.00 12.86 +ATOM 146 CE LYS A 102 -16.174 64.042 108.565 1.00 12.67 +ATOM 147 NZ LYS A 102 -15.160 63.556 109.541 1.00 11.15 +ATOM 148 N ASP A 103 -11.525 62.621 105.249 1.00 13.72 +ATOM 149 CA ASP A 103 -10.469 61.700 105.643 1.00 15.37 +ATOM 150 C ASP A 103 -10.456 61.196 107.081 1.00 15.71 +ATOM 151 O ASP A 103 -9.741 60.245 107.380 1.00 17.23 +ATOM 152 CB ASP A 103 -9.093 62.287 105.270 1.00 17.90 +ATOM 153 CG ASP A 103 -8.857 63.683 105.838 1.00 20.44 +ATOM 154 OD1 ASP A 103 -8.066 64.443 105.226 1.00 22.27 +ATOM 155 OD2 ASP A 103 -9.440 64.022 106.892 1.00 22.08 +ATOM 156 N ASN A 104 -11.242 61.815 107.961 1.00 14.75 +ATOM 157 CA ASN A 104 -11.313 61.404 109.361 1.00 14.37 +ATOM 158 C ASN A 104 -9.945 61.165 109.986 1.00 15.66 +ATOM 159 O ASN A 104 -9.837 60.437 110.967 1.00 15.47 +ATOM 160 CB ASN A 104 -12.127 60.118 109.486 1.00 13.83 +ATOM 161 CG ASN A 104 -13.608 60.354 109.346 1.00 13.58 +ATOM 162 OD1 ASN A 104 -14.266 59.777 108.485 1.00 15.86 +ATOM 163 ND2 ASN A 104 -14.142 61.204 110.196 1.00 9.58 +ATOM 164 N SER A 105 -8.914 61.798 109.441 1.00 15.35 +ATOM 165 CA SER A 105 -7.551 61.594 109.916 1.00 17.55 +ATOM 166 C SER A 105 -7.300 61.629 111.429 1.00 17.96 +ATOM 167 O SER A 105 -6.501 60.841 111.936 1.00 18.51 +ATOM 168 CB SER A 105 -6.605 62.581 109.233 1.00 17.63 +ATOM 169 OG SER A 105 -6.594 63.816 109.924 1.00 23.37 +ATOM 170 N ILE A 106 -7.963 62.522 112.155 1.00 18.17 +ATOM 171 CA ILE A 106 -7.737 62.603 113.598 1.00 18.14 +ATOM 172 C ILE A 106 -8.428 61.497 114.398 1.00 18.35 +ATOM 173 O ILE A 106 -7.839 60.940 115.335 1.00 18.93 +ATOM 174 CB ILE A 106 -8.127 63.997 114.134 1.00 17.39 +ATOM 175 CG1 ILE A 106 -7.303 65.057 113.382 1.00 16.56 +ATOM 176 CG2 ILE A 106 -7.862 64.079 115.637 1.00 15.87 +ATOM 177 CD1 ILE A 106 -7.657 66.483 113.685 1.00 16.68 +ATOM 178 N ARG A 107 -9.665 61.169 114.031 1.00 17.47 +ATOM 179 CA ARG A 107 -10.393 60.093 114.711 1.00 16.32 +ATOM 180 C ARG A 107 -9.552 58.829 114.574 1.00 15.83 +ATOM 181 O ARG A 107 -9.335 58.098 115.540 1.00 17.65 +ATOM 182 CB ARG A 107 -11.762 59.865 114.056 1.00 15.15 +ATOM 183 CG ARG A 107 -12.830 60.880 114.442 1.00 13.35 +ATOM 184 CD ARG A 107 -14.025 60.798 113.502 1.00 13.94 +ATOM 185 NE ARG A 107 -14.687 59.494 113.511 1.00 13.22 +ATOM 186 CZ ARG A 107 -15.594 59.117 114.409 1.00 13.77 +ATOM 187 NH1 ARG A 107 -16.141 57.912 114.334 1.00 11.16 +ATOM 188 NH2 ARG A 107 -15.959 59.946 115.382 1.00 11.90 +ATOM 189 N ILE A 108 -9.072 58.601 113.358 1.00 14.27 +ATOM 190 CA ILE A 108 -8.256 57.451 113.029 1.00 13.04 +ATOM 191 C ILE A 108 -6.905 57.517 113.730 1.00 13.67 +ATOM 192 O ILE A 108 -6.420 56.519 114.255 1.00 11.98 +ATOM 193 CB ILE A 108 -8.052 57.377 111.502 1.00 13.65 +ATOM 194 CG1 ILE A 108 -9.407 57.168 110.819 1.00 13.81 +ATOM 195 CG2 ILE A 108 -7.096 56.256 111.146 1.00 13.28 +ATOM 196 CD1 ILE A 108 -9.343 57.167 109.300 1.00 13.22 +ATOM 197 N GLY A 109 -6.308 58.706 113.739 1.00 14.21 +ATOM 198 CA GLY A 109 -5.014 58.896 114.371 1.00 15.84 +ATOM 199 C GLY A 109 -4.987 58.579 115.860 1.00 16.48 +ATOM 200 O GLY A 109 -3.915 58.444 116.450 1.00 16.67 +ATOM 201 N SER A 110 -6.162 58.480 116.473 1.00 16.06 +ATOM 202 CA SER A 110 -6.251 58.155 117.884 1.00 16.27 +ATOM 203 C SER A 110 -5.436 56.890 118.108 1.00 15.55 +ATOM 204 O SER A 110 -4.780 56.734 119.137 1.00 14.14 +ATOM 205 CB SER A 110 -7.706 57.909 118.276 1.00 15.85 +ATOM 206 OG SER A 110 -7.838 57.664 119.669 1.00 18.13 +ATOM 207 N LYS A 111 -5.477 55.998 117.121 1.00 15.81 +ATOM 208 CA LYS A 111 -4.741 54.745 117.185 1.00 15.80 +ATOM 209 C LYS A 111 -3.734 54.559 116.047 1.00 16.01 +ATOM 210 O LYS A 111 -2.581 54.200 116.289 1.00 15.66 +ATOM 211 CB LYS A 111 -5.709 53.558 117.187 1.00 15.08 +ATOM 212 CG LYS A 111 -4.982 52.226 117.118 1.00 14.89 +ATOM 213 CD LYS A 111 -5.910 51.032 117.078 1.00 15.11 +ATOM 214 CE LYS A 111 -5.080 49.763 116.936 1.00 15.83 +ATOM 215 NZ LYS A 111 -5.884 48.611 116.462 1.00 18.51 +ATOM 216 N GLY A 112 -4.179 54.801 114.815 1.00 15.96 +ATOM 217 CA GLY A 112 -3.331 54.630 113.648 1.00 15.85 +ATOM 218 C GLY A 112 -2.126 55.547 113.553 1.00 17.80 +ATOM 219 O GLY A 112 -2.011 56.530 114.297 1.00 18.94 +ATOM 220 N ASP A 113 -1.217 55.223 112.638 1.00 16.57 +ATOM 221 CA ASP A 113 -0.023 56.025 112.446 1.00 16.98 +ATOM 222 C ASP A 113 -0.298 57.147 111.432 1.00 17.49 +ATOM 223 O ASP A 113 0.174 57.106 110.293 1.00 18.73 +ATOM 224 CB ASP A 113 1.129 55.141 111.960 1.00 17.33 +ATOM 225 CG ASP A 113 1.374 53.946 112.867 1.00 17.36 +ATOM 226 OD1 ASP A 113 1.422 54.126 114.102 1.00 18.85 +ATOM 227 OD2 ASP A 113 1.527 52.821 112.342 1.00 18.65 +ATOM 228 N VAL A 114 -1.064 58.144 111.868 1.00 16.14 +ATOM 229 CA VAL A 114 -1.443 59.295 111.046 1.00 15.92 +ATOM 230 C VAL A 114 -0.568 60.516 111.355 1.00 16.10 +ATOM 231 O VAL A 114 -0.405 60.875 112.520 1.00 17.40 +ATOM 232 CB VAL A 114 -2.909 59.696 111.320 1.00 15.02 +ATOM 233 CG1 VAL A 114 -3.301 60.874 110.451 1.00 16.47 +ATOM 234 CG2 VAL A 114 -3.822 58.525 111.075 1.00 13.66 +ATOM 235 N PHE A 115 -0.005 61.153 110.330 1.00 14.08 +ATOM 236 CA PHE A 115 0.820 62.338 110.565 1.00 13.37 +ATOM 237 C PHE A 115 -0.011 63.412 111.255 1.00 14.32 +ATOM 238 O PHE A 115 -1.235 63.375 111.227 1.00 13.85 +ATOM 239 CB PHE A 115 1.310 62.960 109.257 1.00 11.30 +ATOM 240 CG PHE A 115 2.461 62.253 108.624 1.00 12.01 +ATOM 241 CD1 PHE A 115 2.318 61.652 107.377 1.00 11.21 +ATOM 242 CD2 PHE A 115 3.709 62.238 109.240 1.00 11.72 +ATOM 243 CE1 PHE A 115 3.401 61.046 106.744 1.00 12.34 +ATOM 244 CE2 PHE A 115 4.804 61.634 108.617 1.00 11.24 +ATOM 245 CZ PHE A 115 4.649 61.038 107.365 1.00 11.63 +ATOM 246 N VAL A 116 0.671 64.355 111.893 1.00 14.38 +ATOM 247 CA VAL A 116 0.008 65.495 112.492 1.00 15.12 +ATOM 248 C VAL A 116 0.246 66.523 111.389 1.00 15.22 +ATOM 249 O VAL A 116 1.335 66.563 110.805 1.00 15.50 +ATOM 250 CB VAL A 116 0.692 65.952 113.794 1.00 16.30 +ATOM 251 CG1 VAL A 116 2.197 65.888 113.635 1.00 20.03 +ATOM 252 CG2 VAL A 116 0.261 67.380 114.129 1.00 13.51 +ATOM 253 N ILE A 117 -0.750 67.344 111.083 1.00 15.31 +ATOM 254 CA ILE A 117 -0.589 68.310 110.000 1.00 14.57 +ATOM 255 C ILE A 117 -1.445 69.564 110.118 1.00 13.57 +ATOM 256 O ILE A 117 -2.301 69.671 110.981 1.00 15.45 +ATOM 257 CB ILE A 117 -0.980 67.679 108.651 1.00 14.88 +ATOM 258 CG1 ILE A 117 -2.486 67.423 108.643 1.00 13.93 +ATOM 259 CG2 ILE A 117 -0.264 66.374 108.442 1.00 14.75 +ATOM 260 CD1 ILE A 117 -3.037 67.067 107.303 1.00 14.94 +ATOM 261 N ARG A 118 -1.201 70.490 109.200 1.00 11.73 +ATOM 262 CA ARG A 118 -1.945 71.736 109.070 1.00 12.45 +ATOM 263 C ARG A 118 -1.812 72.131 107.601 1.00 12.34 +ATOM 264 O ARG A 118 -1.036 71.528 106.856 1.00 12.14 +ATOM 265 CB ARG A 118 -1.358 72.856 109.932 1.00 13.80 +ATOM 266 CG ARG A 118 -1.832 72.927 111.373 1.00 16.79 +ATOM 267 CD ARG A 118 -3.322 73.221 111.525 1.00 18.17 +ATOM 268 NE ARG A 118 -3.815 74.351 110.729 1.00 22.44 +ATOM 269 CZ ARG A 118 -3.545 75.640 110.938 1.00 21.46 +ATOM 270 NH1 ARG A 118 -4.072 76.550 110.127 1.00 20.63 +ATOM 271 NH2 ARG A 118 -2.759 76.027 111.939 1.00 21.26 +ATOM 272 N GLU A 119 -2.567 73.142 107.191 1.00 10.70 +ATOM 273 CA GLU A 119 -2.518 73.632 105.829 1.00 10.49 +ATOM 274 C GLU A 119 -2.672 72.541 104.756 1.00 10.17 +ATOM 275 O GLU A 119 -1.805 72.360 103.907 1.00 9.01 +ATOM 276 CB GLU A 119 -1.207 74.404 105.608 1.00 11.76 +ATOM 277 CG GLU A 119 -0.942 75.589 106.564 1.00 13.65 +ATOM 278 CD GLU A 119 -0.349 75.185 107.924 1.00 15.97 +ATOM 279 OE1 GLU A 119 0.522 74.281 107.973 1.00 16.55 +ATOM 280 OE2 GLU A 119 -0.737 75.788 108.944 1.00 15.78 +ATOM 281 N PRO A 120 -3.782 71.791 104.787 1.00 10.69 +ATOM 282 CA PRO A 120 -3.985 70.747 103.783 1.00 11.04 +ATOM 283 C PRO A 120 -4.705 71.355 102.592 1.00 11.60 +ATOM 284 O PRO A 120 -5.366 72.386 102.719 1.00 13.09 +ATOM 285 CB PRO A 120 -4.882 69.763 104.507 1.00 10.05 +ATOM 286 CG PRO A 120 -5.804 70.688 105.220 1.00 9.70 +ATOM 287 CD PRO A 120 -4.823 71.702 105.826 1.00 11.40 +ATOM 288 N PHE A 121 -4.581 70.729 101.434 1.00 12.64 +ATOM 289 CA PHE A 121 -5.282 71.231 100.259 1.00 14.08 +ATOM 290 C PHE A 121 -5.328 70.173 99.177 1.00 14.60 +ATOM 291 O PHE A 121 -4.473 69.290 99.130 1.00 16.45 +ATOM 292 CB PHE A 121 -4.643 72.531 99.747 1.00 13.80 +ATOM 293 CG PHE A 121 -3.262 72.371 99.158 1.00 14.38 +ATOM 294 CD1 PHE A 121 -3.095 71.990 97.824 1.00 15.23 +ATOM 295 CD2 PHE A 121 -2.130 72.681 99.909 1.00 13.66 +ATOM 296 CE1 PHE A 121 -1.817 71.930 97.243 1.00 13.13 +ATOM 297 CE2 PHE A 121 -0.849 72.624 99.340 1.00 14.59 +ATOM 298 CZ PHE A 121 -0.695 72.248 98.002 1.00 13.42 +ATOM 299 N ILE A 122 -6.344 70.248 98.325 1.00 15.20 +ATOM 300 CA ILE A 122 -6.505 69.282 97.253 1.00 14.78 +ATOM 301 C ILE A 122 -6.142 69.885 95.915 1.00 14.81 +ATOM 302 O ILE A 122 -6.286 71.073 95.717 1.00 16.89 +ATOM 303 CB ILE A 122 -7.960 68.771 97.202 1.00 14.83 +ATOM 304 CG1 ILE A 122 -8.286 68.044 98.513 1.00 13.97 +ATOM 305 CG2 ILE A 122 -8.159 67.866 95.996 1.00 11.24 +ATOM 306 CD1 ILE A 122 -9.748 67.692 98.691 1.00 14.88 +ATOM 307 N SER A 123 -5.649 69.052 95.009 1.00 15.53 +ATOM 308 CA SER A 123 -5.282 69.483 93.668 1.00 14.96 +ATOM 309 C SER A 123 -5.404 68.267 92.763 1.00 14.76 +ATOM 310 O SER A 123 -5.152 67.151 93.205 1.00 14.69 +ATOM 311 CB SER A 123 -3.857 70.022 93.646 1.00 15.30 +ATOM 312 OG SER A 123 -3.563 70.560 92.373 1.00 18.23 +ATOM 313 N CYS A 124 -5.784 68.475 91.505 1.00 15.16 +ATOM 314 CA CYS A 124 -5.977 67.354 90.581 1.00 16.84 +ATOM 315 C CYS A 124 -5.188 67.445 89.274 1.00 16.83 +ATOM 316 O CYS A 124 -4.939 68.531 88.749 1.00 18.06 +ATOM 317 CB CYS A 124 -7.471 67.208 90.232 1.00 16.96 +ATOM 318 SG CYS A 124 -8.655 67.276 91.627 1.00 22.73 +ATOM 319 N SER A 125 -4.805 66.290 88.750 1.00 16.73 +ATOM 320 CA SER A 125 -4.076 66.215 87.488 1.00 17.78 +ATOM 321 C SER A 125 -5.138 65.903 86.446 1.00 19.79 +ATOM 322 O SER A 125 -6.319 66.178 86.658 1.00 20.56 +ATOM 323 CB SER A 125 -3.083 65.060 87.524 1.00 16.89 +ATOM 324 OG SER A 125 -3.779 63.823 87.611 1.00 16.11 +ATOM 325 N HIS A 126 -4.731 65.318 85.326 1.00 21.17 +ATOM 326 CA HIS A 126 -5.708 64.948 84.322 1.00 20.84 +ATOM 327 C HIS A 126 -6.220 63.547 84.638 1.00 21.27 +ATOM 328 O HIS A 126 -7.238 63.117 84.102 1.00 23.14 +ATOM 329 CB HIS A 126 -5.102 65.009 82.916 1.00 21.16 +ATOM 330 CG HIS A 126 -3.923 64.113 82.710 1.00 22.16 +ATOM 331 ND1 HIS A 126 -2.787 64.180 83.492 1.00 22.75 +ATOM 332 CD2 HIS A 126 -3.680 63.163 81.777 1.00 20.67 +ATOM 333 CE1 HIS A 126 -1.898 63.311 83.045 1.00 23.10 +ATOM 334 NE2 HIS A 126 -2.416 62.681 82.003 1.00 21.79 +ATOM 335 N LEU A 127 -5.544 62.847 85.545 1.00 20.68 +ATOM 336 CA LEU A 127 -5.957 61.491 85.897 1.00 20.77 +ATOM 337 C LEU A 127 -6.519 61.292 87.301 1.00 21.72 +ATOM 338 O LEU A 127 -7.474 60.529 87.476 1.00 22.12 +ATOM 339 CB LEU A 127 -4.791 60.528 85.713 1.00 19.06 +ATOM 340 CG LEU A 127 -4.171 60.495 84.317 1.00 20.69 +ATOM 341 CD1 LEU A 127 -2.973 59.561 84.353 1.00 21.10 +ATOM 342 CD2 LEU A 127 -5.192 60.034 83.270 1.00 15.04 +ATOM 343 N GLU A 128 -5.937 61.965 88.296 1.00 21.47 +ATOM 344 CA GLU A 128 -6.380 61.798 89.683 1.00 22.46 +ATOM 345 C GLU A 128 -6.322 63.080 90.521 1.00 21.54 +ATOM 346 O GLU A 128 -5.742 64.076 90.106 1.00 20.95 +ATOM 347 CB GLU A 128 -5.507 60.745 90.379 1.00 23.16 +ATOM 348 CG GLU A 128 -4.214 61.330 90.963 1.00 27.75 +ATOM 349 CD GLU A 128 -3.334 60.310 91.696 1.00 31.85 +ATOM 350 OE1 GLU A 128 -3.862 59.506 92.512 1.00 34.15 +ATOM 351 OE2 GLU A 128 -2.101 60.329 91.468 1.00 32.16 +ATOM 352 N CYS A 129 -6.915 63.028 91.713 1.00 20.84 +ATOM 353 CA CYS A 129 -6.901 64.151 92.649 1.00 21.08 +ATOM 354 C CYS A 129 -6.124 63.744 93.887 1.00 19.35 +ATOM 355 O CYS A 129 -6.320 62.651 94.413 1.00 19.42 +ATOM 356 CB CYS A 129 -8.309 64.547 93.094 1.00 22.09 +ATOM 357 SG CYS A 129 -9.358 65.356 91.843 1.00 28.57 +ATOM 358 N ARG A 130 -5.256 64.628 94.361 1.00 18.34 +ATOM 359 CA ARG A 130 -4.462 64.332 95.539 1.00 16.33 +ATOM 360 C ARG A 130 -4.642 65.369 96.630 1.00 16.35 +ATOM 361 O ARG A 130 -5.147 66.463 96.395 1.00 17.66 +ATOM 362 CB ARG A 130 -2.979 64.262 95.179 1.00 16.02 +ATOM 363 CG ARG A 130 -2.605 63.203 94.173 1.00 13.77 +ATOM 364 CD ARG A 130 -1.089 63.174 93.979 1.00 16.39 +ATOM 365 NE ARG A 130 -0.368 62.730 95.175 1.00 15.64 +ATOM 366 CZ ARG A 130 -0.365 61.478 95.622 1.00 16.75 +ATOM 367 NH1 ARG A 130 0.317 61.164 96.717 1.00 15.36 +ATOM 368 NH2 ARG A 130 -1.040 60.537 94.971 1.00 14.93 +ATOM 369 N THR A 131 -4.213 65.008 97.831 1.00 16.46 +ATOM 370 CA THR A 131 -4.277 65.896 98.980 1.00 15.45 +ATOM 371 C THR A 131 -2.852 66.156 99.436 1.00 14.12 +ATOM 372 O THR A 131 -2.120 65.224 99.759 1.00 14.28 +ATOM 373 CB THR A 131 -5.056 65.264 100.157 1.00 16.85 +ATOM 374 OG1 THR A 131 -6.395 64.974 99.741 1.00 19.90 +ATOM 375 CG2 THR A 131 -5.109 66.216 101.348 1.00 13.61 +ATOM 376 N PHE A 132 -2.452 67.423 99.432 1.00 11.60 +ATOM 377 CA PHE A 132 -1.121 67.796 99.882 1.00 11.10 +ATOM 378 C PHE A 132 -1.286 68.330 101.293 1.00 12.34 +ATOM 379 O PHE A 132 -2.378 68.759 101.675 1.00 13.64 +ATOM 380 CB PHE A 132 -0.523 68.888 98.998 1.00 9.73 +ATOM 381 CG PHE A 132 -0.243 68.445 97.605 1.00 9.05 +ATOM 382 CD1 PHE A 132 -1.281 68.210 96.716 1.00 9.95 +ATOM 383 CD2 PHE A 132 1.063 68.219 97.190 1.00 10.02 +ATOM 384 CE1 PHE A 132 -1.024 67.751 95.433 1.00 11.72 +ATOM 385 CE2 PHE A 132 1.338 67.760 95.910 1.00 9.99 +ATOM 386 CZ PHE A 132 0.295 67.523 95.026 1.00 10.49 +ATOM 387 N PHE A 133 -0.212 68.309 102.068 1.00 11.56 +ATOM 388 CA PHE A 133 -0.275 68.811 103.434 1.00 12.76 +ATOM 389 C PHE A 133 1.109 69.042 103.991 1.00 12.54 +ATOM 390 O PHE A 133 2.084 68.514 103.475 1.00 14.92 +ATOM 391 CB PHE A 133 -1.036 67.818 104.316 1.00 13.40 +ATOM 392 CG PHE A 133 -0.623 66.396 104.107 1.00 12.74 +ATOM 393 CD1 PHE A 133 0.481 65.875 104.768 1.00 11.65 +ATOM 394 CD2 PHE A 133 -1.312 65.591 103.203 1.00 11.19 +ATOM 395 CE1 PHE A 133 0.896 64.574 104.532 1.00 11.99 +ATOM 396 CE2 PHE A 133 -0.906 64.284 102.959 1.00 9.08 +ATOM 397 CZ PHE A 133 0.197 63.775 103.621 1.00 10.66 +ATOM 398 N LEU A 134 1.194 69.853 105.034 1.00 12.98 +ATOM 399 CA LEU A 134 2.471 70.122 105.663 1.00 13.35 +ATOM 400 C LEU A 134 2.458 69.391 106.987 1.00 13.58 +ATOM 401 O LEU A 134 1.697 69.736 107.885 1.00 13.79 +ATOM 402 CB LEU A 134 2.664 71.623 105.878 1.00 14.01 +ATOM 403 CG LEU A 134 2.787 72.479 104.607 1.00 14.92 +ATOM 404 CD1 LEU A 134 2.923 73.941 104.989 1.00 16.45 +ATOM 405 CD2 LEU A 134 3.984 72.040 103.789 1.00 13.82 +ATOM 406 N THR A 135 3.287 68.365 107.099 1.00 13.16 +ATOM 407 CA THR A 135 3.346 67.591 108.325 1.00 14.13 +ATOM 408 C THR A 135 4.173 68.325 109.358 1.00 14.75 +ATOM 409 O THR A 135 4.788 69.348 109.070 1.00 15.08 +ATOM 410 CB THR A 135 4.041 66.242 108.125 1.00 14.70 +ATOM 411 OG1 THR A 135 5.457 66.461 108.073 1.00 13.58 +ATOM 412 CG2 THR A 135 3.575 65.567 106.838 1.00 14.11 +ATOM 413 N GLN A 136 4.189 67.773 110.564 1.00 15.42 +ATOM 414 CA GLN A 136 4.975 68.321 111.658 1.00 14.86 +ATOM 415 C GLN A 136 6.053 67.300 112.025 1.00 14.30 +ATOM 416 O GLN A 136 6.588 67.324 113.129 1.00 15.22 +ATOM 417 CB GLN A 136 4.084 68.610 112.867 1.00 15.30 +ATOM 418 CG GLN A 136 3.244 69.860 112.731 1.00 14.49 +ATOM 419 CD GLN A 136 4.069 71.114 112.869 1.00 14.17 +ATOM 420 OE1 GLN A 136 5.292 71.052 113.021 1.00 13.75 +ATOM 421 NE2 GLN A 136 3.409 72.266 112.817 1.00 13.78 +ATOM 422 N GLY A 137 6.352 66.397 111.093 1.00 12.52 +ATOM 423 CA GLY A 137 7.374 65.389 111.322 1.00 12.32 +ATOM 424 C GLY A 137 7.116 64.478 112.505 1.00 12.26 +ATOM 425 O GLY A 137 8.052 63.999 113.139 1.00 11.95 +ATOM 426 N ALA A 138 5.844 64.241 112.804 1.00 11.64 +ATOM 427 CA ALA A 138 5.469 63.384 113.917 1.00 12.14 +ATOM 428 C ALA A 138 4.072 62.821 113.715 1.00 12.16 +ATOM 429 O ALA A 138 3.336 63.234 112.816 1.00 13.25 +ATOM 430 CB ALA A 138 5.526 64.166 115.224 1.00 13.75 +ATOM 431 N LEU A 139 3.705 61.876 114.566 1.00 11.29 +ATOM 432 CA LEU A 139 2.401 61.252 114.472 1.00 10.17 +ATOM 433 C LEU A 139 1.505 61.676 115.624 1.00 10.47 +ATOM 434 O LEU A 139 1.989 62.142 116.659 1.00 10.95 +ATOM 435 CB LEU A 139 2.563 59.734 114.479 1.00 9.31 +ATOM 436 CG LEU A 139 3.488 59.151 113.411 1.00 9.14 +ATOM 437 CD1 LEU A 139 3.443 57.630 113.492 1.00 6.78 +ATOM 438 CD2 LEU A 139 3.056 59.631 112.027 1.00 9.30 +ATOM 439 N LEU A 140 0.197 61.518 115.438 1.00 9.18 +ATOM 440 CA LEU A 140 -0.757 61.856 116.477 1.00 10.38 +ATOM 441 C LEU A 140 -0.622 60.885 117.660 1.00 12.16 +ATOM 442 O LEU A 140 -0.257 59.728 117.478 1.00 10.42 +ATOM 443 CB LEU A 140 -2.180 61.798 115.920 1.00 8.34 +ATOM 444 CG LEU A 140 -2.610 62.960 115.023 1.00 6.62 +ATOM 445 CD1 LEU A 140 -3.965 62.667 114.402 1.00 5.72 +ATOM 446 CD2 LEU A 140 -2.661 64.229 115.837 1.00 6.32 +ATOM 447 N ASN A 141 -0.906 61.378 118.866 1.00 13.73 +ATOM 448 CA ASN A 141 -0.845 60.589 120.101 1.00 15.45 +ATOM 449 C ASN A 141 0.545 60.065 120.464 1.00 16.09 +ATOM 450 O ASN A 141 0.679 59.061 121.168 1.00 14.85 +ATOM 451 CB ASN A 141 -1.839 59.424 120.050 1.00 16.37 +ATOM 452 CG ASN A 141 -2.930 59.547 121.102 1.00 18.52 +ATOM 453 OD1 ASN A 141 -2.819 60.350 122.028 1.00 19.32 +ATOM 454 ND2 ASN A 141 -3.986 58.740 120.972 1.00 19.01 +ATOM 455 N ASP A 142 1.568 60.766 119.982 1.00 17.35 +ATOM 456 CA ASP A 142 2.967 60.443 120.260 1.00 16.99 +ATOM 457 C ASP A 142 3.572 61.678 120.916 1.00 17.21 +ATOM 458 O ASP A 142 3.108 62.789 120.679 1.00 16.10 +ATOM 459 CB ASP A 142 3.725 60.131 118.968 1.00 16.59 +ATOM 460 CG ASP A 142 5.212 59.950 119.202 1.00 19.46 +ATOM 461 OD1 ASP A 142 5.592 59.008 119.939 1.00 18.72 +ATOM 462 OD2 ASP A 142 5.999 60.757 118.658 1.00 19.65 +ATOM 463 N LYS A 143 4.599 61.501 121.742 1.00 17.87 +ATOM 464 CA LYS A 143 5.200 62.659 122.403 1.00 18.78 +ATOM 465 C LYS A 143 5.726 63.715 121.435 1.00 20.49 +ATOM 466 O LYS A 143 5.691 64.902 121.725 1.00 20.51 +ATOM 467 CB LYS A 143 6.327 62.234 123.346 1.00 18.10 +ATOM 468 CG LYS A 143 7.564 61.691 122.670 1.00 16.91 +ATOM 469 CD LYS A 143 8.563 61.357 123.750 1.00 17.38 +ATOM 470 CE LYS A 143 9.909 61.068 123.142 1.00 17.64 +ATOM 471 NZ LYS A 143 10.956 60.927 124.173 1.00 16.33 +ATOM 472 N HIS A 144 6.212 63.300 120.277 1.00 20.84 +ATOM 473 CA HIS A 144 6.745 64.284 119.342 1.00 21.75 +ATOM 474 C HIS A 144 5.720 65.188 118.708 1.00 22.31 +ATOM 475 O HIS A 144 6.039 66.040 117.883 1.00 21.29 +ATOM 476 CB HIS A 144 7.522 63.582 118.264 1.00 19.38 +ATOM 477 CG HIS A 144 8.702 62.849 118.796 1.00 19.76 +ATOM 478 ND1 HIS A 144 9.850 63.490 119.190 1.00 18.78 +ATOM 479 CD2 HIS A 144 8.887 61.536 119.060 1.00 19.56 +ATOM 480 CE1 HIS A 144 10.702 62.603 119.674 1.00 20.12 +ATOM 481 NE2 HIS A 144 10.140 61.412 119.606 1.00 20.06 +ATOM 482 N SER A 145 4.482 65.005 119.117 1.00 22.78 +ATOM 483 CA SER A 145 3.393 65.781 118.587 1.00 24.35 +ATOM 484 C SER A 145 3.206 66.993 119.468 1.00 25.73 +ATOM 485 O SER A 145 2.278 67.767 119.267 1.00 25.63 +ATOM 486 CB SER A 145 2.149 64.921 118.598 1.00 23.72 +ATOM 487 OG SER A 145 1.000 65.691 118.404 1.00 25.63 +ATOM 488 N ASN A 146 4.111 67.154 120.432 1.00 26.92 +ATOM 489 CA ASN A 146 4.051 68.255 121.377 1.00 29.14 +ATOM 490 C ASN A 146 3.702 69.619 120.769 1.00 31.40 +ATOM 491 O ASN A 146 2.719 69.733 120.046 1.00 35.76 +ATOM 492 CB ASN A 146 5.351 68.344 122.175 1.00 28.58 +ATOM 493 CG ASN A 146 5.105 68.729 123.617 1.00 28.25 +ATOM 494 OD1 ASN A 146 5.981 68.625 124.466 1.00 32.09 +ATOM 495 ND2 ASN A 146 3.898 69.177 123.898 1.00 28.39 +ATOM 496 N GLY A 147 4.479 70.656 121.060 1.00 29.48 +ATOM 497 CA GLY A 147 4.160 71.977 120.535 1.00 29.06 +ATOM 498 C GLY A 147 3.999 72.158 119.032 1.00 28.93 +ATOM 499 O GLY A 147 4.566 73.088 118.459 1.00 27.69 +ATOM 500 N THR A 148 3.214 71.293 118.398 1.00 28.93 +ATOM 501 CA THR A 148 2.984 71.349 116.960 1.00 30.72 +ATOM 502 C THR A 148 2.120 72.546 116.553 1.00 32.32 +ATOM 503 O THR A 148 1.466 72.550 115.510 1.00 32.96 +ATOM 504 CB THR A 148 2.345 70.037 116.469 1.00 29.97 +ATOM 505 OG1 THR A 148 1.276 69.664 117.342 1.00 27.37 +ATOM 506 CG2 THR A 148 3.379 68.930 116.451 1.00 29.61 +ATOM 507 N VAL A 149 2.146 73.576 117.385 1.00 34.07 +ATOM 508 CA VAL A 149 1.387 74.783 117.123 1.00 34.56 +ATOM 509 C VAL A 149 2.317 75.885 116.625 1.00 34.64 +ATOM 510 O VAL A 149 1.852 76.905 116.119 1.00 33.07 +ATOM 511 CB VAL A 149 0.707 75.278 118.403 1.00 35.42 +ATOM 512 CG1 VAL A 149 -0.421 76.236 118.065 1.00 35.39 +ATOM 513 CG2 VAL A 149 0.204 74.098 119.190 1.00 39.00 +ATOM 514 N LYS A 150 3.626 75.657 116.752 1.00 34.96 +ATOM 515 CA LYS A 150 4.654 76.635 116.376 1.00 36.65 +ATOM 516 C LYS A 150 4.674 77.225 114.962 1.00 36.13 +ATOM 517 O LYS A 150 5.222 78.317 114.767 1.00 38.05 +ATOM 518 CB LYS A 150 6.051 76.086 116.704 1.00 37.94 +ATOM 519 CG LYS A 150 6.377 74.755 116.046 1.00 42.58 +ATOM 520 CD LYS A 150 7.768 74.263 116.445 1.00 44.14 +ATOM 521 CE LYS A 150 8.019 72.834 115.965 1.00 43.96 +ATOM 522 NZ LYS A 150 9.401 72.384 116.297 1.00 44.57 +ATOM 523 N ASP A 151 4.092 76.533 113.988 1.00 32.40 +ATOM 524 CA ASP A 151 4.071 77.024 112.605 1.00 29.85 +ATOM 525 C ASP A 151 5.261 76.587 111.778 1.00 27.16 +ATOM 526 O ASP A 151 5.171 75.667 110.972 1.00 27.45 +ATOM 527 CB ASP A 151 4.028 78.552 112.528 1.00 30.57 +ATOM 528 CG ASP A 151 2.629 79.098 112.546 1.00 33.24 +ATOM 529 OD1 ASP A 151 1.773 78.515 111.854 1.00 34.72 +ATOM 530 OD2 ASP A 151 2.383 80.119 113.227 1.00 33.32 +ATOM 531 N ARG A 152 6.379 77.274 111.971 1.00 24.66 +ATOM 532 CA ARG A 152 7.587 76.992 111.207 1.00 23.84 +ATOM 533 C ARG A 152 8.675 76.252 111.995 1.00 23.80 +ATOM 534 O ARG A 152 8.967 76.574 113.151 1.00 25.22 +ATOM 535 CB ARG A 152 8.139 78.305 110.622 1.00 20.17 +ATOM 536 CG ARG A 152 7.115 79.092 109.788 1.00 18.08 +ATOM 537 CD ARG A 152 7.649 80.450 109.285 1.00 16.14 +ATOM 538 NE ARG A 152 7.933 81.440 110.330 1.00 11.59 +ATOM 539 CZ ARG A 152 7.027 81.994 111.136 1.00 11.15 +ATOM 540 NH1 ARG A 152 7.407 82.884 112.037 1.00 9.97 +ATOM 541 NH2 ARG A 152 5.749 81.660 111.056 1.00 9.14 +ATOM 542 N SER A 153 9.259 75.247 111.350 1.00 22.13 +ATOM 543 CA SER A 153 10.313 74.435 111.944 1.00 21.10 +ATOM 544 C SER A 153 11.014 73.629 110.850 1.00 20.20 +ATOM 545 O SER A 153 10.460 73.410 109.771 1.00 18.46 +ATOM 546 CB SER A 153 9.741 73.475 112.992 1.00 20.29 +ATOM 547 OG SER A 153 9.638 72.152 112.487 1.00 22.31 +ATOM 548 N PRO A 154 12.253 73.187 111.119 1.00 19.77 +ATOM 549 CA PRO A 154 13.078 72.400 110.193 1.00 19.09 +ATOM 550 C PRO A 154 12.494 71.030 109.842 1.00 19.97 +ATOM 551 O PRO A 154 12.870 70.440 108.830 1.00 21.37 +ATOM 552 CB PRO A 154 14.400 72.260 110.943 1.00 18.68 +ATOM 553 CG PRO A 154 14.458 73.501 111.773 1.00 20.13 +ATOM 554 CD PRO A 154 13.047 73.625 112.284 1.00 19.33 +ATOM 555 N HIS A 155 11.580 70.538 110.678 1.00 19.09 +ATOM 556 CA HIS A 155 10.965 69.219 110.496 1.00 19.11 +ATOM 557 C HIS A 155 9.682 69.227 109.677 1.00 19.11 +ATOM 558 O HIS A 155 9.126 68.177 109.361 1.00 20.75 +ATOM 559 CB HIS A 155 10.673 68.612 111.866 1.00 18.06 +ATOM 560 CG HIS A 155 11.810 68.741 112.825 1.00 16.37 +ATOM 561 ND1 HIS A 155 11.669 69.298 114.078 1.00 15.19 +ATOM 562 CD2 HIS A 155 13.120 68.427 112.697 1.00 15.11 +ATOM 563 CE1 HIS A 155 12.844 69.326 114.679 1.00 14.48 +ATOM 564 NE2 HIS A 155 13.742 68.804 113.862 1.00 14.98 +ATOM 565 N ARG A 156 9.207 70.415 109.346 1.00 19.43 +ATOM 566 CA ARG A 156 7.985 70.572 108.571 1.00 19.90 +ATOM 567 C ARG A 156 8.232 70.072 107.131 1.00 18.64 +ATOM 568 O ARG A 156 9.210 70.470 106.497 1.00 18.36 +ATOM 569 CB ARG A 156 7.617 72.058 108.564 1.00 22.63 +ATOM 570 CG ARG A 156 6.164 72.385 108.712 1.00 24.33 +ATOM 571 CD ARG A 156 5.682 72.321 110.137 1.00 24.77 +ATOM 572 NE ARG A 156 4.238 72.086 110.131 1.00 28.72 +ATOM 573 CZ ARG A 156 3.330 72.984 109.768 1.00 28.59 +ATOM 574 NH1 ARG A 156 2.039 72.670 109.784 1.00 28.23 +ATOM 575 NH2 ARG A 156 3.710 74.203 109.415 1.00 31.69 +ATOM 576 N THR A 157 7.365 69.196 106.623 1.00 16.36 +ATOM 577 CA THR A 157 7.518 68.683 105.264 1.00 14.26 +ATOM 578 C THR A 157 6.207 68.588 104.490 1.00 14.29 +ATOM 579 O THR A 157 5.146 68.326 105.060 1.00 15.55 +ATOM 580 CB THR A 157 8.172 67.287 105.239 1.00 14.42 +ATOM 581 OG1 THR A 157 7.309 66.338 105.875 1.00 12.21 +ATOM 582 CG2 THR A 157 9.521 67.314 105.937 1.00 14.38 +ATOM 583 N LEU A 158 6.303 68.798 103.182 1.00 12.76 +ATOM 584 CA LEU A 158 5.163 68.748 102.275 1.00 11.52 +ATOM 585 C LEU A 158 5.029 67.345 101.708 1.00 12.41 +ATOM 586 O LEU A 158 5.946 66.839 101.060 1.00 12.17 +ATOM 587 CB LEU A 158 5.369 69.733 101.123 1.00 10.49 +ATOM 588 CG LEU A 158 4.335 69.698 100.002 1.00 9.44 +ATOM 589 CD1 LEU A 158 3.004 70.145 100.554 1.00 9.91 +ATOM 590 CD2 LEU A 158 4.767 70.595 98.855 1.00 9.64 +ATOM 591 N MET A 159 3.883 66.720 101.949 1.00 12.21 +ATOM 592 CA MET A 159 3.642 65.369 101.455 1.00 12.43 +ATOM 593 C MET A 159 2.235 65.263 100.883 1.00 12.54 +ATOM 594 O MET A 159 1.434 66.184 101.043 1.00 11.04 +ATOM 595 CB MET A 159 3.846 64.364 102.588 1.00 12.43 +ATOM 596 CG MET A 159 5.265 64.377 103.135 1.00 14.11 +ATOM 597 SD MET A 159 5.577 63.201 104.483 1.00 15.72 +ATOM 598 CE MET A 159 6.136 61.769 103.587 1.00 15.45 +ATOM 599 N SER A 160 1.934 64.152 100.211 1.00 12.65 +ATOM 600 CA SER A 160 0.607 63.976 99.623 1.00 13.42 +ATOM 601 C SER A 160 0.123 62.534 99.560 1.00 13.89 +ATOM 602 O SER A 160 0.909 61.596 99.607 1.00 16.26 +ATOM 603 CB SER A 160 0.567 64.576 98.208 1.00 14.35 +ATOM 604 OG SER A 160 1.421 63.880 97.308 1.00 13.57 +ATOM 605 N CYS A 161 -1.189 62.374 99.454 1.00 13.60 +ATOM 606 CA CYS A 161 -1.816 61.065 99.352 1.00 14.96 +ATOM 607 C CYS A 161 -3.140 61.245 98.626 1.00 13.94 +ATOM 608 O CYS A 161 -3.607 62.366 98.445 1.00 13.94 +ATOM 609 CB CYS A 161 -2.053 60.463 100.739 1.00 15.56 +ATOM 610 SG CYS A 161 -3.216 61.368 101.776 1.00 17.03 +ATOM 611 N PRO A 162 -3.751 60.149 98.172 1.00 14.12 +ATOM 612 CA PRO A 162 -5.031 60.299 97.468 1.00 15.73 +ATOM 613 C PRO A 162 -6.146 60.873 98.345 1.00 15.28 +ATOM 614 O PRO A 162 -6.218 60.586 99.541 1.00 16.13 +ATOM 615 CB PRO A 162 -5.324 58.876 96.966 1.00 14.12 +ATOM 616 CG PRO A 162 -4.534 58.006 97.875 1.00 14.50 +ATOM 617 CD PRO A 162 -3.256 58.770 98.068 1.00 14.22 +ATOM 618 N VAL A 163 -7.005 61.693 97.744 1.00 15.09 +ATOM 619 CA VAL A 163 -8.106 62.312 98.477 1.00 16.49 +ATOM 620 C VAL A 163 -8.956 61.327 99.265 1.00 16.24 +ATOM 621 O VAL A 163 -9.288 60.246 98.784 1.00 15.60 +ATOM 622 CB VAL A 163 -9.050 63.106 97.542 1.00 15.94 +ATOM 623 CG1 VAL A 163 -8.470 64.469 97.259 1.00 16.20 +ATOM 624 CG2 VAL A 163 -9.257 62.351 96.250 1.00 16.55 +ATOM 625 N GLY A 164 -9.303 61.716 100.485 1.00 15.93 +ATOM 626 CA GLY A 164 -10.128 60.872 101.328 1.00 16.32 +ATOM 627 C GLY A 164 -9.346 59.985 102.275 1.00 16.33 +ATOM 628 O GLY A 164 -9.886 59.512 103.280 1.00 15.96 +ATOM 629 N GLU A 165 -8.074 59.760 101.964 1.00 16.52 +ATOM 630 CA GLU A 165 -7.233 58.916 102.799 1.00 16.59 +ATOM 631 C GLU A 165 -6.550 59.699 103.912 1.00 16.59 +ATOM 632 O GLU A 165 -6.176 60.859 103.738 1.00 17.31 +ATOM 633 CB GLU A 165 -6.179 58.212 101.941 1.00 16.72 +ATOM 634 CG GLU A 165 -6.735 57.090 101.090 1.00 19.33 +ATOM 635 CD GLU A 165 -5.690 56.483 100.184 1.00 20.82 +ATOM 636 OE1 GLU A 165 -4.503 56.483 100.572 1.00 22.85 +ATOM 637 OE2 GLU A 165 -6.051 55.999 99.091 1.00 22.37 +ATOM 638 N ALA A 166 -6.401 59.065 105.065 1.00 16.31 +ATOM 639 CA ALA A 166 -5.740 59.712 106.189 1.00 17.13 +ATOM 640 C ALA A 166 -4.246 59.758 105.871 1.00 17.18 +ATOM 641 O ALA A 166 -3.673 58.768 105.432 1.00 16.83 +ATOM 642 CB ALA A 166 -5.984 58.921 107.470 1.00 14.37 +ATOM 643 N PRO A 167 -3.601 60.916 106.072 1.00 18.06 +ATOM 644 CA PRO A 167 -2.167 61.033 105.791 1.00 18.13 +ATOM 645 C PRO A 167 -1.329 60.210 106.770 1.00 18.51 +ATOM 646 O PRO A 167 -1.409 60.388 107.991 1.00 19.87 +ATOM 647 CB PRO A 167 -1.917 62.533 105.901 1.00 18.19 +ATOM 648 CG PRO A 167 -2.911 62.958 106.930 1.00 18.93 +ATOM 649 CD PRO A 167 -4.155 62.204 106.518 1.00 17.97 +ATOM 650 N SER A 168 -0.531 59.303 106.218 1.00 18.19 +ATOM 651 CA SER A 168 0.314 58.415 107.002 1.00 16.81 +ATOM 652 C SER A 168 1.625 58.155 106.283 1.00 17.05 +ATOM 653 O SER A 168 1.734 58.369 105.083 1.00 17.56 +ATOM 654 CB SER A 168 -0.416 57.093 107.225 1.00 17.20 +ATOM 655 OG SER A 168 0.484 56.000 107.223 1.00 17.34 +ATOM 656 N PRO A 169 2.645 57.687 107.017 1.00 17.76 +ATOM 657 CA PRO A 169 3.961 57.388 106.457 1.00 16.84 +ATOM 658 C PRO A 169 3.908 56.133 105.603 1.00 16.72 +ATOM 659 O PRO A 169 4.902 55.736 104.994 1.00 19.79 +ATOM 660 CB PRO A 169 4.810 57.191 107.698 1.00 18.24 +ATOM 661 CG PRO A 169 3.834 56.543 108.644 1.00 18.22 +ATOM 662 CD PRO A 169 2.630 57.427 108.468 1.00 18.74 +ATOM 663 N TYR A 169A 2.737 55.514 105.558 1.00 14.35 +ATOM 664 CA TYR A 169A 2.552 54.291 104.802 1.00 13.55 +ATOM 665 C TYR A 169A 1.834 54.558 103.493 1.00 13.83 +ATOM 666 O TYR A 169A 1.915 53.766 102.560 1.00 13.20 +ATOM 667 CB TYR A 169A 1.748 53.287 105.636 1.00 11.83 +ATOM 668 CG TYR A 169A 2.282 53.094 107.044 1.00 13.24 +ATOM 669 CD1 TYR A 169A 1.422 52.747 108.091 1.00 13.30 +ATOM 670 CD2 TYR A 169A 3.640 53.285 107.340 1.00 11.45 +ATOM 671 CE1 TYR A 169A 1.892 52.603 109.389 1.00 11.97 +ATOM 672 CE2 TYR A 169A 4.118 53.142 108.634 1.00 10.85 +ATOM 673 CZ TYR A 169A 3.237 52.802 109.654 1.00 12.54 +ATOM 674 OH TYR A 169A 3.691 52.654 110.942 1.00 13.81 +ATOM 675 N ASN A 170 1.129 55.679 103.416 1.00 14.72 +ATOM 676 CA ASN A 170 0.392 55.996 102.204 1.00 14.49 +ATOM 677 C ASN A 170 0.765 57.346 101.605 1.00 14.78 +ATOM 678 O ASN A 170 0.175 57.760 100.609 1.00 15.13 +ATOM 679 CB ASN A 170 -1.114 55.950 102.497 1.00 13.54 +ATOM 680 CG ASN A 170 -1.639 57.229 103.140 1.00 14.47 +ATOM 681 OD1 ASN A 170 -0.953 57.881 103.915 1.00 12.69 +ATOM 682 ND2 ASN A 170 -2.880 57.574 102.825 1.00 16.36 +ATOM 683 N SER A 171 1.758 58.015 102.191 1.00 14.96 +ATOM 684 CA SER A 171 2.155 59.342 101.724 1.00 15.74 +ATOM 685 C SER A 171 3.406 59.482 100.877 1.00 16.29 +ATOM 686 O SER A 171 4.470 58.951 101.201 1.00 16.68 +ATOM 687 CB SER A 171 2.278 60.294 102.913 1.00 15.80 +ATOM 688 OG SER A 171 1.006 60.585 103.455 1.00 13.97 +ATOM 689 N ARG A 172 3.264 60.225 99.789 1.00 15.46 +ATOM 690 CA ARG A 172 4.375 60.488 98.898 1.00 15.65 +ATOM 691 C ARG A 172 5.103 61.709 99.443 1.00 14.88 +ATOM 692 O ARG A 172 4.458 62.670 99.857 1.00 15.76 +ATOM 693 CB ARG A 172 3.861 60.801 97.497 1.00 18.25 +ATOM 694 CG ARG A 172 4.953 61.282 96.557 1.00 24.32 +ATOM 695 CD ARG A 172 4.385 61.876 95.287 1.00 27.91 +ATOM 696 NE ARG A 172 3.642 60.907 94.489 1.00 31.75 +ATOM 697 CZ ARG A 172 2.870 61.250 93.461 1.00 35.48 +ATOM 698 NH1 ARG A 172 2.220 60.314 92.765 1.00 36.39 +ATOM 699 NH2 ARG A 172 2.735 62.539 93.137 1.00 36.25 +ATOM 700 N PHE A 173 6.431 61.680 99.464 1.00 13.97 +ATOM 701 CA PHE A 173 7.177 62.843 99.941 1.00 14.19 +ATOM 702 C PHE A 173 7.262 63.827 98.776 1.00 15.27 +ATOM 703 O PHE A 173 7.448 63.418 97.629 1.00 16.03 +ATOM 704 CB PHE A 173 8.593 62.477 100.378 1.00 11.87 +ATOM 705 CG PHE A 173 9.394 63.658 100.856 1.00 12.10 +ATOM 706 CD1 PHE A 173 9.288 64.107 102.172 1.00 12.60 +ATOM 707 CD2 PHE A 173 10.223 64.355 99.978 1.00 9.95 +ATOM 708 CE1 PHE A 173 10.001 65.241 102.606 1.00 12.52 +ATOM 709 CE2 PHE A 173 10.934 65.484 100.401 1.00 10.21 +ATOM 710 CZ PHE A 173 10.825 65.928 101.713 1.00 11.44 +ATOM 711 N GLU A 174 7.136 65.117 99.068 1.00 14.59 +ATOM 712 CA GLU A 174 7.180 66.126 98.026 1.00 15.86 +ATOM 713 C GLU A 174 8.316 67.129 98.207 1.00 16.68 +ATOM 714 O GLU A 174 9.098 67.364 97.280 1.00 16.53 +ATOM 715 CB GLU A 174 5.843 66.863 97.976 1.00 15.82 +ATOM 716 CG GLU A 174 4.637 65.944 97.799 1.00 19.64 +ATOM 717 CD GLU A 174 4.461 65.452 96.368 1.00 20.00 +ATOM 718 OE1 GLU A 174 3.522 64.663 96.116 1.00 20.92 +ATOM 719 OE2 GLU A 174 5.256 65.862 95.493 1.00 21.74 +ATOM 720 N SER A 175 8.414 67.720 99.395 1.00 15.95 +ATOM 721 CA SER A 175 9.463 68.702 99.638 1.00 16.43 +ATOM 722 C SER A 175 9.549 69.084 101.113 1.00 15.99 +ATOM 723 O SER A 175 8.646 68.774 101.887 1.00 16.16 +ATOM 724 CB SER A 175 9.192 69.953 98.787 1.00 15.73 +ATOM 725 OG SER A 175 10.357 70.750 98.652 1.00 18.70 +ATOM 726 N VAL A 176 10.646 69.733 101.504 1.00 14.56 +ATOM 727 CA VAL A 176 10.814 70.185 102.885 1.00 14.64 +ATOM 728 C VAL A 176 10.205 71.589 102.921 1.00 14.61 +ATOM 729 O VAL A 176 10.632 72.470 102.169 1.00 14.91 +ATOM 730 CB VAL A 176 12.305 70.277 103.290 1.00 14.07 +ATOM 731 CG1 VAL A 176 12.412 70.792 104.707 1.00 12.39 +ATOM 732 CG2 VAL A 176 12.987 68.908 103.162 1.00 12.09 +ATOM 733 N ALA A 177 9.206 71.805 103.774 1.00 13.74 +ATOM 734 CA ALA A 177 8.581 73.117 103.808 1.00 13.52 +ATOM 735 C ALA A 177 7.637 73.420 104.959 1.00 14.47 +ATOM 736 O ALA A 177 6.999 72.525 105.520 1.00 14.07 +ATOM 737 CB ALA A 177 7.841 73.336 102.512 1.00 13.42 +ATOM 738 N TRP A 178 7.552 74.701 105.301 1.00 12.76 +ATOM 739 CA TRP A 178 6.623 75.138 106.323 1.00 14.37 +ATOM 740 C TRP A 178 5.613 76.071 105.651 1.00 14.73 +ATOM 741 O TRP A 178 4.874 76.804 106.303 1.00 15.75 +ATOM 742 CB TRP A 178 7.330 75.819 107.519 1.00 15.18 +ATOM 743 CG TRP A 178 8.476 76.752 107.229 1.00 16.55 +ATOM 744 CD1 TRP A 178 9.800 76.525 107.488 1.00 17.15 +ATOM 745 CD2 TRP A 178 8.401 78.065 106.659 1.00 17.97 +ATOM 746 NE1 TRP A 178 10.553 77.611 107.116 1.00 17.58 +ATOM 747 CE2 TRP A 178 9.722 78.572 106.602 1.00 18.01 +ATOM 748 CE3 TRP A 178 7.349 78.863 106.186 1.00 17.54 +ATOM 749 CZ2 TRP A 178 10.019 79.841 106.091 1.00 16.69 +ATOM 750 CZ3 TRP A 178 7.645 80.125 105.673 1.00 18.26 +ATOM 751 CH2 TRP A 178 8.972 80.599 105.630 1.00 18.07 +ATOM 752 N SER A 179 5.594 76.018 104.323 1.00 15.21 +ATOM 753 CA SER A 179 4.683 76.811 103.502 1.00 14.69 +ATOM 754 C SER A 179 4.796 76.248 102.081 1.00 15.08 +ATOM 755 O SER A 179 5.909 76.085 101.576 1.00 16.07 +ATOM 756 CB SER A 179 5.091 78.287 103.528 1.00 14.20 +ATOM 757 OG SER A 179 4.072 79.110 102.984 1.00 12.31 +ATOM 758 N ALA A 180 3.663 75.957 101.436 1.00 14.15 +ATOM 759 CA ALA A 180 3.697 75.365 100.099 1.00 14.26 +ATOM 760 C ALA A 180 2.550 75.663 99.142 1.00 14.78 +ATOM 761 O ALA A 180 1.605 76.387 99.452 1.00 15.64 +ATOM 762 CB ALA A 180 3.833 73.860 100.224 1.00 14.35 +ATOM 763 N SER A 181 2.665 75.069 97.961 1.00 14.71 +ATOM 764 CA SER A 181 1.672 75.187 96.905 1.00 16.39 +ATOM 765 C SER A 181 2.019 74.110 95.893 1.00 17.26 +ATOM 766 O SER A 181 3.134 73.581 95.923 1.00 17.76 +ATOM 767 CB SER A 181 1.739 76.566 96.241 1.00 16.73 +ATOM 768 OG SER A 181 0.825 76.649 95.164 1.00 15.59 +ATOM 769 N ALA A 182 1.071 73.775 95.013 1.00 17.66 +ATOM 770 CA ALA A 182 1.300 72.762 93.979 1.00 16.85 +ATOM 771 C ALA A 182 0.155 72.692 92.979 1.00 16.50 +ATOM 772 O ALA A 182 -0.989 72.993 93.313 1.00 17.67 +ATOM 773 CB ALA A 182 1.506 71.398 94.618 1.00 16.60 +ATOM 774 N CYS A 183 0.478 72.308 91.747 1.00 16.55 +ATOM 775 CA CYS A 183 -0.517 72.163 90.681 1.00 17.23 +ATOM 776 C CYS A 183 0.039 71.295 89.557 1.00 16.74 +ATOM 777 O CYS A 183 1.255 71.215 89.377 1.00 16.65 +ATOM 778 CB CYS A 183 -0.942 73.534 90.133 1.00 18.35 +ATOM 779 SG CYS A 183 0.437 74.657 89.757 1.00 19.85 +ATOM 780 N HIS A 184 -0.856 70.630 88.827 1.00 16.65 +ATOM 781 CA HIS A 184 -0.480 69.751 87.714 1.00 16.62 +ATOM 782 C HIS A 184 -0.830 70.447 86.398 1.00 17.43 +ATOM 783 O HIS A 184 -1.959 70.901 86.224 1.00 17.68 +ATOM 784 CB HIS A 184 -1.235 68.421 87.825 1.00 15.68 +ATOM 785 CG HIS A 184 -0.647 67.316 86.995 1.00 15.85 +ATOM 786 ND1 HIS A 184 0.017 66.237 87.549 1.00 12.45 +ATOM 787 CD2 HIS A 184 -0.603 67.129 85.654 1.00 13.21 +ATOM 788 CE1 HIS A 184 0.441 65.442 86.587 1.00 12.37 +ATOM 789 NE2 HIS A 184 0.080 65.960 85.425 1.00 11.38 +ATOM 790 N ASP A 185 0.127 70.520 85.473 1.00 18.02 +ATOM 791 CA ASP A 185 -0.088 71.207 84.192 1.00 18.48 +ATOM 792 C ASP A 185 -0.532 70.324 83.040 1.00 18.85 +ATOM 793 O ASP A 185 -0.493 70.745 81.883 1.00 19.77 +ATOM 794 CB ASP A 185 1.188 71.927 83.758 1.00 18.12 +ATOM 795 CG ASP A 185 2.287 70.961 83.320 1.00 19.36 +ATOM 796 OD1 ASP A 185 2.087 69.727 83.403 1.00 22.51 +ATOM 797 OD2 ASP A 185 3.358 71.433 82.891 1.00 19.12 +ATOM 798 N GLY A 186 -0.946 69.104 83.345 1.00 19.50 +ATOM 799 CA GLY A 186 -1.363 68.196 82.292 1.00 19.99 +ATOM 800 C GLY A 186 -0.292 67.150 82.038 1.00 20.02 +ATOM 801 O GLY A 186 -0.596 66.033 81.623 1.00 19.56 +ATOM 802 N THR A 187 0.964 67.512 82.301 1.00 19.63 +ATOM 803 CA THR A 187 2.074 66.596 82.097 1.00 19.77 +ATOM 804 C THR A 187 2.663 66.112 83.430 1.00 20.52 +ATOM 805 O THR A 187 2.736 64.905 83.681 1.00 20.76 +ATOM 806 CB THR A 187 3.197 67.259 81.237 1.00 20.36 +ATOM 807 OG1 THR A 187 2.702 67.523 79.919 1.00 17.91 +ATOM 808 CG2 THR A 187 4.413 66.343 81.126 1.00 18.53 +ATOM 809 N SER A 188 3.090 67.041 84.282 1.00 19.43 +ATOM 810 CA SER A 188 3.674 66.654 85.561 1.00 18.54 +ATOM 811 C SER A 188 3.284 67.596 86.684 1.00 18.42 +ATOM 812 O SER A 188 2.775 68.705 86.452 1.00 17.95 +ATOM 813 CB SER A 188 5.200 66.605 85.460 1.00 20.57 +ATOM 814 OG SER A 188 5.733 67.884 85.167 1.00 20.00 +ATOM 815 N TRP A 189 3.542 67.140 87.906 1.00 16.60 +ATOM 816 CA TRP A 189 3.257 67.914 89.100 1.00 14.42 +ATOM 817 C TRP A 189 4.303 68.974 89.347 1.00 14.89 +ATOM 818 O TRP A 189 5.495 68.756 89.149 1.00 16.37 +ATOM 819 CB TRP A 189 3.205 67.024 90.345 1.00 11.76 +ATOM 820 CG TRP A 189 1.915 66.313 90.525 1.00 10.33 +ATOM 821 CD1 TRP A 189 1.665 65.014 90.248 1.00 7.66 +ATOM 822 CD2 TRP A 189 0.672 66.882 90.966 1.00 8.70 +ATOM 823 NE1 TRP A 189 0.345 64.726 90.481 1.00 12.11 +ATOM 824 CE2 TRP A 189 -0.290 65.856 90.924 1.00 8.28 +ATOM 825 CE3 TRP A 189 0.282 68.160 91.394 1.00 9.83 +ATOM 826 CZ2 TRP A 189 -1.628 66.062 91.285 1.00 8.52 +ATOM 827 CZ3 TRP A 189 -1.055 68.370 91.757 1.00 8.96 +ATOM 828 CH2 TRP A 189 -1.989 67.322 91.699 1.00 8.47 +ATOM 829 N LEU A 190 3.838 70.128 89.788 1.00 14.56 +ATOM 830 CA LEU A 190 4.714 71.224 90.136 1.00 13.95 +ATOM 831 C LEU A 190 4.485 71.440 91.626 1.00 13.37 +ATOM 832 O LEU A 190 3.357 71.685 92.048 1.00 13.74 +ATOM 833 CB LEU A 190 4.334 72.496 89.363 1.00 13.34 +ATOM 834 CG LEU A 190 4.723 73.824 90.028 1.00 14.53 +ATOM 835 CD1 LEU A 190 6.235 73.907 90.211 1.00 14.05 +ATOM 836 CD2 LEU A 190 4.230 74.980 89.185 1.00 14.25 +ATOM 837 N THR A 191 5.533 71.310 92.427 1.00 13.26 +ATOM 838 CA THR A 191 5.384 71.553 93.856 1.00 14.83 +ATOM 839 C THR A 191 6.250 72.741 94.247 1.00 14.74 +ATOM 840 O THR A 191 7.291 72.998 93.636 1.00 15.06 +ATOM 841 CB THR A 191 5.788 70.335 94.736 1.00 13.66 +ATOM 842 OG1 THR A 191 7.133 69.948 94.446 1.00 13.69 +ATOM 843 CG2 THR A 191 4.842 69.172 94.509 1.00 11.41 +ATOM 844 N ILE A 192 5.801 73.461 95.268 1.00 14.08 +ATOM 845 CA ILE A 192 6.501 74.629 95.772 1.00 13.48 +ATOM 846 C ILE A 192 6.616 74.520 97.293 1.00 14.02 +ATOM 847 O ILE A 192 5.610 74.515 98.008 1.00 13.60 +ATOM 848 CB ILE A 192 5.745 75.921 95.381 1.00 12.78 +ATOM 849 CG1 ILE A 192 5.768 76.094 93.859 1.00 12.04 +ATOM 850 CG2 ILE A 192 6.383 77.120 96.033 1.00 11.88 +ATOM 851 CD1 ILE A 192 4.840 77.168 93.345 1.00 9.66 +ATOM 852 N GLY A 193 7.855 74.418 97.772 1.00 14.28 +ATOM 853 CA GLY A 193 8.104 74.300 99.198 1.00 13.24 +ATOM 854 C GLY A 193 9.115 75.285 99.755 1.00 13.46 +ATOM 855 O GLY A 193 10.286 75.310 99.361 1.00 14.00 +ATOM 856 N ILE A 194 8.648 76.102 100.691 1.00 13.81 +ATOM 857 CA ILE A 194 9.479 77.111 101.332 1.00 13.65 +ATOM 858 C ILE A 194 10.003 76.612 102.678 1.00 14.57 +ATOM 859 O ILE A 194 9.253 76.050 103.482 1.00 14.81 +ATOM 860 CB ILE A 194 8.675 78.404 101.586 1.00 12.89 +ATOM 861 CG1 ILE A 194 8.058 78.899 100.280 1.00 11.80 +ATOM 862 CG2 ILE A 194 9.569 79.460 102.221 1.00 8.82 +ATOM 863 CD1 ILE A 194 7.137 80.090 100.455 1.00 11.28 +ATOM 864 N SER A 195 11.292 76.830 102.919 1.00 14.67 +ATOM 865 CA SER A 195 11.916 76.428 104.172 1.00 13.97 +ATOM 866 C SER A 195 13.059 77.403 104.489 1.00 13.92 +ATOM 867 O SER A 195 13.301 78.344 103.734 1.00 14.53 +ATOM 868 CB SER A 195 12.430 74.985 104.058 1.00 13.25 +ATOM 869 OG SER A 195 12.734 74.444 105.333 1.00 15.17 +ATOM 870 N GLY A 196 13.757 77.183 105.599 1.00 13.69 +ATOM 871 CA GLY A 196 14.849 78.066 105.965 1.00 13.88 +ATOM 872 C GLY A 196 14.416 79.048 107.034 1.00 14.64 +ATOM 873 O GLY A 196 13.262 79.015 107.452 1.00 16.74 +ATOM 874 N PRO A 197 15.304 79.947 107.486 1.00 14.34 +ATOM 875 CA PRO A 197 14.966 80.931 108.524 1.00 13.98 +ATOM 876 C PRO A 197 14.046 82.043 108.023 1.00 14.68 +ATOM 877 O PRO A 197 13.959 82.304 106.819 1.00 13.28 +ATOM 878 CB PRO A 197 16.332 81.454 108.948 1.00 13.21 +ATOM 879 CG PRO A 197 17.075 81.466 107.640 1.00 14.14 +ATOM 880 CD PRO A 197 16.691 80.129 107.019 1.00 14.10 +ATOM 881 N ASP A 198 13.370 82.707 108.951 1.00 14.35 +ATOM 882 CA ASP A 198 12.458 83.786 108.588 1.00 14.81 +ATOM 883 C ASP A 198 13.113 84.920 107.801 1.00 14.85 +ATOM 884 O ASP A 198 12.466 85.554 106.970 1.00 14.91 +ATOM 885 CB ASP A 198 11.792 84.346 109.841 1.00 14.02 +ATOM 886 CG ASP A 198 10.942 83.311 110.552 1.00 15.60 +ATOM 887 OD1 ASP A 198 10.681 82.252 109.945 1.00 14.62 +ATOM 888 OD2 ASP A 198 10.533 83.554 111.709 1.00 15.98 +ATOM 889 N ASN A 199 14.394 85.172 108.047 1.00 15.38 +ATOM 890 CA ASN A 199 15.086 86.242 107.347 1.00 15.07 +ATOM 891 C ASN A 199 15.774 85.858 106.042 1.00 15.78 +ATOM 892 O ASN A 199 16.567 86.643 105.526 1.00 17.47 +ATOM 893 CB ASN A 199 16.116 86.897 108.263 1.00 16.04 +ATOM 894 CG ASN A 199 17.181 85.929 108.717 1.00 16.30 +ATOM 895 OD1 ASN A 199 17.629 85.079 107.953 1.00 15.08 +ATOM 896 ND2 ASN A 199 17.600 86.061 109.962 1.00 16.62 +ATOM 897 N GLY A 200 15.496 84.670 105.508 1.00 15.75 +ATOM 898 CA GLY A 200 16.118 84.282 104.247 1.00 14.71 +ATOM 899 C GLY A 200 15.541 83.019 103.630 1.00 16.41 +ATOM 900 O GLY A 200 16.248 82.282 102.943 1.00 15.71 +ATOM 901 N ALA A 201 14.253 82.773 103.858 1.00 14.50 +ATOM 902 CA ALA A 201 13.607 81.576 103.346 1.00 14.60 +ATOM 903 C ALA A 201 13.690 81.441 101.826 1.00 15.35 +ATOM 904 O ALA A 201 13.641 82.428 101.097 1.00 14.62 +ATOM 905 CB ALA A 201 12.150 81.539 103.800 1.00 14.23 +ATOM 906 N VAL A 202 13.822 80.204 101.359 1.00 13.56 +ATOM 907 CA VAL A 202 13.904 79.937 99.937 1.00 16.11 +ATOM 908 C VAL A 202 12.898 78.880 99.510 1.00 16.30 +ATOM 909 O VAL A 202 12.806 77.807 100.114 1.00 16.24 +ATOM 910 CB VAL A 202 15.337 79.484 99.505 1.00 16.86 +ATOM 911 CG1 VAL A 202 15.984 78.673 100.597 1.00 20.69 +ATOM 912 CG2 VAL A 202 15.258 78.626 98.247 1.00 16.22 +ATOM 913 N ALA A 203 12.137 79.207 98.468 1.00 15.86 +ATOM 914 CA ALA A 203 11.141 78.297 97.926 1.00 16.91 +ATOM 915 C ALA A 203 11.836 77.430 96.897 1.00 16.41 +ATOM 916 O ALA A 203 12.491 77.943 95.997 1.00 18.30 +ATOM 917 CB ALA A 203 10.006 79.073 97.279 1.00 14.00 +ATOM 918 N VAL A 204 11.708 76.118 97.047 1.00 16.44 +ATOM 919 CA VAL A 204 12.330 75.182 96.122 1.00 16.22 +ATOM 920 C VAL A 204 11.241 74.630 95.219 1.00 16.64 +ATOM 921 O VAL A 204 10.335 73.958 95.693 1.00 18.11 +ATOM 922 CB VAL A 204 13.000 74.004 96.884 1.00 16.21 +ATOM 923 CG1 VAL A 204 13.651 73.044 95.893 1.00 16.33 +ATOM 924 CG2 VAL A 204 14.038 74.531 97.866 1.00 11.84 +ATOM 925 N LEU A 205 11.322 74.919 93.924 1.00 16.63 +ATOM 926 CA LEU A 205 10.320 74.437 92.980 1.00 16.67 +ATOM 927 C LEU A 205 10.752 73.115 92.388 1.00 17.74 +ATOM 928 O LEU A 205 11.932 72.923 92.077 1.00 18.84 +ATOM 929 CB LEU A 205 10.117 75.416 91.823 1.00 16.03 +ATOM 930 CG LEU A 205 9.851 76.900 92.058 1.00 17.28 +ATOM 931 CD1 LEU A 205 9.144 77.442 90.825 1.00 16.88 +ATOM 932 CD2 LEU A 205 9.008 77.124 93.275 1.00 16.63 +ATOM 933 N LYS A 206 9.798 72.203 92.224 1.00 16.47 +ATOM 934 CA LYS A 206 10.101 70.910 91.640 1.00 16.33 +ATOM 935 C LYS A 206 9.100 70.526 90.571 1.00 16.01 +ATOM 936 O LYS A 206 7.894 70.752 90.711 1.00 14.46 +ATOM 937 CB LYS A 206 10.107 69.811 92.698 1.00 17.02 +ATOM 938 CG LYS A 206 11.212 69.898 93.731 1.00 18.08 +ATOM 939 CD LYS A 206 11.089 68.734 94.695 1.00 17.22 +ATOM 940 CE LYS A 206 12.080 68.823 95.831 1.00 17.22 +ATOM 941 NZ LYS A 206 11.876 67.675 96.752 1.00 18.88 +ATOM 942 N TYR A 207 9.621 69.953 89.493 1.00 15.13 +ATOM 943 CA TYR A 207 8.790 69.475 88.411 1.00 15.30 +ATOM 944 C TYR A 207 9.071 67.973 88.417 1.00 17.12 +ATOM 945 O TYR A 207 10.227 67.548 88.380 1.00 18.83 +ATOM 946 CB TYR A 207 9.203 70.131 87.091 1.00 13.70 +ATOM 947 CG TYR A 207 8.162 70.025 85.997 1.00 12.91 +ATOM 948 CD1 TYR A 207 8.376 69.216 84.878 1.00 11.58 +ATOM 949 CD2 TYR A 207 6.955 70.730 86.081 1.00 10.05 +ATOM 950 CE1 TYR A 207 7.419 69.109 83.871 1.00 8.67 +ATOM 951 CE2 TYR A 207 5.994 70.627 85.079 1.00 8.71 +ATOM 952 CZ TYR A 207 6.234 69.813 83.980 1.00 9.88 +ATOM 953 OH TYR A 207 5.287 69.684 82.993 1.00 13.41 +ATOM 954 N ASN A 208 8.012 67.177 88.501 1.00 17.55 +ATOM 955 CA ASN A 208 8.119 65.721 88.556 1.00 17.60 +ATOM 956 C ASN A 208 9.107 65.258 89.625 1.00 16.90 +ATOM 957 O ASN A 208 9.823 64.276 89.437 1.00 16.39 +ATOM 958 CB ASN A 208 8.521 65.132 87.201 1.00 18.87 +ATOM 959 CG ASN A 208 7.825 63.797 86.920 1.00 21.68 +ATOM 960 OD1 ASN A 208 7.767 62.911 87.779 1.00 19.65 +ATOM 961 ND2 ASN A 208 7.288 63.653 85.710 1.00 25.42 +ATOM 962 N GLY A 209 9.150 65.975 90.744 1.00 15.89 +ATOM 963 CA GLY A 209 10.039 65.596 91.830 1.00 16.40 +ATOM 964 C GLY A 209 11.485 66.053 91.757 1.00 16.90 +ATOM 965 O GLY A 209 12.258 65.781 92.672 1.00 16.45 +ATOM 966 N ILE A 210 11.865 66.731 90.677 1.00 16.86 +ATOM 967 CA ILE A 210 13.237 67.214 90.537 1.00 17.52 +ATOM 968 C ILE A 210 13.270 68.736 90.512 1.00 15.69 +ATOM 969 O ILE A 210 12.503 69.377 89.789 1.00 15.92 +ATOM 970 CB ILE A 210 13.921 66.647 89.259 1.00 18.33 +ATOM 971 CG1 ILE A 210 13.080 66.966 88.028 1.00 23.38 +ATOM 972 CG2 ILE A 210 14.068 65.136 89.380 1.00 19.17 +ATOM 973 CD1 ILE A 210 13.357 66.058 86.819 1.00 25.05 +ATOM 974 N ILE A 211 14.158 69.298 91.325 1.00 13.73 +ATOM 975 CA ILE A 211 14.318 70.742 91.439 1.00 14.42 +ATOM 976 C ILE A 211 14.547 71.441 90.090 1.00 14.33 +ATOM 977 O ILE A 211 15.494 71.116 89.375 1.00 12.95 +ATOM 978 CB ILE A 211 15.484 71.088 92.399 1.00 13.13 +ATOM 979 CG1 ILE A 211 15.191 70.522 93.796 1.00 12.89 +ATOM 980 CG2 ILE A 211 15.671 72.588 92.459 1.00 12.43 +ATOM 981 CD1 ILE A 211 16.200 70.899 94.862 1.00 12.42 +ATOM 982 N THR A 212 13.668 72.393 89.757 1.00 14.25 +ATOM 983 CA THR A 212 13.747 73.146 88.499 1.00 14.24 +ATOM 984 C THR A 212 14.023 74.647 88.677 1.00 16.12 +ATOM 985 O THR A 212 14.270 75.356 87.701 1.00 17.58 +ATOM 986 CB THR A 212 12.457 73.019 87.675 1.00 12.14 +ATOM 987 OG1 THR A 212 11.323 73.222 88.529 1.00 13.02 +ATOM 988 CG2 THR A 212 12.378 71.672 87.011 1.00 8.11 +ATOM 989 N ASP A 213 13.960 75.134 89.912 1.00 16.31 +ATOM 990 CA ASP A 213 14.237 76.537 90.177 1.00 18.02 +ATOM 991 C ASP A 213 14.207 76.844 91.667 1.00 18.66 +ATOM 992 O ASP A 213 13.748 76.039 92.465 1.00 18.52 +ATOM 993 CB ASP A 213 13.227 77.439 89.459 1.00 20.01 +ATOM 994 CG ASP A 213 13.772 78.839 89.221 1.00 21.40 +ATOM 995 OD1 ASP A 213 14.929 79.094 89.632 1.00 19.78 +ATOM 996 OD2 ASP A 213 13.057 79.674 88.617 1.00 21.95 +ATOM 997 N THR A 214 14.710 78.020 92.027 1.00 20.06 +ATOM 998 CA THR A 214 14.730 78.489 93.413 1.00 19.90 +ATOM 999 C THR A 214 14.381 79.979 93.466 1.00 19.53 +ATOM 1000 O THR A 214 14.735 80.734 92.569 1.00 19.00 +ATOM 1001 CB THR A 214 16.119 78.278 94.062 1.00 19.71 +ATOM 1002 OG1 THR A 214 16.133 77.034 94.772 1.00 19.73 +ATOM 1003 CG2 THR A 214 16.432 79.402 95.021 1.00 19.77 +ATOM 1004 N ILE A 215 13.682 80.387 94.521 1.00 20.02 +ATOM 1005 CA ILE A 215 13.297 81.781 94.708 1.00 19.70 +ATOM 1006 C ILE A 215 13.598 82.158 96.151 1.00 21.02 +ATOM 1007 O ILE A 215 12.970 81.630 97.070 1.00 20.95 +ATOM 1008 CB ILE A 215 11.795 81.976 94.477 1.00 20.44 +ATOM 1009 CG1 ILE A 215 11.398 81.396 93.115 1.00 20.30 +ATOM 1010 CG2 ILE A 215 11.444 83.456 94.560 1.00 18.77 +ATOM 1011 CD1 ILE A 215 9.894 81.275 92.921 1.00 21.91 +ATOM 1012 N LYS A 216 14.561 83.057 96.356 1.00 21.91 +ATOM 1013 CA LYS A 216 14.918 83.495 97.707 1.00 22.79 +ATOM 1014 C LYS A 216 14.113 84.713 98.133 1.00 21.11 +ATOM 1015 O LYS A 216 13.692 85.506 97.298 1.00 20.34 +ATOM 1016 CB LYS A 216 16.416 83.823 97.798 1.00 26.84 +ATOM 1017 CG LYS A 216 16.961 84.715 96.654 1.00 33.31 +ATOM 1018 CD LYS A 216 18.473 85.028 96.845 1.00 35.34 +ATOM 1019 CE LYS A 216 19.166 85.488 95.542 1.00 35.90 +ATOM 1020 NZ LYS A 216 19.311 84.392 94.514 1.00 34.35 +ATOM 1021 N SER A 217 13.897 84.840 99.440 1.00 21.03 +ATOM 1022 CA SER A 217 13.158 85.960 100.022 1.00 20.08 +ATOM 1023 C SER A 217 13.775 87.258 99.515 1.00 20.87 +ATOM 1024 O SER A 217 14.998 87.363 99.441 1.00 20.37 +ATOM 1025 CB SER A 217 13.260 85.900 101.549 1.00 19.57 +ATOM 1026 OG SER A 217 12.803 87.093 102.164 1.00 18.17 +ATOM 1027 N TRP A 218 12.940 88.239 99.169 1.00 20.53 +ATOM 1028 CA TRP A 218 13.439 89.518 98.658 1.00 21.29 +ATOM 1029 C TRP A 218 13.279 90.680 99.639 1.00 22.57 +ATOM 1030 O TRP A 218 13.714 91.806 99.359 1.00 23.16 +ATOM 1031 CB TRP A 218 12.764 89.857 97.323 1.00 19.09 +ATOM 1032 CG TRP A 218 11.284 90.047 97.405 1.00 19.09 +ATOM 1033 CD1 TRP A 218 10.623 91.201 97.682 1.00 18.47 +ATOM 1034 CD2 TRP A 218 10.275 89.043 97.206 1.00 17.64 +ATOM 1035 NE1 TRP A 218 9.263 90.987 97.665 1.00 18.95 +ATOM 1036 CE2 TRP A 218 9.023 89.670 97.377 1.00 17.86 +ATOM 1037 CE3 TRP A 218 10.311 87.676 96.900 1.00 17.01 +ATOM 1038 CZ2 TRP A 218 7.812 88.977 97.252 1.00 16.86 +ATOM 1039 CZ3 TRP A 218 9.113 86.989 96.775 1.00 16.49 +ATOM 1040 CH2 TRP A 218 7.876 87.644 96.951 1.00 17.12 +ATOM 1041 N ARG A 219 12.672 90.395 100.788 1.00 22.35 +ATOM 1042 CA ARG A 219 12.456 91.388 101.839 1.00 23.85 +ATOM 1043 C ARG A 219 12.930 90.827 103.180 1.00 23.12 +ATOM 1044 O ARG A 219 12.836 91.490 104.213 1.00 22.27 +ATOM 1045 CB ARG A 219 10.966 91.748 101.944 1.00 27.83 +ATOM 1046 CG ARG A 219 10.473 92.719 100.882 1.00 32.52 +ATOM 1047 CD ARG A 219 11.072 94.105 101.111 1.00 36.73 +ATOM 1048 NE ARG A 219 10.860 94.981 99.962 1.00 42.65 +ATOM 1049 CZ ARG A 219 11.556 96.095 99.736 1.00 46.40 +ATOM 1050 NH1 ARG A 219 12.509 96.474 100.588 1.00 46.53 +ATOM 1051 NH2 ARG A 219 11.324 96.817 98.641 1.00 47.83 +ATOM 1052 N ASN A 220 13.424 89.594 103.155 1.00 22.06 +ATOM 1053 CA ASN A 220 13.913 88.927 104.356 1.00 21.70 +ATOM 1054 C ASN A 220 12.917 88.919 105.511 1.00 21.14 +ATOM 1055 O ASN A 220 13.292 89.170 106.654 1.00 21.07 +ATOM 1056 CB ASN A 220 15.212 89.571 104.843 1.00 22.13 +ATOM 1057 CG ASN A 220 16.327 89.484 103.826 1.00 22.35 +ATOM 1058 OD1 ASN A 220 16.275 88.695 102.876 1.00 24.78 +ATOM 1059 ND2 ASN A 220 17.354 90.287 104.027 1.00 21.25 +ATOM 1060 N ASN A 221 11.652 88.636 105.231 1.00 19.94 +ATOM 1061 CA ASN A 221 10.675 88.591 106.308 1.00 18.24 +ATOM 1062 C ASN A 221 9.594 87.539 106.067 1.00 18.45 +ATOM 1063 O ASN A 221 8.444 87.858 105.756 1.00 18.58 +ATOM 1064 CB ASN A 221 10.050 89.971 106.518 1.00 15.30 +ATOM 1065 CG ASN A 221 9.119 90.016 107.712 1.00 13.88 +ATOM 1066 OD1 ASN A 221 9.035 89.067 108.491 1.00 13.89 +ATOM 1067 ND2 ASN A 221 8.417 91.131 107.867 1.00 13.96 +ATOM 1068 N ILE A 222 10.001 86.281 106.213 1.00 17.92 +ATOM 1069 CA ILE A 222 9.132 85.122 106.062 1.00 17.46 +ATOM 1070 C ILE A 222 8.481 84.939 104.693 1.00 18.31 +ATOM 1071 O ILE A 222 7.258 85.065 104.564 1.00 19.09 +ATOM 1072 CB ILE A 222 8.024 85.142 107.135 1.00 17.38 +ATOM 1073 CG1 ILE A 222 8.653 85.375 108.510 1.00 17.48 +ATOM 1074 CG2 ILE A 222 7.265 83.814 107.148 1.00 16.00 +ATOM 1075 CD1 ILE A 222 7.642 85.457 109.633 1.00 17.28 +ATOM 1076 N LEU A 223 9.282 84.642 103.669 1.00 17.87 +ATOM 1077 CA LEU A 223 8.715 84.417 102.336 1.00 17.68 +ATOM 1078 C LEU A 223 7.676 83.307 102.493 1.00 16.86 +ATOM 1079 O LEU A 223 7.967 82.248 103.052 1.00 18.58 +ATOM 1080 CB LEU A 223 9.798 83.979 101.343 1.00 17.39 +ATOM 1081 CG LEU A 223 9.298 83.453 99.991 1.00 15.33 +ATOM 1082 CD1 LEU A 223 8.748 84.577 99.120 1.00 14.72 +ATOM 1083 CD2 LEU A 223 10.445 82.775 99.296 1.00 15.84 +ATOM 1084 N ARG A 224 6.466 83.555 102.013 1.00 16.16 +ATOM 1085 CA ARG A 224 5.386 82.589 102.141 1.00 15.25 +ATOM 1086 C ARG A 224 4.525 82.542 100.887 1.00 17.33 +ATOM 1087 O ARG A 224 4.617 83.427 100.026 1.00 17.63 +ATOM 1088 CB ARG A 224 4.534 82.931 103.368 1.00 15.94 +ATOM 1089 CG ARG A 224 4.292 84.431 103.591 1.00 13.60 +ATOM 1090 CD ARG A 224 3.724 84.711 104.991 1.00 13.60 +ATOM 1091 NE ARG A 224 3.363 86.117 105.180 1.00 14.30 +ATOM 1092 CZ ARG A 224 4.230 87.128 105.149 1.00 13.33 +ATOM 1093 NH1 ARG A 224 3.812 88.372 105.326 1.00 11.92 +ATOM 1094 NH2 ARG A 224 5.522 86.899 104.944 1.00 16.20 +ATOM 1095 N THR A 225 3.686 81.511 100.780 1.00 17.09 +ATOM 1096 CA THR A 225 2.850 81.366 99.599 1.00 16.04 +ATOM 1097 C THR A 225 1.401 80.912 99.853 1.00 15.72 +ATOM 1098 O THR A 225 0.877 81.042 100.963 1.00 15.84 +ATOM 1099 CB THR A 225 3.549 80.428 98.565 1.00 16.09 +ATOM 1100 OG1 THR A 225 2.916 80.567 97.288 1.00 16.81 +ATOM 1101 CG2 THR A 225 3.487 78.971 99.014 1.00 16.31 +ATOM 1102 N GLN A 226 0.779 80.366 98.812 1.00 14.72 +ATOM 1103 CA GLN A 226 -0.618 79.949 98.823 1.00 15.51 +ATOM 1104 C GLN A 226 -1.198 79.017 99.873 1.00 16.28 +ATOM 1105 O GLN A 226 -2.249 79.311 100.432 1.00 16.26 +ATOM 1106 CB GLN A 226 -0.987 79.379 97.462 1.00 15.49 +ATOM 1107 CG GLN A 226 -0.769 80.325 96.310 1.00 16.37 +ATOM 1108 CD GLN A 226 -1.419 79.815 95.044 1.00 18.64 +ATOM 1109 OE1 GLN A 226 -2.649 79.694 94.972 1.00 19.04 +ATOM 1110 NE2 GLN A 226 -0.603 79.500 94.039 1.00 17.39 +ATOM 1111 N GLU A 227 -0.546 77.889 100.125 1.00 16.63 +ATOM 1112 CA GLU A 227 -1.070 76.916 101.077 1.00 17.34 +ATOM 1113 C GLU A 227 -2.335 76.294 100.458 1.00 17.58 +ATOM 1114 O GLU A 227 -3.255 75.884 101.165 1.00 17.17 +ATOM 1115 CB GLU A 227 -1.394 77.577 102.431 1.00 18.30 +ATOM 1116 CG GLU A 227 -0.250 78.417 103.031 1.00 21.61 +ATOM 1117 CD GLU A 227 0.943 77.590 103.502 1.00 22.82 +ATOM 1118 OE1 GLU A 227 1.419 76.720 102.739 1.00 22.58 +ATOM 1119 OE2 GLU A 227 1.420 77.822 104.643 1.00 26.66 +ATOM 1120 N SER A 228 -2.364 76.266 99.120 1.00 18.04 +ATOM 1121 CA SER A 228 -3.443 75.673 98.314 1.00 17.11 +ATOM 1122 C SER A 228 -2.865 75.430 96.917 1.00 17.69 +ATOM 1123 O SER A 228 -1.654 75.523 96.732 1.00 18.70 +ATOM 1124 CB SER A 228 -4.702 76.562 98.243 1.00 15.77 +ATOM 1125 OG SER A 228 -4.458 77.845 97.713 1.00 16.72 +ATOM 1126 N GLU A 229 -3.702 75.133 95.931 1.00 17.57 +ATOM 1127 CA GLU A 229 -3.183 74.833 94.602 1.00 17.95 +ATOM 1128 C GLU A 229 -2.904 76.050 93.742 1.00 19.18 +ATOM 1129 O GLU A 229 -3.588 77.064 93.848 1.00 21.05 +ATOM 1130 CB GLU A 229 -4.145 73.905 93.843 1.00 17.55 +ATOM 1131 CG GLU A 229 -5.455 74.572 93.451 1.00 18.04 +ATOM 1132 CD GLU A 229 -6.276 73.790 92.417 1.00 21.04 +ATOM 1133 OE1 GLU A 229 -7.278 74.353 91.910 1.00 22.18 +ATOM 1134 OE2 GLU A 229 -5.937 72.624 92.107 1.00 19.92 +ATOM 1135 N CYS A 230 -1.879 75.944 92.899 1.00 18.58 +ATOM 1136 CA CYS A 230 -1.543 77.011 91.981 1.00 17.96 +ATOM 1137 C CYS A 230 -2.349 76.718 90.730 1.00 17.75 +ATOM 1138 O CYS A 230 -2.863 75.615 90.578 1.00 18.47 +ATOM 1139 CB CYS A 230 -0.043 77.035 91.666 1.00 19.57 +ATOM 1140 SG CYS A 230 0.860 75.448 91.577 1.00 20.47 +ATOM 1141 N ALA A 231 -2.467 77.688 89.834 1.00 16.75 +ATOM 1142 CA ALA A 231 -3.271 77.488 88.631 1.00 15.71 +ATOM 1143 C ALA A 231 -2.463 77.357 87.343 1.00 14.41 +ATOM 1144 O ALA A 231 -1.535 78.119 87.105 1.00 11.66 +ATOM 1145 CB ALA A 231 -4.288 78.625 88.503 1.00 13.01 +ATOM 1146 N CYS A 232 -2.821 76.390 86.508 1.00 15.49 +ATOM 1147 CA CYS A 232 -2.097 76.210 85.252 1.00 18.33 +ATOM 1148 C CYS A 232 -2.986 76.478 84.044 1.00 17.57 +ATOM 1149 O CYS A 232 -4.144 76.096 84.021 1.00 17.12 +ATOM 1150 CB CYS A 232 -1.511 74.794 85.155 1.00 19.17 +ATOM 1151 SG CYS A 232 -0.420 74.247 86.524 1.00 24.32 +ATOM 1152 N VAL A 233 -2.429 77.149 83.045 1.00 19.06 +ATOM 1153 CA VAL A 233 -3.152 77.462 81.815 1.00 19.04 +ATOM 1154 C VAL A 233 -2.256 77.314 80.591 1.00 19.53 +ATOM 1155 O VAL A 233 -1.123 77.794 80.585 1.00 20.82 +ATOM 1156 CB VAL A 233 -3.674 78.903 81.834 1.00 19.55 +ATOM 1157 CG1 VAL A 233 -4.174 79.289 80.452 1.00 20.27 +ATOM 1158 CG2 VAL A 233 -4.784 79.031 82.849 1.00 19.12 +ATOM 1159 N ASN A 234 -2.756 76.639 79.561 1.00 19.31 +ATOM 1160 CA ASN A 234 -2.002 76.471 78.317 1.00 18.99 +ATOM 1161 C ASN A 234 -0.517 76.146 78.509 1.00 18.57 +ATOM 1162 O ASN A 234 0.320 76.604 77.748 1.00 20.21 +ATOM 1163 CB ASN A 234 -2.184 77.747 77.460 1.00 20.56 +ATOM 1164 CG ASN A 234 -1.309 77.780 76.203 1.00 20.42 +ATOM 1165 OD1 ASN A 234 -1.147 76.777 75.504 1.00 19.14 +ATOM 1166 ND2 ASN A 234 -0.760 78.960 75.903 1.00 19.19 +ATOM 1167 N GLY A 235 -0.189 75.359 79.527 1.00 17.82 +ATOM 1168 CA GLY A 235 1.199 74.985 79.741 1.00 16.50 +ATOM 1169 C GLY A 235 1.986 75.832 80.723 1.00 17.60 +ATOM 1170 O GLY A 235 3.190 75.647 80.874 1.00 17.35 +ATOM 1171 N SER A 236 1.317 76.765 81.394 1.00 17.84 +ATOM 1172 CA SER A 236 1.990 77.626 82.365 1.00 16.59 +ATOM 1173 C SER A 236 1.208 77.613 83.672 1.00 17.57 +ATOM 1174 O SER A 236 -0.028 77.570 83.678 1.00 17.29 +ATOM 1175 CB SER A 236 2.075 79.060 81.847 1.00 13.78 +ATOM 1176 OG SER A 236 2.628 79.102 80.551 1.00 15.90 +ATOM 1177 N CYS A 237 1.928 77.645 84.783 1.00 17.52 +ATOM 1178 CA CYS A 237 1.283 77.647 86.082 1.00 18.25 +ATOM 1179 C CYS A 237 1.661 78.941 86.788 1.00 17.52 +ATOM 1180 O CYS A 237 2.790 79.412 86.668 1.00 19.08 +ATOM 1181 CB CYS A 237 1.722 76.425 86.881 1.00 18.69 +ATOM 1182 SG CYS A 237 1.471 74.843 86.006 1.00 24.99 +ATOM 1183 N PHE A 238 0.709 79.522 87.508 1.00 16.21 +ATOM 1184 CA PHE A 238 0.947 80.777 88.197 1.00 17.13 +ATOM 1185 C PHE A 238 0.657 80.673 89.692 1.00 18.10 +ATOM 1186 O PHE A 238 -0.274 79.977 90.117 1.00 17.83 +ATOM 1187 CB PHE A 238 0.070 81.886 87.606 1.00 18.08 +ATOM 1188 CG PHE A 238 0.034 81.915 86.104 1.00 17.47 +ATOM 1189 CD1 PHE A 238 -0.723 80.991 85.395 1.00 16.41 +ATOM 1190 CD2 PHE A 238 0.737 82.886 85.399 1.00 17.84 +ATOM 1191 CE1 PHE A 238 -0.783 81.031 84.011 1.00 16.39 +ATOM 1192 CE2 PHE A 238 0.686 82.938 84.015 1.00 17.48 +ATOM 1193 CZ PHE A 238 -0.078 82.006 83.317 1.00 18.09 +ATOM 1194 N THR A 239 1.450 81.383 90.485 1.00 17.33 +ATOM 1195 CA THR A 239 1.275 81.368 91.928 1.00 18.69 +ATOM 1196 C THR A 239 1.481 82.775 92.470 1.00 16.95 +ATOM 1197 O THR A 239 1.864 83.686 91.739 1.00 16.98 +ATOM 1198 CB THR A 239 2.296 80.406 92.589 1.00 19.82 +ATOM 1199 OG1 THR A 239 1.947 80.183 93.962 1.00 20.69 +ATOM 1200 CG2 THR A 239 3.694 80.996 92.515 1.00 20.11 +ATOM 1201 N VAL A 240 1.214 82.941 93.757 1.00 16.21 +ATOM 1202 CA VAL A 240 1.375 84.225 94.421 1.00 15.43 +ATOM 1203 C VAL A 240 2.209 84.019 95.682 1.00 16.34 +ATOM 1204 O VAL A 240 2.050 83.015 96.381 1.00 16.76 +ATOM 1205 CB VAL A 240 0.015 84.821 94.828 1.00 14.04 +ATOM 1206 CG1 VAL A 240 0.228 86.123 95.581 1.00 11.84 +ATOM 1207 CG2 VAL A 240 -0.851 85.040 93.597 1.00 12.13 +ATOM 1208 N MET A 241 3.105 84.961 95.957 1.00 16.27 +ATOM 1209 CA MET A 241 3.953 84.892 97.139 1.00 16.44 +ATOM 1210 C MET A 241 3.995 86.250 97.831 1.00 15.64 +ATOM 1211 O MET A 241 3.777 87.292 97.209 1.00 13.83 +ATOM 1212 CB MET A 241 5.380 84.451 96.774 1.00 16.12 +ATOM 1213 CG MET A 241 5.462 83.104 96.079 1.00 17.09 +ATOM 1214 SD MET A 241 7.139 82.417 96.050 1.00 19.59 +ATOM 1215 CE MET A 241 6.853 80.814 96.712 1.00 19.24 +ATOM 1216 N THR A 242 4.276 86.223 99.126 1.00 15.52 +ATOM 1217 CA THR A 242 4.334 87.431 99.928 1.00 17.74 +ATOM 1218 C THR A 242 5.589 87.429 100.784 1.00 19.29 +ATOM 1219 O THR A 242 6.012 86.387 101.291 1.00 20.92 +ATOM 1220 CB THR A 242 3.118 87.529 100.872 1.00 18.00 +ATOM 1221 OG1 THR A 242 1.920 87.654 100.099 1.00 16.57 +ATOM 1222 CG2 THR A 242 3.254 88.729 101.807 1.00 18.87 +ATOM 1223 N ASP A 243 6.185 88.602 100.938 1.00 20.13 +ATOM 1224 CA ASP A 243 7.375 88.755 101.755 1.00 20.39 +ATOM 1225 C ASP A 243 7.196 90.091 102.444 1.00 21.62 +ATOM 1226 O ASP A 243 6.955 91.116 101.796 1.00 22.88 +ATOM 1227 CB ASP A 243 8.631 88.754 100.881 1.00 20.85 +ATOM 1228 CG ASP A 243 9.893 88.397 101.660 1.00 20.14 +ATOM 1229 OD1 ASP A 243 10.912 88.088 101.008 1.00 18.95 +ATOM 1230 OD2 ASP A 243 9.869 88.428 102.913 1.00 19.21 +ATOM 1231 N GLY A 244 7.292 90.080 103.762 1.00 21.25 +ATOM 1232 CA GLY A 244 7.116 91.303 104.508 1.00 21.20 +ATOM 1233 C GLY A 244 6.270 91.037 105.738 1.00 21.87 +ATOM 1234 O GLY A 244 6.097 89.889 106.146 1.00 22.84 +ATOM 1235 N PRO A 245 5.729 92.088 106.358 1.00 21.51 +ATOM 1236 CA PRO A 245 4.901 91.946 107.560 1.00 20.46 +ATOM 1237 C PRO A 245 3.490 91.381 107.369 1.00 18.97 +ATOM 1238 O PRO A 245 2.806 91.699 106.395 1.00 18.63 +ATOM 1239 CB PRO A 245 4.849 93.375 108.120 1.00 20.01 +ATOM 1240 CG PRO A 245 6.088 94.021 107.572 1.00 21.17 +ATOM 1241 CD PRO A 245 6.121 93.495 106.159 1.00 22.47 +ATOM 1242 N SER A 246 3.068 90.537 108.305 1.00 16.47 +ATOM 1243 CA SER A 246 1.716 90.014 108.275 1.00 17.78 +ATOM 1244 C SER A 246 0.980 91.093 109.065 1.00 17.84 +ATOM 1245 O SER A 246 -0.235 91.062 109.243 1.00 17.71 +ATOM 1246 CB SER A 246 1.632 88.650 108.977 1.00 17.06 +ATOM 1247 OG SER A 246 2.086 88.686 110.319 1.00 17.05 +ATOM 1248 N ASN A 247 1.775 92.079 109.477 1.00 18.92 +ATOM 1249 CA ASN A 247 1.379 93.229 110.282 1.00 19.28 +ATOM 1250 C ASN A 247 0.971 94.522 109.551 1.00 19.62 +ATOM 1251 O ASN A 247 0.338 95.388 110.149 1.00 18.83 +ATOM 1252 CB ASN A 247 2.532 93.573 111.222 1.00 17.32 +ATOM 1253 CG ASN A 247 2.131 93.498 112.664 1.00 18.57 +ATOM 1254 OD1 ASN A 247 0.952 93.336 112.972 1.00 21.15 +ATOM 1255 ND2 ASN A 247 3.100 93.621 113.563 1.00 16.08 +ATOM 1256 N GLY A 248 1.367 94.673 108.288 1.00 19.48 +ATOM 1257 CA GLY A 248 1.038 95.873 107.537 1.00 18.63 +ATOM 1258 C GLY A 248 1.415 95.707 106.072 1.00 20.78 +ATOM 1259 O GLY A 248 1.420 94.579 105.561 1.00 19.82 +ATOM 1260 N GLN A 249 1.729 96.816 105.395 1.00 20.62 +ATOM 1261 CA GLN A 249 2.108 96.794 103.979 1.00 19.77 +ATOM 1262 C GLN A 249 3.204 95.767 103.722 1.00 19.68 +ATOM 1263 O GLN A 249 4.280 95.851 104.307 1.00 20.48 +ATOM 1264 CB GLN A 249 2.640 98.168 103.540 1.00 20.37 +ATOM 1265 CG GLN A 249 1.855 98.864 102.433 1.00 21.92 +ATOM 1266 CD GLN A 249 1.507 97.948 101.273 1.00 23.74 +ATOM 1267 OE1 GLN A 249 2.339 97.171 100.805 1.00 27.13 +ATOM 1268 NE2 GLN A 249 0.274 98.042 100.798 1.00 23.97 +ATOM 1269 N ALA A 250 2.942 94.807 102.844 1.00 18.79 +ATOM 1270 CA ALA A 250 3.944 93.799 102.512 1.00 17.00 +ATOM 1271 C ALA A 250 4.130 93.773 101.000 1.00 16.74 +ATOM 1272 O ALA A 250 3.350 94.378 100.269 1.00 17.10 +ATOM 1273 CB ALA A 250 3.515 92.434 103.017 1.00 16.68 +ATOM 1274 N SER A 251 5.162 93.078 100.533 1.00 15.85 +ATOM 1275 CA SER A 251 5.443 92.997 99.108 1.00 14.41 +ATOM 1276 C SER A 251 4.795 91.749 98.505 1.00 14.77 +ATOM 1277 O SER A 251 4.950 90.637 99.015 1.00 15.16 +ATOM 1278 CB SER A 251 6.962 92.992 98.877 1.00 15.66 +ATOM 1279 OG SER A 251 7.296 92.980 97.496 1.00 16.54 +ATOM 1280 N TYR A 252 4.070 91.943 97.411 1.00 14.28 +ATOM 1281 CA TYR A 252 3.385 90.849 96.746 1.00 14.04 +ATOM 1282 C TYR A 252 3.882 90.613 95.323 1.00 15.37 +ATOM 1283 O TYR A 252 4.092 91.559 94.556 1.00 17.17 +ATOM 1284 CB TYR A 252 1.888 91.138 96.720 1.00 12.14 +ATOM 1285 CG TYR A 252 1.416 91.819 97.973 1.00 12.56 +ATOM 1286 CD1 TYR A 252 1.040 93.159 97.964 1.00 10.94 +ATOM 1287 CD2 TYR A 252 1.411 91.141 99.193 1.00 13.62 +ATOM 1288 CE1 TYR A 252 0.678 93.810 99.143 1.00 11.43 +ATOM 1289 CE2 TYR A 252 1.051 91.784 100.374 1.00 13.38 +ATOM 1290 CZ TYR A 252 0.689 93.112 100.343 1.00 11.77 +ATOM 1291 OH TYR A 252 0.339 93.728 101.516 1.00 13.26 +ATOM 1292 N LYS A 253 4.048 89.344 94.964 1.00 15.35 +ATOM 1293 CA LYS A 253 4.506 88.997 93.628 1.00 15.47 +ATOM 1294 C LYS A 253 3.765 87.822 92.993 1.00 15.71 +ATOM 1295 O LYS A 253 3.369 86.872 93.671 1.00 15.63 +ATOM 1296 CB LYS A 253 5.997 88.672 93.650 1.00 16.29 +ATOM 1297 CG LYS A 253 6.906 89.824 93.993 1.00 16.45 +ATOM 1298 CD LYS A 253 8.328 89.408 93.716 1.00 18.46 +ATOM 1299 CE LYS A 253 9.331 90.478 94.091 1.00 19.78 +ATOM 1300 NZ LYS A 253 10.679 90.094 93.579 1.00 20.99 +ATOM 1301 N ILE A 254 3.594 87.902 91.678 1.00 15.00 +ATOM 1302 CA ILE A 254 2.945 86.851 90.900 1.00 16.74 +ATOM 1303 C ILE A 254 4.011 86.173 90.056 1.00 17.50 +ATOM 1304 O ILE A 254 4.766 86.841 89.346 1.00 16.97 +ATOM 1305 CB ILE A 254 1.918 87.403 89.921 1.00 17.38 +ATOM 1306 CG1 ILE A 254 0.695 87.927 90.660 1.00 19.83 +ATOM 1307 CG2 ILE A 254 1.527 86.318 88.949 1.00 19.77 +ATOM 1308 CD1 ILE A 254 -0.284 88.615 89.733 1.00 21.52 +ATOM 1309 N PHE A 255 4.071 84.849 90.112 1.00 17.67 +ATOM 1310 CA PHE A 255 5.063 84.141 89.325 1.00 16.41 +ATOM 1311 C PHE A 255 4.433 83.287 88.243 1.00 15.89 +ATOM 1312 O PHE A 255 3.390 82.674 88.444 1.00 16.19 +ATOM 1313 CB PHE A 255 5.942 83.274 90.227 1.00 17.18 +ATOM 1314 CG PHE A 255 6.676 84.048 91.287 1.00 16.90 +ATOM 1315 CD1 PHE A 255 6.007 84.518 92.414 1.00 18.38 +ATOM 1316 CD2 PHE A 255 8.036 84.306 91.162 1.00 17.18 +ATOM 1317 CE1 PHE A 255 6.687 85.233 93.405 1.00 17.18 +ATOM 1318 CE2 PHE A 255 8.721 85.018 92.143 1.00 16.39 +ATOM 1319 CZ PHE A 255 8.044 85.480 93.267 1.00 17.09 +ATOM 1320 N LYS A 256 5.064 83.288 87.075 1.00 16.28 +ATOM 1321 CA LYS A 256 4.609 82.491 85.944 1.00 15.77 +ATOM 1322 C LYS A 256 5.728 81.495 85.693 1.00 16.39 +ATOM 1323 O LYS A 256 6.895 81.881 85.604 1.00 18.78 +ATOM 1324 CB LYS A 256 4.409 83.351 84.700 1.00 14.02 +ATOM 1325 CG LYS A 256 4.025 82.521 83.485 1.00 14.64 +ATOM 1326 CD LYS A 256 4.015 83.319 82.198 1.00 14.42 +ATOM 1327 CE LYS A 256 3.668 82.419 81.034 1.00 15.57 +ATOM 1328 NZ LYS A 256 3.453 83.195 79.803 1.00 17.47 +ATOM 1329 N MET A 257 5.391 80.218 85.580 1.00 16.02 +ATOM 1330 CA MET A 257 6.423 79.217 85.367 1.00 16.13 +ATOM 1331 C MET A 257 6.076 78.169 84.338 1.00 15.67 +ATOM 1332 O MET A 257 4.905 77.886 84.090 1.00 15.76 +ATOM 1333 CB MET A 257 6.763 78.552 86.697 1.00 17.02 +ATOM 1334 CG MET A 257 5.651 78.663 87.693 1.00 19.14 +ATOM 1335 SD MET A 257 6.209 78.980 89.387 1.00 20.04 +ATOM 1336 CE MET A 257 4.666 78.803 90.187 1.00 18.42 +ATOM 1337 N GLU A 258 7.117 77.602 83.742 1.00 15.11 +ATOM 1338 CA GLU A 258 6.969 76.569 82.728 1.00 17.34 +ATOM 1339 C GLU A 258 7.953 75.437 83.034 1.00 17.75 +ATOM 1340 O GLU A 258 9.167 75.649 83.105 1.00 18.45 +ATOM 1341 CB GLU A 258 7.200 77.179 81.335 1.00 16.82 +ATOM 1342 CG GLU A 258 6.150 78.248 81.001 1.00 20.00 +ATOM 1343 CD GLU A 258 6.322 78.905 79.634 1.00 21.70 +ATOM 1344 OE1 GLU A 258 5.491 79.785 79.306 1.00 20.98 +ATOM 1345 OE2 GLU A 258 7.273 78.550 78.892 1.00 24.44 +ATOM 1346 N LYS A 259 7.407 74.239 83.230 1.00 18.65 +ATOM 1347 CA LYS A 259 8.181 73.053 83.574 1.00 18.46 +ATOM 1348 C LYS A 259 8.910 73.294 84.878 1.00 18.40 +ATOM 1349 O LYS A 259 10.021 72.802 85.080 1.00 18.47 +ATOM 1350 CB LYS A 259 9.192 72.721 82.491 1.00 20.45 +ATOM 1351 CG LYS A 259 8.591 72.421 81.147 1.00 23.51 +ATOM 1352 CD LYS A 259 9.701 72.020 80.189 1.00 26.95 +ATOM 1353 CE LYS A 259 9.295 72.236 78.735 1.00 29.70 +ATOM 1354 NZ LYS A 259 10.400 71.825 77.810 1.00 33.29 +ATOM 1355 N GLY A 260 8.287 74.080 85.751 1.00 18.13 +ATOM 1356 CA GLY A 260 8.873 74.372 87.047 1.00 17.29 +ATOM 1357 C GLY A 260 9.911 75.478 87.105 1.00 17.89 +ATOM 1358 O GLY A 260 10.545 75.677 88.140 1.00 18.33 +ATOM 1359 N LYS A 261 10.099 76.202 86.007 1.00 18.80 +ATOM 1360 CA LYS A 261 11.077 77.290 85.981 1.00 19.44 +ATOM 1361 C LYS A 261 10.370 78.640 85.841 1.00 17.56 +ATOM 1362 O LYS A 261 9.460 78.787 85.022 1.00 17.74 +ATOM 1363 CB LYS A 261 12.068 77.077 84.820 1.00 20.88 +ATOM 1364 CG LYS A 261 13.096 78.192 84.644 1.00 24.29 +ATOM 1365 CD LYS A 261 14.158 77.861 83.583 1.00 25.75 +ATOM 1366 CE LYS A 261 15.360 77.107 84.171 1.00 30.06 +ATOM 1367 NZ LYS A 261 15.102 75.659 84.558 1.00 30.49 +ATOM 1368 N VAL A 262 10.778 79.617 86.649 1.00 16.06 +ATOM 1369 CA VAL A 262 10.179 80.953 86.596 1.00 15.30 +ATOM 1370 C VAL A 262 10.578 81.648 85.292 1.00 15.37 +ATOM 1371 O VAL A 262 11.743 81.965 85.100 1.00 16.59 +ATOM 1372 CB VAL A 262 10.636 81.832 87.797 1.00 13.91 +ATOM 1373 CG1 VAL A 262 10.070 83.234 87.664 1.00 11.83 +ATOM 1374 CG2 VAL A 262 10.177 81.214 89.107 1.00 11.51 +ATOM 1375 N VAL A 263 9.613 81.869 84.401 1.00 14.98 +ATOM 1376 CA VAL A 263 9.881 82.519 83.113 1.00 16.11 +ATOM 1377 C VAL A 263 9.571 84.016 83.143 1.00 17.55 +ATOM 1378 O VAL A 263 10.046 84.771 82.288 1.00 18.00 +ATOM 1379 CB VAL A 263 9.071 81.867 81.956 1.00 15.38 +ATOM 1380 CG1 VAL A 263 9.633 80.500 81.634 1.00 14.63 +ATOM 1381 CG2 VAL A 263 7.604 81.745 82.346 1.00 13.23 +ATOM 1382 N LYS A 264 8.757 84.428 84.116 1.00 17.88 +ATOM 1383 CA LYS A 264 8.396 85.828 84.311 1.00 17.64 +ATOM 1384 C LYS A 264 7.827 86.029 85.699 1.00 18.40 +ATOM 1385 O LYS A 264 7.310 85.097 86.303 1.00 18.77 +ATOM 1386 CB LYS A 264 7.362 86.298 83.300 1.00 17.85 +ATOM 1387 CG LYS A 264 7.054 87.780 83.459 1.00 17.69 +ATOM 1388 CD LYS A 264 6.217 88.317 82.331 1.00 19.96 +ATOM 1389 CE LYS A 264 6.270 89.837 82.314 1.00 21.57 +ATOM 1390 NZ LYS A 264 5.504 90.403 81.165 1.00 24.30 +ATOM 1391 N SER A 265 7.920 87.255 86.199 1.00 19.91 +ATOM 1392 CA SER A 265 7.412 87.590 87.522 1.00 19.50 +ATOM 1393 C SER A 265 7.120 89.077 87.608 1.00 19.57 +ATOM 1394 O SER A 265 7.826 89.895 87.016 1.00 21.74 +ATOM 1395 CB SER A 265 8.445 87.242 88.585 1.00 20.27 +ATOM 1396 OG SER A 265 9.453 88.238 88.636 1.00 19.91 +ATOM 1397 N VAL A 266 6.088 89.432 88.359 1.00 18.91 +ATOM 1398 CA VAL A 266 5.728 90.830 88.520 1.00 17.61 +ATOM 1399 C VAL A 266 5.368 91.116 89.960 1.00 18.38 +ATOM 1400 O VAL A 266 4.799 90.264 90.645 1.00 17.12 +ATOM 1401 CB VAL A 266 4.524 91.201 87.652 1.00 18.22 +ATOM 1402 CG1 VAL A 266 4.139 92.639 87.910 1.00 17.04 +ATOM 1403 CG2 VAL A 266 4.851 90.977 86.181 1.00 18.53 +ATOM 1404 N GLU A 267 5.710 92.310 90.434 1.00 20.06 +ATOM 1405 CA GLU A 267 5.363 92.668 91.797 1.00 22.23 +ATOM 1406 C GLU A 267 4.155 93.570 91.736 1.00 22.36 +ATOM 1407 O GLU A 267 4.137 94.533 90.981 1.00 23.90 +ATOM 1408 CB GLU A 267 6.494 93.402 92.504 1.00 22.29 +ATOM 1409 CG GLU A 267 6.158 93.677 93.963 1.00 23.38 +ATOM 1410 CD GLU A 267 7.309 94.294 94.711 1.00 25.29 +ATOM 1411 OE1 GLU A 267 8.461 93.855 94.509 1.00 26.74 +ATOM 1412 OE2 GLU A 267 7.063 95.209 95.516 1.00 27.37 +ATOM 1413 N LEU A 268 3.142 93.252 92.529 1.00 22.34 +ATOM 1414 CA LEU A 268 1.935 94.050 92.538 1.00 22.47 +ATOM 1415 C LEU A 268 2.127 95.431 93.160 1.00 22.71 +ATOM 1416 O LEU A 268 2.804 95.605 94.183 1.00 21.44 +ATOM 1417 CB LEU A 268 0.822 93.308 93.278 1.00 22.51 +ATOM 1418 CG LEU A 268 0.406 91.946 92.711 1.00 22.16 +ATOM 1419 CD1 LEU A 268 -0.806 91.448 93.482 1.00 19.54 +ATOM 1420 CD2 LEU A 268 0.076 92.066 91.219 1.00 21.22 +ATOM 1421 N ASP A 269 1.526 96.412 92.505 1.00 23.65 +ATOM 1422 CA ASP A 269 1.552 97.788 92.958 1.00 23.74 +ATOM 1423 C ASP A 269 0.227 97.900 93.703 1.00 23.76 +ATOM 1424 O ASP A 269 -0.742 98.472 93.204 1.00 23.92 +ATOM 1425 CB ASP A 269 1.574 98.728 91.753 1.00 24.07 +ATOM 1426 CG ASP A 269 1.772 100.179 92.145 1.00 23.92 +ATOM 1427 OD1 ASP A 269 2.024 100.450 93.336 1.00 24.00 +ATOM 1428 OD2 ASP A 269 1.688 101.049 91.251 1.00 26.05 +ATOM 1429 N ALA A 270 0.191 97.323 94.896 1.00 23.43 +ATOM 1430 CA ALA A 270 -1.017 97.316 95.694 1.00 22.54 +ATOM 1431 C ALA A 270 -0.881 98.086 96.999 1.00 21.28 +ATOM 1432 O ALA A 270 -0.808 97.504 98.083 1.00 21.28 +ATOM 1433 CB ALA A 270 -1.429 95.878 95.973 1.00 23.08 +ATOM 1434 N PRO A 271 -0.828 99.414 96.916 1.00 19.82 +ATOM 1435 CA PRO A 271 -0.709 100.142 98.178 1.00 18.93 +ATOM 1436 C PRO A 271 -2.004 100.008 98.988 1.00 17.93 +ATOM 1437 O PRO A 271 -3.101 100.056 98.433 1.00 16.66 +ATOM 1438 CB PRO A 271 -0.429 101.573 97.721 1.00 19.07 +ATOM 1439 CG PRO A 271 -1.123 101.648 96.382 1.00 19.01 +ATOM 1440 CD PRO A 271 -0.743 100.325 95.761 1.00 19.84 +ATOM 1441 N ASN A 272 -1.853 99.823 100.297 1.00 18.05 +ATOM 1442 CA ASN A 272 -2.966 99.670 101.239 1.00 17.66 +ATOM 1443 C ASN A 272 -3.688 98.319 101.114 1.00 18.77 +ATOM 1444 O ASN A 272 -4.724 98.081 101.739 1.00 17.93 +ATOM 1445 CB ASN A 272 -3.959 100.824 101.085 1.00 15.09 +ATOM 1446 CG ASN A 272 -4.929 100.908 102.245 1.00 14.89 +ATOM 1447 OD1 ASN A 272 -4.531 100.839 103.404 1.00 12.31 +ATOM 1448 ND2 ASN A 272 -6.204 101.064 101.937 1.00 15.61 +ATOM 1449 N TYR A 273 -3.123 97.434 100.297 1.00 19.10 +ATOM 1450 CA TYR A 273 -3.671 96.098 100.106 1.00 18.81 +ATOM 1451 C TYR A 273 -2.814 95.114 100.909 1.00 18.33 +ATOM 1452 O TYR A 273 -1.695 95.439 101.299 1.00 16.95 +ATOM 1453 CB TYR A 273 -3.599 95.698 98.636 1.00 18.80 +ATOM 1454 CG TYR A 273 -4.723 96.190 97.771 1.00 18.77 +ATOM 1455 CD1 TYR A 273 -4.884 97.542 97.498 1.00 18.48 +ATOM 1456 CD2 TYR A 273 -5.598 95.283 97.166 1.00 19.28 +ATOM 1457 CE1 TYR A 273 -5.883 97.981 96.639 1.00 18.53 +ATOM 1458 CE2 TYR A 273 -6.594 95.708 96.309 1.00 17.62 +ATOM 1459 CZ TYR A 273 -6.731 97.054 96.048 1.00 18.72 +ATOM 1460 OH TYR A 273 -7.703 97.458 95.170 1.00 20.82 +ATOM 1461 N HIS A 274 -3.341 93.919 101.153 1.00 18.37 +ATOM 1462 CA HIS A 274 -2.586 92.887 101.861 1.00 18.21 +ATOM 1463 C HIS A 274 -3.000 91.542 101.301 1.00 18.35 +ATOM 1464 O HIS A 274 -4.185 91.201 101.309 1.00 17.69 +ATOM 1465 CB HIS A 274 -2.859 92.914 103.365 1.00 17.96 +ATOM 1466 CG HIS A 274 -1.788 92.256 104.181 1.00 18.41 +ATOM 1467 ND1 HIS A 274 -1.991 91.086 104.883 1.00 17.22 +ATOM 1468 CD2 HIS A 274 -0.507 92.621 104.431 1.00 18.59 +ATOM 1469 CE1 HIS A 274 -0.887 90.766 105.532 1.00 16.76 +ATOM 1470 NE2 HIS A 274 0.031 91.681 105.275 1.00 17.51 +ATOM 1471 N TYR A 275 -2.024 90.789 100.803 1.00 18.22 +ATOM 1472 CA TYR A 275 -2.293 89.481 100.230 1.00 16.41 +ATOM 1473 C TYR A 275 -1.562 88.355 100.921 1.00 16.40 +ATOM 1474 O TYR A 275 -0.352 88.412 101.115 1.00 15.31 +ATOM 1475 CB TYR A 275 -1.915 89.443 98.750 1.00 17.39 +ATOM 1476 CG TYR A 275 -2.797 90.278 97.860 1.00 19.38 +ATOM 1477 CD1 TYR A 275 -2.401 91.544 97.442 1.00 19.77 +ATOM 1478 CD2 TYR A 275 -4.037 89.808 97.449 1.00 19.77 +ATOM 1479 CE1 TYR A 275 -3.224 92.321 96.631 1.00 20.45 +ATOM 1480 CE2 TYR A 275 -4.865 90.577 96.647 1.00 20.45 +ATOM 1481 CZ TYR A 275 -4.453 91.831 96.240 1.00 20.43 +ATOM 1482 OH TYR A 275 -5.279 92.587 95.444 1.00 22.17 +ATOM 1483 N GLU A 276 -2.309 87.317 101.276 1.00 17.45 +ATOM 1484 CA GLU A 276 -1.734 86.145 101.908 1.00 18.16 +ATOM 1485 C GLU A 276 -2.593 84.916 101.704 1.00 17.63 +ATOM 1486 O GLU A 276 -3.814 85.003 101.667 1.00 19.63 +ATOM 1487 CB GLU A 276 -1.493 86.397 103.401 1.00 19.83 +ATOM 1488 CG GLU A 276 0.003 86.550 103.701 1.00 24.91 +ATOM 1489 CD GLU A 276 0.290 87.481 104.851 1.00 26.23 +ATOM 1490 OE1 GLU A 276 1.470 87.656 105.200 1.00 27.86 +ATOM 1491 OE2 GLU A 276 -0.664 88.044 105.412 1.00 30.74 +ATOM 1492 N GLU A 277 -1.937 83.775 101.538 1.00 17.18 +ATOM 1493 CA GLU A 277 -2.619 82.508 101.349 1.00 15.52 +ATOM 1494 C GLU A 277 -3.742 82.577 100.317 1.00 16.08 +ATOM 1495 O GLU A 277 -4.887 82.209 100.593 1.00 17.71 +ATOM 1496 CB GLU A 277 -3.152 82.039 102.696 1.00 15.54 +ATOM 1497 CG GLU A 277 -2.106 82.140 103.796 1.00 14.26 +ATOM 1498 CD GLU A 277 -2.611 81.691 105.150 1.00 14.37 +ATOM 1499 OE1 GLU A 277 -3.804 81.900 105.446 1.00 15.24 +ATOM 1500 OE2 GLU A 277 -1.810 81.145 105.927 1.00 15.56 +ATOM 1501 N CYS A 278 -3.400 83.048 99.122 1.00 16.28 +ATOM 1502 CA CYS A 278 -4.352 83.162 98.022 1.00 15.76 +ATOM 1503 C CYS A 278 -4.822 81.818 97.492 1.00 15.62 +ATOM 1504 O CYS A 278 -4.075 80.838 97.473 1.00 15.51 +ATOM 1505 CB CYS A 278 -3.730 83.910 96.840 1.00 15.98 +ATOM 1506 SG CYS A 278 -3.392 85.668 97.129 1.00 18.94 +ATOM 1507 N SER A 279 -6.069 81.794 97.049 1.00 14.09 +ATOM 1508 CA SER A 279 -6.645 80.610 96.454 1.00 14.16 +ATOM 1509 C SER A 279 -6.870 81.054 95.013 1.00 14.41 +ATOM 1510 O SER A 279 -7.693 81.929 94.743 1.00 13.79 +ATOM 1511 CB SER A 279 -7.957 80.261 97.149 1.00 15.96 +ATOM 1512 OG SER A 279 -7.729 79.938 98.511 1.00 17.65 +ATOM 1513 N CYS A 280 -6.112 80.484 94.087 1.00 13.99 +ATOM 1514 CA CYS A 280 -6.240 80.893 92.696 1.00 14.62 +ATOM 1515 C CYS A 280 -6.788 79.819 91.778 1.00 15.94 +ATOM 1516 O CYS A 280 -6.360 78.671 91.822 1.00 16.02 +ATOM 1517 CB CYS A 280 -4.894 81.338 92.149 1.00 15.13 +ATOM 1518 SG CYS A 280 -3.970 82.597 93.092 1.00 16.83 +ATOM 1519 N TYR A 281 -7.738 80.204 90.935 1.00 16.95 +ATOM 1520 CA TYR A 281 -8.320 79.273 89.991 1.00 16.38 +ATOM 1521 C TYR A 281 -8.287 79.829 88.575 1.00 17.17 +ATOM 1522 O TYR A 281 -8.368 81.039 88.356 1.00 16.39 +ATOM 1523 CB TYR A 281 -9.769 78.935 90.369 1.00 15.76 +ATOM 1524 CG TYR A 281 -10.743 80.091 90.293 1.00 17.35 +ATOM 1525 CD1 TYR A 281 -11.004 80.886 91.409 1.00 18.39 +ATOM 1526 CD2 TYR A 281 -11.416 80.385 89.106 1.00 17.36 +ATOM 1527 CE1 TYR A 281 -11.918 81.946 91.342 1.00 18.30 +ATOM 1528 CE2 TYR A 281 -12.324 81.436 89.029 1.00 17.74 +ATOM 1529 CZ TYR A 281 -12.570 82.212 90.147 1.00 18.03 +ATOM 1530 OH TYR A 281 -13.458 83.257 90.060 1.00 18.79 +ATOM 1531 N PRO A 282 -8.151 78.938 87.588 1.00 18.77 +ATOM 1532 CA PRO A 282 -8.118 79.383 86.193 1.00 17.47 +ATOM 1533 C PRO A 282 -9.547 79.575 85.694 1.00 18.09 +ATOM 1534 O PRO A 282 -10.465 78.905 86.172 1.00 17.09 +ATOM 1535 CB PRO A 282 -7.399 78.234 85.488 1.00 18.10 +ATOM 1536 CG PRO A 282 -7.865 77.031 86.280 1.00 17.58 +ATOM 1537 CD PRO A 282 -7.783 77.514 87.708 1.00 16.47 +ATOM 1538 N ASN A 283 -9.727 80.501 84.750 1.00 18.47 +ATOM 1539 CA ASN A 283 -11.038 80.780 84.167 1.00 17.74 +ATOM 1540 C ASN A 283 -10.917 81.585 82.862 1.00 17.41 +ATOM 1541 O ASN A 283 -10.389 82.699 82.845 1.00 15.74 +ATOM 1542 CB ASN A 283 -11.930 81.520 85.179 1.00 19.18 +ATOM 1543 CG ASN A 283 -13.310 81.830 84.620 1.00 20.22 +ATOM 1544 OD1 ASN A 283 -13.495 82.823 83.918 1.00 22.25 +ATOM 1545 ND2 ASN A 283 -14.278 80.968 84.908 1.00 19.62 +ATOM 1546 N ALA A 284 -11.406 81.000 81.772 1.00 16.49 +ATOM 1547 CA ALA A 284 -11.352 81.631 80.461 1.00 16.58 +ATOM 1548 C ALA A 284 -9.943 82.124 80.114 1.00 16.81 +ATOM 1549 O ALA A 284 -9.762 83.247 79.638 1.00 16.92 +ATOM 1550 CB ALA A 284 -12.353 82.785 80.393 1.00 15.43 +ATOM 1551 N GLY A 285 -8.949 81.280 80.370 1.00 17.17 +ATOM 1552 CA GLY A 285 -7.571 81.617 80.052 1.00 18.52 +ATOM 1553 C GLY A 285 -6.827 82.563 80.976 1.00 20.18 +ATOM 1554 O GLY A 285 -5.684 82.926 80.689 1.00 21.24 +ATOM 1555 N GLU A 286 -7.454 82.959 82.079 1.00 20.52 +ATOM 1556 CA GLU A 286 -6.831 83.867 83.032 1.00 20.91 +ATOM 1557 C GLU A 286 -6.969 83.326 84.447 1.00 20.93 +ATOM 1558 O GLU A 286 -7.704 82.368 84.681 1.00 21.44 +ATOM 1559 CB GLU A 286 -7.478 85.245 82.926 1.00 23.35 +ATOM 1560 CG GLU A 286 -7.332 85.839 81.542 1.00 28.20 +ATOM 1561 CD GLU A 286 -7.936 87.223 81.417 1.00 30.02 +ATOM 1562 OE1 GLU A 286 -7.568 88.113 82.216 1.00 31.04 +ATOM 1563 OE2 GLU A 286 -8.773 87.422 80.510 1.00 31.75 +ATOM 1564 N ILE A 287 -6.273 83.948 85.393 1.00 19.37 +ATOM 1565 CA ILE A 287 -6.306 83.488 86.768 1.00 18.48 +ATOM 1566 C ILE A 287 -6.954 84.488 87.708 1.00 19.16 +ATOM 1567 O ILE A 287 -6.761 85.701 87.576 1.00 19.81 +ATOM 1568 CB ILE A 287 -4.879 83.184 87.283 1.00 18.70 +ATOM 1569 CG1 ILE A 287 -4.299 81.996 86.522 1.00 19.38 +ATOM 1570 CG2 ILE A 287 -4.903 82.862 88.776 1.00 18.59 +ATOM 1571 CD1 ILE A 287 -4.041 82.263 85.062 1.00 21.60 +ATOM 1572 N THR A 288 -7.722 83.966 88.660 1.00 17.27 +ATOM 1573 CA THR A 288 -8.389 84.787 89.660 1.00 15.45 +ATOM 1574 C THR A 288 -8.030 84.267 91.049 1.00 16.00 +ATOM 1575 O THR A 288 -8.109 83.065 91.318 1.00 15.30 +ATOM 1576 CB THR A 288 -9.909 84.725 89.510 1.00 14.52 +ATOM 1577 OG1 THR A 288 -10.267 85.106 88.181 1.00 15.99 +ATOM 1578 CG2 THR A 288 -10.581 85.663 90.505 1.00 13.45 +ATOM 1579 N CYS A 289 -7.634 85.172 91.930 1.00 15.73 +ATOM 1580 CA CYS A 289 -7.287 84.777 93.278 1.00 15.74 +ATOM 1581 C CYS A 289 -8.054 85.592 94.312 1.00 15.92 +ATOM 1582 O CYS A 289 -8.225 86.801 94.172 1.00 15.90 +ATOM 1583 CB CYS A 289 -5.798 84.976 93.541 1.00 17.68 +ATOM 1584 SG CYS A 289 -4.593 84.367 92.321 1.00 18.32 +ATOM 1585 N VAL A 290 -8.519 84.906 95.349 1.00 15.22 +ATOM 1586 CA VAL A 290 -9.220 85.531 96.458 1.00 14.10 +ATOM 1587 C VAL A 290 -8.328 85.108 97.609 1.00 15.24 +ATOM 1588 O VAL A 290 -8.080 83.922 97.801 1.00 15.10 +ATOM 1589 CB VAL A 290 -10.644 84.976 96.619 1.00 13.95 +ATOM 1590 CG1 VAL A 290 -11.262 85.470 97.924 1.00 12.44 +ATOM 1591 CG2 VAL A 290 -11.497 85.428 95.437 1.00 12.77 +ATOM 1592 N CYS A 291 -7.832 86.087 98.359 1.00 15.70 +ATOM 1593 CA CYS A 291 -6.898 85.823 99.432 1.00 14.63 +ATOM 1594 C CYS A 291 -7.319 86.302 100.803 1.00 15.19 +ATOM 1595 O CYS A 291 -8.461 86.680 101.029 1.00 13.69 +ATOM 1596 CB CYS A 291 -5.570 86.468 99.071 1.00 15.07 +ATOM 1597 SG CYS A 291 -5.257 86.491 97.276 1.00 16.85 +ATOM 1598 N ARG A 292 -6.349 86.301 101.710 1.00 15.88 +ATOM 1599 CA ARG A 292 -6.556 86.714 103.090 1.00 15.74 +ATOM 1600 C ARG A 292 -5.842 88.020 103.447 1.00 16.56 +ATOM 1601 O ARG A 292 -4.658 88.173 103.149 1.00 16.27 +ATOM 1602 CB ARG A 292 -6.055 85.603 104.011 1.00 14.39 +ATOM 1603 CG ARG A 292 -5.768 86.016 105.436 1.00 14.25 +ATOM 1604 CD ARG A 292 -5.104 84.856 106.154 1.00 15.20 +ATOM 1605 NE ARG A 292 -4.765 85.151 107.538 1.00 15.02 +ATOM 1606 CZ ARG A 292 -4.438 84.221 108.433 1.00 17.19 +ATOM 1607 NH1 ARG A 292 -4.135 84.568 109.686 1.00 14.78 +ATOM 1608 NH2 ARG A 292 -4.428 82.939 108.080 1.00 13.64 +ATOM 1609 N ASP A 293 -6.566 88.958 104.066 1.00 16.62 +ATOM 1610 CA ASP A 293 -5.974 90.225 104.515 1.00 17.40 +ATOM 1611 C ASP A 293 -5.850 90.113 106.037 1.00 17.07 +ATOM 1612 O ASP A 293 -6.847 90.190 106.784 1.00 17.74 +ATOM 1613 CB ASP A 293 -6.842 91.432 104.134 1.00 19.84 +ATOM 1614 CG ASP A 293 -6.264 92.758 104.645 1.00 22.07 +ATOM 1615 OD1 ASP A 293 -6.524 93.814 104.017 1.00 22.11 +ATOM 1616 OD2 ASP A 293 -5.561 92.747 105.684 1.00 21.93 +ATOM 1617 N ASN A 294 -4.611 89.920 106.477 1.00 15.19 +ATOM 1618 CA ASN A 294 -4.282 89.728 107.884 1.00 15.13 +ATOM 1619 C ASN A 294 -3.913 91.048 108.551 1.00 14.99 +ATOM 1620 O ASN A 294 -3.764 91.147 109.776 1.00 13.97 +ATOM 1621 CB ASN A 294 -3.103 88.752 107.978 1.00 14.01 +ATOM 1622 CG ASN A 294 -2.946 88.157 109.354 1.00 14.61 +ATOM 1623 OD1 ASN A 294 -3.820 87.434 109.825 1.00 14.78 +ATOM 1624 ND2 ASN A 294 -1.827 88.455 110.011 1.00 13.33 +ATOM 1625 N TRP A 295 -3.775 92.062 107.715 1.00 15.09 +ATOM 1626 CA TRP A 295 -3.389 93.384 108.152 1.00 14.75 +ATOM 1627 C TRP A 295 -4.528 94.226 108.725 1.00 15.69 +ATOM 1628 O TRP A 295 -4.571 94.494 109.930 1.00 13.11 +ATOM 1629 CB TRP A 295 -2.730 94.075 106.968 1.00 14.51 +ATOM 1630 CG TRP A 295 -2.400 95.504 107.142 1.00 14.23 +ATOM 1631 CD1 TRP A 295 -2.323 96.204 108.310 1.00 14.46 +ATOM 1632 CD2 TRP A 295 -2.060 96.417 106.102 1.00 13.53 +ATOM 1633 NE1 TRP A 295 -1.957 97.503 108.061 1.00 15.12 +ATOM 1634 CE2 TRP A 295 -1.788 97.662 106.708 1.00 15.21 +ATOM 1635 CE3 TRP A 295 -1.956 96.307 104.710 1.00 12.55 +ATOM 1636 CZ2 TRP A 295 -1.419 98.795 105.969 1.00 14.06 +ATOM 1637 CZ3 TRP A 295 -1.587 97.434 103.974 1.00 13.82 +ATOM 1638 CH2 TRP A 295 -1.325 98.661 104.608 1.00 13.31 +ATOM 1639 N HIS A 296 -5.460 94.612 107.860 1.00 16.92 +ATOM 1640 CA HIS A 296 -6.567 95.461 108.269 1.00 17.76 +ATOM 1641 C HIS A 296 -7.843 95.284 107.436 1.00 18.19 +ATOM 1642 O HIS A 296 -8.479 96.265 107.060 1.00 19.49 +ATOM 1643 CB HIS A 296 -6.102 96.920 108.197 1.00 19.33 +ATOM 1644 CG HIS A 296 -5.546 97.308 106.857 1.00 19.42 +ATOM 1645 ND1 HIS A 296 -5.721 96.542 105.729 1.00 21.58 +ATOM 1646 CD2 HIS A 296 -4.896 98.428 106.458 1.00 20.17 +ATOM 1647 CE1 HIS A 296 -5.208 97.174 104.682 1.00 19.36 +ATOM 1648 NE2 HIS A 296 -4.705 98.318 105.099 1.00 20.39 +ATOM 1649 N GLY A 297 -8.223 94.040 107.159 1.00 19.59 +ATOM 1650 CA GLY A 297 -9.414 93.798 106.360 1.00 18.92 +ATOM 1651 C GLY A 297 -10.291 92.629 106.789 1.00 20.10 +ATOM 1652 O GLY A 297 -9.803 91.521 107.020 1.00 20.07 +ATOM 1653 N SER A 298 -11.593 92.895 106.895 1.00 20.85 +ATOM 1654 CA SER A 298 -12.596 91.897 107.270 1.00 21.33 +ATOM 1655 C SER A 298 -13.129 91.202 106.020 1.00 21.13 +ATOM 1656 O SER A 298 -13.686 90.110 106.093 1.00 22.10 +ATOM 1657 CB SER A 298 -13.783 92.553 107.978 1.00 19.96 +ATOM 1658 OG SER A 298 -13.526 92.718 109.345 1.00 22.31 +ATOM 1659 N ASN A 299 -12.998 91.872 104.884 1.00 18.78 +ATOM 1660 CA ASN A 299 -13.450 91.325 103.616 1.00 18.07 +ATOM 1661 C ASN A 299 -12.224 90.775 102.880 1.00 17.38 +ATOM 1662 O ASN A 299 -11.090 91.035 103.281 1.00 17.23 +ATOM 1663 CB ASN A 299 -14.145 92.421 102.800 1.00 19.01 +ATOM 1664 CG ASN A 299 -13.326 93.700 102.716 1.00 19.50 +ATOM 1665 OD1 ASN A 299 -12.586 94.045 103.650 1.00 20.20 +ATOM 1666 ND2 ASN A 299 -13.471 94.423 101.608 1.00 17.42 +ATOM 1667 N ARG A 300 -12.439 90.025 101.806 1.00 15.65 +ATOM 1668 CA ARG A 300 -11.304 89.448 101.101 1.00 15.45 +ATOM 1669 C ARG A 300 -10.807 90.206 99.878 1.00 14.91 +ATOM 1670 O ARG A 300 -11.595 90.692 99.070 1.00 15.66 +ATOM 1671 CB ARG A 300 -11.605 87.988 100.726 1.00 13.13 +ATOM 1672 CG ARG A 300 -11.760 87.090 101.948 1.00 10.90 +ATOM 1673 CD ARG A 300 -11.649 85.611 101.610 1.00 12.43 +ATOM 1674 NE ARG A 300 -11.766 84.781 102.813 1.00 14.24 +ATOM 1675 CZ ARG A 300 -10.793 84.582 103.702 1.00 13.14 +ATOM 1676 NH1 ARG A 300 -11.014 83.818 104.766 1.00 12.19 +ATOM 1677 NH2 ARG A 300 -9.593 85.122 103.521 1.00 11.87 +ATOM 1678 N PRO A 301 -9.476 90.349 99.755 1.00 14.35 +ATOM 1679 CA PRO A 301 -8.868 91.045 98.617 1.00 15.33 +ATOM 1680 C PRO A 301 -8.702 90.066 97.450 1.00 15.66 +ATOM 1681 O PRO A 301 -8.688 88.851 97.656 1.00 15.46 +ATOM 1682 CB PRO A 301 -7.530 91.510 99.180 1.00 14.51 +ATOM 1683 CG PRO A 301 -7.174 90.386 100.114 1.00 14.76 +ATOM 1684 CD PRO A 301 -8.486 90.141 100.828 1.00 13.14 +ATOM 1685 N TRP A 302 -8.578 90.591 96.232 1.00 16.43 +ATOM 1686 CA TRP A 302 -8.415 89.739 95.053 1.00 16.39 +ATOM 1687 C TRP A 302 -7.460 90.270 93.985 1.00 16.05 +ATOM 1688 O TRP A 302 -7.142 91.459 93.938 1.00 16.92 +ATOM 1689 CB TRP A 302 -9.776 89.467 94.399 1.00 15.24 +ATOM 1690 CG TRP A 302 -10.526 90.701 93.936 1.00 15.15 +ATOM 1691 CD1 TRP A 302 -11.523 91.348 94.604 1.00 15.17 +ATOM 1692 CD2 TRP A 302 -10.393 91.376 92.675 1.00 14.38 +ATOM 1693 NE1 TRP A 302 -12.027 92.371 93.839 1.00 14.59 +ATOM 1694 CE2 TRP A 302 -11.353 92.412 92.649 1.00 13.94 +ATOM 1695 CE3 TRP A 302 -9.560 91.202 91.562 1.00 14.20 +ATOM 1696 CZ2 TRP A 302 -11.510 93.269 91.557 1.00 13.69 +ATOM 1697 CZ3 TRP A 302 -9.715 92.056 90.472 1.00 14.67 +ATOM 1698 CH2 TRP A 302 -10.687 93.076 90.482 1.00 14.11 +ATOM 1699 N VAL A 303 -7.008 89.367 93.125 1.00 15.50 +ATOM 1700 CA VAL A 303 -6.113 89.721 92.031 1.00 17.00 +ATOM 1701 C VAL A 303 -6.419 88.774 90.899 1.00 17.39 +ATOM 1702 O VAL A 303 -6.537 87.570 91.106 1.00 16.83 +ATOM 1703 CB VAL A 303 -4.615 89.500 92.346 1.00 17.21 +ATOM 1704 CG1 VAL A 303 -3.760 90.223 91.306 1.00 16.85 +ATOM 1705 CG2 VAL A 303 -4.288 89.959 93.711 1.00 18.65 +ATOM 1706 N SER A 304 -6.557 89.319 89.703 1.00 17.52 +ATOM 1707 CA SER A 304 -6.810 88.490 88.547 1.00 19.38 +ATOM 1708 C SER A 304 -5.774 88.965 87.555 1.00 19.75 +ATOM 1709 O SER A 304 -5.351 90.124 87.607 1.00 19.43 +ATOM 1710 CB SER A 304 -8.228 88.701 88.022 1.00 18.24 +ATOM 1711 OG SER A 304 -8.466 90.068 87.767 1.00 24.22 +ATOM 1712 N PHE A 305 -5.332 88.070 86.683 1.00 19.58 +ATOM 1713 CA PHE A 305 -4.327 88.442 85.709 1.00 21.72 +ATOM 1714 C PHE A 305 -4.279 87.521 84.503 1.00 23.12 +ATOM 1715 O PHE A 305 -4.718 86.375 84.566 1.00 24.34 +ATOM 1716 CB PHE A 305 -2.958 88.511 86.389 1.00 19.16 +ATOM 1717 CG PHE A 305 -2.617 87.296 87.200 1.00 17.70 +ATOM 1718 CD1 PHE A 305 -1.955 86.222 86.630 1.00 17.21 +ATOM 1719 CD2 PHE A 305 -2.941 87.239 88.549 1.00 18.41 +ATOM 1720 CE1 PHE A 305 -1.618 85.110 87.395 1.00 17.82 +ATOM 1721 CE2 PHE A 305 -2.608 86.132 89.320 1.00 17.71 +ATOM 1722 CZ PHE A 305 -1.944 85.069 88.742 1.00 16.47 +ATOM 1723 N ASN A 306 -3.751 88.056 83.407 1.00 24.71 +ATOM 1724 CA ASN A 306 -3.607 87.352 82.138 1.00 27.34 +ATOM 1725 C ASN A 306 -2.321 86.508 82.130 1.00 26.13 +ATOM 1726 O ASN A 306 -1.581 86.473 83.112 1.00 25.41 +ATOM 1727 CB ASN A 306 -3.582 88.396 81.008 1.00 32.70 +ATOM 1728 CG ASN A 306 -3.269 87.795 79.650 1.00 39.43 +ATOM 1729 OD1 ASN A 306 -3.695 86.666 79.324 1.00 43.18 +ATOM 1730 ND2 ASN A 306 -2.528 88.548 78.833 1.00 42.48 +ATOM 1731 N GLN A 308 -2.049 85.835 81.021 1.00 25.29 +ATOM 1732 CA GLN A 308 -0.859 85.010 80.925 1.00 25.40 +ATOM 1733 C GLN A 308 0.433 85.781 80.743 1.00 25.71 +ATOM 1734 O GLN A 308 1.484 85.179 80.539 1.00 27.13 +ATOM 1735 CB GLN A 308 -1.025 83.981 79.817 1.00 25.12 +ATOM 1736 CG GLN A 308 -1.873 82.817 80.276 1.00 25.67 +ATOM 1737 CD GLN A 308 -2.533 82.093 79.133 1.00 27.06 +ATOM 1738 OE1 GLN A 308 -1.863 81.514 78.274 1.00 26.71 +ATOM 1739 NE2 GLN A 308 -3.864 82.125 79.108 1.00 27.62 +ATOM 1740 N ASN A 309 0.348 87.108 80.809 1.00 25.55 +ATOM 1741 CA ASN A 309 1.521 87.966 80.723 1.00 25.28 +ATOM 1742 C ASN A 309 1.563 88.805 81.992 1.00 24.35 +ATOM 1743 O ASN A 309 2.109 89.907 82.011 1.00 24.01 +ATOM 1744 CB ASN A 309 1.464 88.879 79.503 1.00 29.15 +ATOM 1745 CG ASN A 309 1.753 88.144 78.227 1.00 32.68 +ATOM 1746 OD1 ASN A 309 2.818 87.519 78.081 1.00 35.07 +ATOM 1747 ND2 ASN A 309 0.810 88.199 77.285 1.00 33.77 +ATOM 1748 N LEU A 310 0.951 88.278 83.047 1.00 23.08 +ATOM 1749 CA LEU A 310 0.929 88.940 84.342 1.00 21.65 +ATOM 1750 C LEU A 310 0.387 90.370 84.343 1.00 21.38 +ATOM 1751 O LEU A 310 0.746 91.178 85.196 1.00 20.58 +ATOM 1752 CB LEU A 310 2.334 88.900 84.948 1.00 21.49 +ATOM 1753 CG LEU A 310 2.742 87.616 85.684 1.00 21.20 +ATOM 1754 CD1 LEU A 310 1.992 86.410 85.160 1.00 20.86 +ATOM 1755 CD2 LEU A 310 4.240 87.424 85.550 1.00 21.56 +ATOM 1756 N GLU A 311 -0.453 90.693 83.368 1.00 21.18 +ATOM 1757 CA GLU A 311 -1.081 92.001 83.340 1.00 20.87 +ATOM 1758 C GLU A 311 -2.211 91.719 84.323 1.00 20.55 +ATOM 1759 O GLU A 311 -2.943 90.736 84.161 1.00 19.65 +ATOM 1760 CB GLU A 311 -1.605 92.305 81.940 1.00 22.96 +ATOM 1761 CG GLU A 311 -0.491 92.357 80.915 1.00 27.26 +ATOM 1762 CD GLU A 311 -0.986 92.291 79.477 1.00 30.89 +ATOM 1763 OE1 GLU A 311 -1.760 91.363 79.144 1.00 34.30 +ATOM 1764 OE2 GLU A 311 -0.592 93.157 78.668 1.00 32.81 +ATOM 1765 N TYR A 312 -2.352 92.567 85.338 1.00 19.26 +ATOM 1766 CA TYR A 312 -3.338 92.330 86.383 1.00 18.85 +ATOM 1767 C TYR A 312 -4.286 93.458 86.796 1.00 19.80 +ATOM 1768 O TYR A 312 -4.181 94.601 86.358 1.00 20.05 +ATOM 1769 CB TYR A 312 -2.587 91.869 87.625 1.00 17.70 +ATOM 1770 CG TYR A 312 -1.670 92.951 88.166 1.00 16.10 +ATOM 1771 CD1 TYR A 312 -2.170 93.978 88.971 1.00 15.75 +ATOM 1772 CD2 TYR A 312 -0.325 92.992 87.812 1.00 15.39 +ATOM 1773 CE1 TYR A 312 -1.354 95.020 89.406 1.00 15.64 +ATOM 1774 CE2 TYR A 312 0.502 94.033 88.242 1.00 15.42 +ATOM 1775 CZ TYR A 312 -0.023 95.043 89.039 1.00 15.48 +ATOM 1776 OH TYR A 312 0.776 96.069 89.468 1.00 15.28 +ATOM 1777 N GLN A 313 -5.196 93.092 87.693 1.00 21.32 +ATOM 1778 CA GLN A 313 -6.195 93.987 88.268 1.00 22.33 +ATOM 1779 C GLN A 313 -6.398 93.518 89.701 1.00 20.79 +ATOM 1780 O GLN A 313 -6.397 92.317 89.974 1.00 20.50 +ATOM 1781 CB GLN A 313 -7.526 93.869 87.533 1.00 24.53 +ATOM 1782 CG GLN A 313 -7.513 94.345 86.102 1.00 28.85 +ATOM 1783 CD GLN A 313 -8.892 94.240 85.454 1.00 32.32 +ATOM 1784 OE1 GLN A 313 -9.095 94.683 84.321 1.00 35.54 +ATOM 1785 NE2 GLN A 313 -9.846 93.650 86.171 1.00 33.23 +ATOM 1786 N ILE A 314 -6.588 94.456 90.612 1.00 20.41 +ATOM 1787 CA ILE A 314 -6.789 94.105 92.011 1.00 20.02 +ATOM 1788 C ILE A 314 -8.100 94.679 92.533 1.00 20.42 +ATOM 1789 O ILE A 314 -8.746 95.477 91.866 1.00 21.39 +ATOM 1790 CB ILE A 314 -5.638 94.646 92.862 1.00 18.62 +ATOM 1791 CG1 ILE A 314 -5.457 96.140 92.573 1.00 18.32 +ATOM 1792 CG2 ILE A 314 -4.363 93.871 92.566 1.00 19.58 +ATOM 1793 CD1 ILE A 314 -4.252 96.785 93.248 1.00 16.62 +ATOM 1794 N GLY A 315 -8.485 94.264 93.733 1.00 20.83 +ATOM 1795 CA GLY A 315 -9.700 94.768 94.336 1.00 19.25 +ATOM 1796 C GLY A 315 -10.021 94.028 95.617 1.00 19.79 +ATOM 1797 O GLY A 315 -9.214 93.235 96.107 1.00 17.16 +ATOM 1798 N TYR A 316 -11.203 94.313 96.160 1.00 19.70 +ATOM 1799 CA TYR A 316 -11.698 93.669 97.368 1.00 20.21 +ATOM 1800 C TYR A 316 -13.152 93.275 97.071 1.00 20.84 +ATOM 1801 O TYR A 316 -13.847 93.961 96.313 1.00 22.32 +ATOM 1802 CB TYR A 316 -11.648 94.632 98.572 1.00 20.12 +ATOM 1803 CG TYR A 316 -10.339 94.656 99.356 1.00 20.35 +ATOM 1804 CD1 TYR A 316 -9.189 95.260 98.836 1.00 20.06 +ATOM 1805 CD2 TYR A 316 -10.254 94.076 100.627 1.00 19.46 +ATOM 1806 CE1 TYR A 316 -7.977 95.284 99.573 1.00 20.35 +ATOM 1807 CE2 TYR A 316 -9.056 94.091 101.368 1.00 19.43 +ATOM 1808 CZ TYR A 316 -7.921 94.693 100.839 1.00 19.85 +ATOM 1809 OH TYR A 316 -6.745 94.689 101.567 1.00 16.51 +ATOM 1810 N ILE A 317 -13.606 92.161 97.635 1.00 19.07 +ATOM 1811 CA ILE A 317 -14.982 91.728 97.431 1.00 17.54 +ATOM 1812 C ILE A 317 -15.822 92.749 98.183 1.00 17.68 +ATOM 1813 O ILE A 317 -15.615 92.973 99.382 1.00 18.06 +ATOM 1814 CB ILE A 317 -15.200 90.316 97.993 1.00 16.55 +ATOM 1815 CG1 ILE A 317 -14.337 89.320 97.202 1.00 16.27 +ATOM 1816 CG2 ILE A 317 -16.672 89.961 97.926 1.00 17.05 +ATOM 1817 CD1 ILE A 317 -14.373 87.897 97.716 1.00 14.15 +ATOM 1818 N CYS A 318 -16.769 93.360 97.481 1.00 17.55 +ATOM 1819 CA CYS A 318 -17.585 94.420 98.057 1.00 17.96 +ATOM 1820 C CYS A 318 -18.764 94.046 98.957 1.00 18.60 +ATOM 1821 O CYS A 318 -19.248 94.884 99.721 1.00 19.89 +ATOM 1822 CB CYS A 318 -18.092 95.327 96.937 1.00 19.47 +ATOM 1823 SG CYS A 318 -16.936 95.803 95.605 1.00 20.75 +ATOM 1824 N SER A 319 -19.219 92.800 98.873 1.00 18.21 +ATOM 1825 CA SER A 319 -20.355 92.305 99.649 1.00 17.20 +ATOM 1826 C SER A 319 -20.331 92.575 101.159 1.00 17.35 +ATOM 1827 O SER A 319 -19.296 92.470 101.811 1.00 16.66 +ATOM 1828 CB SER A 319 -20.498 90.794 99.414 1.00 17.64 +ATOM 1829 OG SER A 319 -21.642 90.254 100.053 1.00 16.88 +ATOM 1830 N GLY A 320 -21.493 92.921 101.705 1.00 18.21 +ATOM 1831 CA GLY A 320 -21.608 93.154 103.133 1.00 18.50 +ATOM 1832 C GLY A 320 -21.669 91.816 103.864 1.00 19.31 +ATOM 1833 O GLY A 320 -22.024 91.743 105.043 1.00 18.51 +ATOM 1834 N VAL A 321 -21.356 90.744 103.141 1.00 19.60 +ATOM 1835 CA VAL A 321 -21.334 89.399 103.711 1.00 19.60 +ATOM 1836 C VAL A 321 -19.856 89.131 103.834 1.00 19.42 +ATOM 1837 O VAL A 321 -19.255 88.465 102.998 1.00 19.91 +ATOM 1838 CB VAL A 321 -21.986 88.365 102.768 1.00 19.75 +ATOM 1839 CG1 VAL A 321 -21.932 86.966 103.389 1.00 18.97 +ATOM 1840 CG2 VAL A 321 -23.429 88.766 102.500 1.00 19.10 +ATOM 1841 N PHE A 322 -19.274 89.700 104.879 1.00 19.37 +ATOM 1842 CA PHE A 322 -17.846 89.598 105.126 1.00 19.61 +ATOM 1843 C PHE A 322 -17.342 88.160 105.165 1.00 19.69 +ATOM 1844 O PHE A 322 -17.880 87.321 105.903 1.00 20.23 +ATOM 1845 CB PHE A 322 -17.527 90.345 106.415 1.00 20.52 +ATOM 1846 CG PHE A 322 -18.082 91.744 106.444 1.00 20.88 +ATOM 1847 CD1 PHE A 322 -18.971 92.136 107.449 1.00 21.01 +ATOM 1848 CD2 PHE A 322 -17.722 92.670 105.467 1.00 20.09 +ATOM 1849 CE1 PHE A 322 -19.492 93.436 107.482 1.00 19.61 +ATOM 1850 CE2 PHE A 322 -18.235 93.970 105.486 1.00 19.22 +ATOM 1851 CZ PHE A 322 -19.121 94.353 106.497 1.00 20.99 +ATOM 1852 N GLY A 323 -16.296 87.891 104.383 1.00 18.32 +ATOM 1853 CA GLY A 323 -15.756 86.546 104.296 1.00 18.97 +ATOM 1854 C GLY A 323 -14.558 86.126 105.136 1.00 19.98 +ATOM 1855 O GLY A 323 -14.267 84.940 105.198 1.00 20.66 +ATOM 1856 N ASP A 324 -13.855 87.065 105.767 1.00 18.62 +ATOM 1857 CA ASP A 324 -12.688 86.736 106.595 1.00 17.59 +ATOM 1858 C ASP A 324 -13.148 86.376 108.011 1.00 18.02 +ATOM 1859 O ASP A 324 -14.298 86.609 108.373 1.00 17.87 +ATOM 1860 CB ASP A 324 -11.734 87.952 106.661 1.00 17.36 +ATOM 1861 CG ASP A 324 -10.338 87.596 107.186 1.00 16.53 +ATOM 1862 OD1 ASP A 324 -9.541 88.528 107.482 1.00 17.05 +ATOM 1863 OD2 ASP A 324 -10.036 86.386 107.294 1.00 17.08 +ATOM 1864 N ASN A 325 -12.256 85.784 108.802 1.00 17.90 +ATOM 1865 CA ASN A 325 -12.560 85.450 110.206 1.00 17.88 +ATOM 1866 C ASN A 325 -11.283 85.759 110.999 1.00 18.23 +ATOM 1867 O ASN A 325 -10.237 85.163 110.759 1.00 18.17 +ATOM 1868 CB ASN A 325 -12.985 83.991 110.355 1.00 17.46 +ATOM 1869 CG ASN A 325 -13.128 83.567 111.824 1.00 17.80 +ATOM 1870 OD1 ASN A 325 -12.177 83.105 112.441 1.00 18.59 +ATOM 1871 ND2 ASN A 325 -14.319 83.738 112.381 1.00 16.87 +ATOM 1872 N PRO A 326 -11.381 86.599 112.040 1.00 19.35 +ATOM 1873 CA PRO A 326 -12.549 87.360 112.500 1.00 17.69 +ATOM 1874 C PRO A 326 -13.136 88.329 111.516 1.00 17.38 +ATOM 1875 O PRO A 326 -12.541 88.613 110.480 1.00 16.75 +ATOM 1876 CB PRO A 326 -12.028 88.050 113.753 1.00 17.86 +ATOM 1877 CG PRO A 326 -10.655 88.416 113.352 1.00 18.60 +ATOM 1878 CD PRO A 326 -10.148 87.144 112.658 1.00 18.78 +ATOM 1879 N ARG A 327 -14.305 88.847 111.869 1.00 16.81 +ATOM 1880 CA ARG A 327 -15.038 89.788 111.045 1.00 17.44 +ATOM 1881 C ARG A 327 -16.190 90.311 111.904 1.00 19.31 +ATOM 1882 O ARG A 327 -16.557 89.686 112.899 1.00 21.27 +ATOM 1883 CB ARG A 327 -15.630 89.070 109.828 1.00 15.81 +ATOM 1884 CG ARG A 327 -16.691 88.025 110.195 1.00 12.82 +ATOM 1885 CD ARG A 327 -17.501 87.611 108.971 1.00 12.38 +ATOM 1886 NE ARG A 327 -18.529 86.614 109.271 1.00 10.72 +ATOM 1887 CZ ARG A 327 -18.314 85.303 109.368 1.00 10.11 +ATOM 1888 NH1 ARG A 327 -19.323 84.492 109.644 1.00 12.25 +ATOM 1889 NH2 ARG A 327 -17.106 84.793 109.179 1.00 8.06 +ATOM 1890 N PRO A 328 -16.774 91.460 111.530 1.00 18.97 +ATOM 1891 CA PRO A 328 -17.891 92.032 112.285 1.00 18.79 +ATOM 1892 C PRO A 328 -19.175 91.409 111.754 1.00 19.38 +ATOM 1893 O PRO A 328 -19.152 90.722 110.732 1.00 20.57 +ATOM 1894 CB PRO A 328 -17.809 93.509 111.933 1.00 18.09 +ATOM 1895 CG PRO A 328 -17.420 93.450 110.486 1.00 17.41 +ATOM 1896 CD PRO A 328 -16.319 92.397 110.484 1.00 18.00 +ATOM 1897 N ASN A 329 -20.290 91.636 112.440 1.00 20.00 +ATOM 1898 CA ASN A 329 -21.571 91.116 111.965 1.00 20.64 +ATOM 1899 C ASN A 329 -21.822 91.723 110.585 1.00 20.73 +ATOM 1900 O ASN A 329 -21.322 92.803 110.286 1.00 20.42 +ATOM 1901 CB ASN A 329 -22.710 91.528 112.903 1.00 19.97 +ATOM 1902 CG ASN A 329 -22.623 90.860 114.243 1.00 20.87 +ATOM 1903 OD1 ASN A 329 -22.572 89.639 114.328 1.00 23.63 +ATOM 1904 ND2 ASN A 329 -22.607 91.653 115.305 1.00 21.79 +ATOM 1905 N ASP A 330 -22.604 91.031 109.762 1.00 21.64 +ATOM 1906 CA ASP A 330 -22.921 91.495 108.415 1.00 22.76 +ATOM 1907 C ASP A 330 -23.576 92.872 108.358 1.00 24.07 +ATOM 1908 O ASP A 330 -24.437 93.210 109.181 1.00 24.56 +ATOM 1909 CB ASP A 330 -23.824 90.487 107.705 1.00 23.14 +ATOM 1910 CG ASP A 330 -23.110 89.183 107.395 1.00 24.88 +ATOM 1911 OD1 ASP A 330 -21.887 89.223 107.126 1.00 24.81 +ATOM 1912 OD2 ASP A 330 -23.773 88.121 107.406 1.00 24.33 +ATOM 1913 N GLY A 331 -23.166 93.664 107.373 1.00 23.60 +ATOM 1914 CA GLY A 331 -23.727 94.992 107.231 1.00 23.77 +ATOM 1915 C GLY A 331 -23.452 95.601 105.871 1.00 23.25 +ATOM 1916 O GLY A 331 -23.762 95.012 104.827 1.00 23.19 +ATOM 1917 N THR A 332 -22.869 96.792 105.890 1.00 22.68 +ATOM 1918 CA THR A 332 -22.541 97.493 104.665 1.00 23.15 +ATOM 1919 C THR A 332 -21.078 97.210 104.358 1.00 22.70 +ATOM 1920 O THR A 332 -20.194 97.527 105.155 1.00 21.60 +ATOM 1921 CB THR A 332 -22.750 99.005 104.829 1.00 24.25 +ATOM 1922 OG1 THR A 332 -24.032 99.253 105.427 1.00 25.74 +ATOM 1923 CG2 THR A 332 -22.688 99.697 103.469 1.00 23.98 +ATOM 1924 N GLY A 333 -20.840 96.600 103.203 1.00 21.87 +ATOM 1925 CA GLY A 333 -19.499 96.246 102.820 1.00 22.05 +ATOM 1926 C GLY A 333 -18.740 97.398 102.224 1.00 22.53 +ATOM 1927 O GLY A 333 -19.127 98.551 102.343 1.00 22.76 +ATOM 1928 N SER A 335 -17.632 97.084 101.577 1.00 23.16 +ATOM 1929 CA SER A 335 -16.817 98.110 100.962 1.00 23.73 +ATOM 1930 C SER A 335 -15.968 97.473 99.887 1.00 24.68 +ATOM 1931 O SER A 335 -15.516 96.348 100.021 1.00 24.15 +ATOM 1932 CB SER A 335 -15.903 98.747 101.989 1.00 24.08 +ATOM 1933 OG SER A 335 -14.912 99.531 101.344 1.00 24.52 +ATOM 1934 N CYS A 336 -15.739 98.194 98.806 1.00 25.58 +ATOM 1935 CA CYS A 336 -14.931 97.624 97.750 1.00 26.83 +ATOM 1936 C CYS A 336 -13.448 97.779 98.140 1.00 25.76 +ATOM 1937 O CYS A 336 -12.533 97.430 97.370 1.00 25.96 +ATOM 1938 CB CYS A 336 -15.238 98.297 96.419 1.00 26.49 +ATOM 1939 SG CYS A 336 -16.821 97.838 95.644 1.00 30.14 +ATOM 1940 N GLY A 339 -13.205 98.256 99.361 1.00 24.87 +ATOM 1941 CA GLY A 339 -11.832 98.409 99.810 1.00 23.44 +ATOM 1942 C GLY A 339 -11.706 97.699 101.132 1.00 22.92 +ATOM 1943 O GLY A 339 -12.665 97.072 101.595 1.00 22.02 +ATOM 1944 N PRO A 340 -10.541 97.778 101.768 1.00 21.86 +ATOM 1945 CA PRO A 340 -10.353 97.111 103.056 1.00 21.25 +ATOM 1946 C PRO A 340 -11.332 97.549 104.146 1.00 21.01 +ATOM 1947 O PRO A 340 -11.393 98.735 104.461 1.00 20.98 +ATOM 1948 CB PRO A 340 -8.926 97.507 103.452 1.00 23.51 +ATOM 1949 CG PRO A 340 -8.252 97.842 102.146 1.00 23.94 +ATOM 1950 CD PRO A 340 -9.343 98.541 101.376 1.00 22.57 +ATOM 1951 N VAL A 341 -12.072 96.601 104.725 1.00 20.32 +ATOM 1952 CA VAL A 341 -13.000 96.891 105.817 1.00 20.07 +ATOM 1953 C VAL A 341 -12.180 96.688 107.108 1.00 20.95 +ATOM 1954 O VAL A 341 -11.934 95.563 107.543 1.00 20.69 +ATOM 1955 CB VAL A 341 -14.208 95.918 105.802 1.00 19.87 +ATOM 1956 CG1 VAL A 341 -15.096 96.201 106.987 1.00 17.95 +ATOM 1957 CG2 VAL A 341 -15.008 96.040 104.503 1.00 18.12 +ATOM 1958 N SER A 342 -11.724 97.791 107.683 1.00 21.46 +ATOM 1959 CA SER A 342 -10.889 97.771 108.879 1.00 23.76 +ATOM 1960 C SER A 342 -11.461 97.173 110.180 1.00 24.99 +ATOM 1961 O SER A 342 -10.680 96.775 111.053 1.00 25.80 +ATOM 1962 CB SER A 342 -10.441 99.186 109.190 1.00 23.66 +ATOM 1963 OG SER A 342 -11.453 99.857 109.914 1.00 24.17 +ATOM 1964 N SER A 344 -12.785 97.144 110.344 1.00 25.31 +ATOM 1965 CA SER A 344 -13.343 96.630 111.580 1.00 26.76 +ATOM 1966 C SER A 344 -13.127 95.165 111.768 1.00 25.62 +ATOM 1967 O SER A 344 -13.709 94.363 111.056 1.00 22.72 +ATOM 1968 CB SER A 344 -14.843 96.958 111.707 1.00 28.25 +ATOM 1969 OG SER A 344 -15.642 96.112 110.895 1.00 34.42 +ATOM 1970 N ASN A 345 -12.272 94.827 112.725 1.00 24.63 +ATOM 1971 CA ASN A 345 -12.010 93.440 113.031 1.00 26.30 +ATOM 1972 C ASN A 345 -11.193 92.610 112.076 1.00 26.07 +ATOM 1973 O ASN A 345 -11.021 91.447 112.356 1.00 26.92 +ATOM 1974 CB ASN A 345 -13.327 92.712 113.280 1.00 27.37 +ATOM 1975 CG ASN A 345 -13.370 92.101 114.639 1.00 29.29 +ATOM 1976 OD1 ASN A 345 -12.356 91.595 115.124 1.00 32.43 +ATOM 1977 ND2 ASN A 345 -14.521 92.155 115.282 1.00 27.75 +ATOM 1978 N GLY A 345A -10.656 93.168 110.996 1.00 26.48 +ATOM 1979 CA GLY A 345A -9.904 92.326 110.091 1.00 27.64 +ATOM 1980 C GLY A 345A -8.426 92.280 110.352 1.00 26.92 +ATOM 1981 O GLY A 345A -7.693 91.841 109.483 1.00 27.05 +ATOM 1982 N ALA A 346 -7.993 92.716 111.533 1.00 27.31 +ATOM 1983 CA ALA A 346 -6.567 92.725 111.879 1.00 26.98 +ATOM 1984 C ALA A 346 -5.889 91.351 111.907 1.00 27.96 +ATOM 1985 O ALA A 346 -4.690 91.255 112.161 1.00 31.45 +ATOM 1986 CB ALA A 346 -6.349 93.415 113.209 1.00 27.80 +ATOM 1987 N TYR A 347 -6.648 90.289 111.666 1.00 25.91 +ATOM 1988 CA TYR A 347 -6.098 88.931 111.628 1.00 22.57 +ATOM 1989 C TYR A 347 -6.851 88.261 110.479 1.00 21.14 +ATOM 1990 O TYR A 347 -7.089 88.897 109.446 1.00 23.08 +ATOM 1991 CB TYR A 347 -6.344 88.232 112.979 1.00 23.55 +ATOM 1992 CG TYR A 347 -5.843 86.797 113.137 1.00 24.55 +ATOM 1993 CD1 TYR A 347 -4.536 86.422 112.781 1.00 24.67 +ATOM 1994 CD2 TYR A 347 -6.668 85.823 113.703 1.00 23.67 +ATOM 1995 CE1 TYR A 347 -4.078 85.103 112.995 1.00 22.45 +ATOM 1996 CE2 TYR A 347 -6.219 84.520 113.918 1.00 22.09 +ATOM 1997 CZ TYR A 347 -4.936 84.167 113.564 1.00 22.91 +ATOM 1998 OH TYR A 347 -4.544 82.866 113.762 1.00 23.36 +ATOM 1999 N GLY A 348 -7.248 87.008 110.641 1.00 18.66 +ATOM 2000 CA GLY A 348 -7.969 86.351 109.570 1.00 16.24 +ATOM 2001 C GLY A 348 -7.743 84.856 109.490 1.00 16.40 +ATOM 2002 O GLY A 348 -7.236 84.213 110.418 1.00 15.85 +ATOM 2003 N VAL A 349 -8.129 84.304 108.354 1.00 15.70 +ATOM 2004 CA VAL A 349 -7.990 82.894 108.107 1.00 15.37 +ATOM 2005 C VAL A 349 -7.968 82.736 106.593 1.00 14.98 +ATOM 2006 O VAL A 349 -8.472 83.587 105.874 1.00 15.16 +ATOM 2007 CB VAL A 349 -9.180 82.133 108.727 1.00 15.48 +ATOM 2008 CG1 VAL A 349 -10.460 82.428 107.973 1.00 13.16 +ATOM 2009 CG2 VAL A 349 -8.886 80.660 108.744 1.00 16.69 +ATOM 2010 N LYS A 350 -7.372 81.660 106.102 1.00 14.87 +ATOM 2011 CA LYS A 350 -7.323 81.457 104.667 1.00 14.99 +ATOM 2012 C LYS A 350 -8.708 81.065 104.170 1.00 15.62 +ATOM 2013 O LYS A 350 -9.403 80.265 104.805 1.00 15.88 +ATOM 2014 CB LYS A 350 -6.310 80.377 104.313 1.00 15.03 +ATOM 2015 CG LYS A 350 -6.288 80.008 102.846 1.00 13.81 +ATOM 2016 CD LYS A 350 -5.276 78.915 102.593 1.00 13.09 +ATOM 2017 CE LYS A 350 -5.420 78.312 101.194 1.00 13.49 +ATOM 2018 NZ LYS A 350 -5.164 79.285 100.097 1.00 10.76 +ATOM 2019 N GLY A 351 -9.104 81.655 103.045 1.00 14.40 +ATOM 2020 CA GLY A 351 -10.404 81.377 102.469 1.00 14.36 +ATOM 2021 C GLY A 351 -10.390 81.474 100.955 1.00 15.18 +ATOM 2022 O GLY A 351 -9.333 81.552 100.337 1.00 14.26 +ATOM 2023 N PHE A 352 -11.571 81.490 100.353 1.00 15.37 +ATOM 2024 CA PHE A 352 -11.672 81.549 98.904 1.00 14.45 +ATOM 2025 C PHE A 352 -13.049 82.045 98.481 1.00 14.92 +ATOM 2026 O PHE A 352 -13.913 82.290 99.322 1.00 14.65 +ATOM 2027 CB PHE A 352 -11.484 80.156 98.322 1.00 13.16 +ATOM 2028 CG PHE A 352 -12.622 79.246 98.622 1.00 13.14 +ATOM 2029 CD1 PHE A 352 -12.709 78.609 99.854 1.00 12.11 +ATOM 2030 CD2 PHE A 352 -13.668 79.106 97.714 1.00 13.32 +ATOM 2031 CE1 PHE A 352 -13.822 77.853 100.185 1.00 12.19 +ATOM 2032 CE2 PHE A 352 -14.789 78.348 98.039 1.00 13.05 +ATOM 2033 CZ PHE A 352 -14.865 77.722 99.279 1.00 12.22 +ATOM 2034 N SER A 353 -13.239 82.160 97.167 1.00 15.55 +ATOM 2035 CA SER A 353 -14.500 82.584 96.574 1.00 16.04 +ATOM 2036 C SER A 353 -14.481 82.390 95.073 1.00 16.73 +ATOM 2037 O SER A 353 -13.426 82.464 94.449 1.00 16.21 +ATOM 2038 CB SER A 353 -14.789 84.052 96.878 1.00 16.73 +ATOM 2039 OG SER A 353 -15.147 84.223 98.235 1.00 19.17 +ATOM 2040 N PHE A 354 -15.657 82.135 94.503 1.00 16.68 +ATOM 2041 CA PHE A 354 -15.799 81.951 93.065 1.00 16.50 +ATOM 2042 C PHE A 354 -16.686 83.039 92.499 1.00 18.00 +ATOM 2043 O PHE A 354 -17.836 83.222 92.924 1.00 19.37 +ATOM 2044 CB PHE A 354 -16.399 80.589 92.742 1.00 16.15 +ATOM 2045 CG PHE A 354 -15.484 79.451 93.048 1.00 15.31 +ATOM 2046 CD1 PHE A 354 -15.750 78.593 94.108 1.00 14.31 +ATOM 2047 CD2 PHE A 354 -14.344 79.245 92.288 1.00 14.79 +ATOM 2048 CE1 PHE A 354 -14.893 77.549 94.404 1.00 14.20 +ATOM 2049 CE2 PHE A 354 -13.475 78.197 92.581 1.00 15.71 +ATOM 2050 CZ PHE A 354 -13.753 77.347 93.642 1.00 14.99 +ATOM 2051 N LYS A 355 -16.141 83.765 91.532 1.00 18.07 +ATOM 2052 CA LYS A 355 -16.856 84.859 90.901 1.00 17.35 +ATOM 2053 C LYS A 355 -17.516 84.415 89.610 1.00 17.36 +ATOM 2054 O LYS A 355 -16.887 83.776 88.768 1.00 17.69 +ATOM 2055 CB LYS A 355 -15.885 86.018 90.631 1.00 16.42 +ATOM 2056 CG LYS A 355 -16.346 87.037 89.595 1.00 15.11 +ATOM 2057 CD LYS A 355 -15.317 88.149 89.452 1.00 14.22 +ATOM 2058 CE LYS A 355 -15.320 88.755 88.049 1.00 16.29 +ATOM 2059 NZ LYS A 355 -16.575 89.460 87.673 1.00 13.77 +ATOM 2060 N TYR A 356 -18.799 84.740 89.484 1.00 17.79 +ATOM 2061 CA TYR A 356 -19.584 84.447 88.287 1.00 17.63 +ATOM 2062 C TYR A 356 -20.235 85.777 87.922 1.00 18.41 +ATOM 2063 O TYR A 356 -21.187 86.209 88.588 1.00 18.74 +ATOM 2064 CB TYR A 356 -20.675 83.400 88.564 1.00 15.88 +ATOM 2065 CG TYR A 356 -20.183 81.976 88.738 1.00 13.91 +ATOM 2066 CD1 TYR A 356 -19.750 81.513 89.978 1.00 10.69 +ATOM 2067 CD2 TYR A 356 -20.183 81.081 87.660 1.00 12.71 +ATOM 2068 CE1 TYR A 356 -19.335 80.198 90.149 1.00 10.82 +ATOM 2069 CE2 TYR A 356 -19.769 79.765 87.820 1.00 12.65 +ATOM 2070 CZ TYR A 356 -19.350 79.327 89.068 1.00 12.90 +ATOM 2071 OH TYR A 356 -18.978 78.014 89.243 1.00 14.03 +ATOM 2072 N GLY A 357 -19.724 86.434 86.882 1.00 19.36 +ATOM 2073 CA GLY A 357 -20.276 87.725 86.509 1.00 20.05 +ATOM 2074 C GLY A 357 -20.053 88.635 87.707 1.00 21.09 +ATOM 2075 O GLY A 357 -18.955 88.659 88.261 1.00 21.46 +ATOM 2076 N ASN A 358 -21.079 89.368 88.124 1.00 20.80 +ATOM 2077 CA ASN A 358 -20.940 90.238 89.278 1.00 22.54 +ATOM 2078 C ASN A 358 -21.378 89.538 90.568 1.00 22.99 +ATOM 2079 O ASN A 358 -21.531 90.171 91.607 1.00 23.58 +ATOM 2080 CB ASN A 358 -21.735 91.536 89.073 1.00 25.01 +ATOM 2081 CG ASN A 358 -21.042 92.498 88.111 1.00 26.82 +ATOM 2082 OD1 ASN A 358 -19.871 92.838 88.297 1.00 28.22 +ATOM 2083 ND2 ASN A 358 -21.761 92.945 87.085 1.00 27.32 +ATOM 2084 N GLY A 359 -21.555 88.225 90.511 1.00 22.06 +ATOM 2085 CA GLY A 359 -21.963 87.505 91.701 1.00 22.30 +ATOM 2086 C GLY A 359 -20.807 86.703 92.266 1.00 23.21 +ATOM 2087 O GLY A 359 -19.774 86.555 91.604 1.00 23.36 +ATOM 2088 N VAL A 360 -20.979 86.173 93.475 1.00 21.86 +ATOM 2089 CA VAL A 360 -19.924 85.405 94.114 1.00 21.99 +ATOM 2090 C VAL A 360 -20.412 84.341 95.073 1.00 20.80 +ATOM 2091 O VAL A 360 -21.414 84.522 95.763 1.00 20.56 +ATOM 2092 CB VAL A 360 -18.971 86.317 94.917 1.00 22.95 +ATOM 2093 CG1 VAL A 360 -18.205 87.205 93.986 1.00 24.78 +ATOM 2094 CG2 VAL A 360 -19.767 87.155 95.908 1.00 22.26 +ATOM 2095 N TRP A 361 -19.684 83.229 95.107 1.00 19.54 +ATOM 2096 CA TRP A 361 -19.991 82.131 96.010 1.00 18.88 +ATOM 2097 C TRP A 361 -18.974 82.279 97.116 1.00 19.04 +ATOM 2098 O TRP A 361 -17.767 82.110 96.896 1.00 18.81 +ATOM 2099 CB TRP A 361 -19.806 80.768 95.337 1.00 18.21 +ATOM 2100 CG TRP A 361 -21.062 80.161 94.794 1.00 17.52 +ATOM 2101 CD1 TRP A 361 -21.414 80.043 93.480 1.00 16.94 +ATOM 2102 CD2 TRP A 361 -22.124 79.560 95.550 1.00 17.62 +ATOM 2103 NE1 TRP A 361 -22.626 79.402 93.368 1.00 18.16 +ATOM 2104 CE2 TRP A 361 -23.085 79.092 94.624 1.00 16.82 +ATOM 2105 CE3 TRP A 361 -22.355 79.366 96.921 1.00 16.66 +ATOM 2106 CZ2 TRP A 361 -24.260 78.446 95.019 1.00 16.40 +ATOM 2107 CZ3 TRP A 361 -23.526 78.723 97.319 1.00 16.40 +ATOM 2108 CH2 TRP A 361 -24.463 78.269 96.367 1.00 17.66 +ATOM 2109 N ILE A 362 -19.465 82.607 98.302 1.00 18.01 +ATOM 2110 CA ILE A 362 -18.609 82.803 99.450 1.00 17.31 +ATOM 2111 C ILE A 362 -18.573 81.591 100.374 1.00 17.78 +ATOM 2112 O ILE A 362 -19.602 80.965 100.652 1.00 17.57 +ATOM 2113 CB ILE A 362 -19.085 84.019 100.273 1.00 18.22 +ATOM 2114 CG1 ILE A 362 -19.014 85.282 99.414 1.00 18.46 +ATOM 2115 CG2 ILE A 362 -18.245 84.166 101.550 1.00 16.51 +ATOM 2116 CD1 ILE A 362 -19.620 86.499 100.085 1.00 18.07 +ATOM 2117 N GLY A 363 -17.370 81.268 100.831 1.00 16.15 +ATOM 2118 CA GLY A 363 -17.188 80.185 101.769 1.00 16.14 +ATOM 2119 C GLY A 363 -16.712 80.914 103.012 1.00 17.41 +ATOM 2120 O GLY A 363 -15.858 81.798 102.912 1.00 16.46 +ATOM 2121 N ARG A 364 -17.259 80.589 104.178 1.00 16.71 +ATOM 2122 CA ARG A 364 -16.833 81.281 105.394 1.00 17.26 +ATOM 2123 C ARG A 364 -17.226 80.521 106.646 1.00 17.00 +ATOM 2124 O ARG A 364 -18.003 79.566 106.586 1.00 18.76 +ATOM 2125 CB ARG A 364 -17.432 82.699 105.450 1.00 16.21 +ATOM 2126 CG ARG A 364 -18.921 82.775 105.849 1.00 16.52 +ATOM 2127 CD ARG A 364 -19.416 84.229 105.928 1.00 15.76 +ATOM 2128 NE ARG A 364 -20.720 84.374 106.579 1.00 14.66 +ATOM 2129 CZ ARG A 364 -21.350 85.535 106.751 1.00 13.48 +ATOM 2130 NH1 ARG A 364 -22.529 85.572 107.350 1.00 14.00 +ATOM 2131 NH2 ARG A 364 -20.810 86.666 106.321 1.00 14.41 +ATOM 2132 N THR A 365 -16.680 80.939 107.779 1.00 16.03 +ATOM 2133 CA THR A 365 -17.007 80.300 109.044 1.00 17.30 +ATOM 2134 C THR A 365 -18.397 80.783 109.470 1.00 18.28 +ATOM 2135 O THR A 365 -18.897 81.776 108.945 1.00 18.88 +ATOM 2136 CB THR A 365 -15.998 80.689 110.143 1.00 17.53 +ATOM 2137 OG1 THR A 365 -16.223 82.049 110.543 1.00 16.36 +ATOM 2138 CG2 THR A 365 -14.575 80.529 109.635 1.00 16.05 +ATOM 2139 N LYS A 366 -19.037 80.091 110.404 1.00 18.58 +ATOM 2140 CA LYS A 366 -20.348 80.550 110.847 1.00 20.02 +ATOM 2141 C LYS A 366 -20.165 81.584 111.965 1.00 20.57 +ATOM 2142 O LYS A 366 -20.937 82.537 112.079 1.00 18.75 +ATOM 2143 CB LYS A 366 -21.194 79.372 111.315 1.00 18.77 +ATOM 2144 CG LYS A 366 -21.414 78.362 110.208 1.00 19.49 +ATOM 2145 CD LYS A 366 -22.274 77.202 110.654 1.00 18.15 +ATOM 2146 CE LYS A 366 -23.719 77.473 110.345 1.00 17.50 +ATOM 2147 NZ LYS A 366 -23.896 77.682 108.893 1.00 16.39 +ATOM 2148 N SER A 367 -19.114 81.397 112.759 1.00 20.98 +ATOM 2149 CA SER A 367 -18.784 82.299 113.860 1.00 22.08 +ATOM 2150 C SER A 367 -17.952 83.507 113.380 1.00 22.63 +ATOM 2151 O SER A 367 -17.135 83.386 112.468 1.00 21.90 +ATOM 2152 CB SER A 367 -18.007 81.530 114.924 1.00 21.15 +ATOM 2153 OG SER A 367 -17.290 82.420 115.755 1.00 21.94 +ATOM 2154 N THR A 368 -18.162 84.665 114.001 1.00 23.94 +ATOM 2155 CA THR A 368 -17.437 85.882 113.630 1.00 25.04 +ATOM 2156 C THR A 368 -16.163 86.104 114.442 1.00 25.04 +ATOM 2157 O THR A 368 -15.361 86.964 114.082 1.00 26.11 +ATOM 2158 CB THR A 368 -18.297 87.131 113.832 1.00 26.77 +ATOM 2159 OG1 THR A 368 -19.474 87.041 113.020 1.00 20.00 +ATOM 2160 CG2 THR A 368 -17.523 88.380 113.440 1.00 20.00 +ATOM 2161 N ASN A 369 -15.977 85.339 115.521 1.00 24.44 +ATOM 2162 CA ASN A 369 -14.793 85.479 116.380 1.00 25.41 +ATOM 2163 C ASN A 369 -13.765 84.360 116.276 1.00 23.88 +ATOM 2164 O ASN A 369 -12.564 84.612 116.291 1.00 23.12 +ATOM 2165 CB ASN A 369 -15.204 85.591 117.843 1.00 29.16 +ATOM 2166 CG ASN A 369 -16.244 86.646 118.063 1.00 34.71 +ATOM 2167 OD1 ASN A 369 -16.052 87.806 117.686 1.00 37.48 +ATOM 2168 ND2 ASN A 369 -17.367 86.259 118.674 1.00 37.22 +ATOM 2169 N SER A 370 -14.234 83.123 116.205 1.00 22.46 +ATOM 2170 CA SER A 370 -13.324 81.999 116.112 1.00 21.00 +ATOM 2171 C SER A 370 -13.631 81.137 114.906 1.00 20.02 +ATOM 2172 O SER A 370 -14.705 81.231 114.318 1.00 18.40 +ATOM 2173 CB SER A 370 -13.389 81.152 117.389 1.00 21.86 +ATOM 2174 OG SER A 370 -14.710 80.701 117.648 1.00 23.12 +ATOM 2175 N ARG A 371 -12.669 80.299 114.547 1.00 19.56 +ATOM 2176 CA ARG A 371 -12.810 79.400 113.413 1.00 20.43 +ATOM 2177 C ARG A 371 -13.759 78.268 113.777 1.00 19.31 +ATOM 2178 O ARG A 371 -13.341 77.144 114.027 1.00 19.12 +ATOM 2179 CB ARG A 371 -11.430 78.863 113.010 1.00 21.01 +ATOM 2180 CG ARG A 371 -10.497 79.989 112.569 1.00 20.86 +ATOM 2181 CD ARG A 371 -9.024 79.597 112.481 1.00 19.50 +ATOM 2182 NE ARG A 371 -8.222 80.763 112.104 1.00 20.75 +ATOM 2183 CZ ARG A 371 -6.934 80.732 111.770 1.00 20.82 +ATOM 2184 NH1 ARG A 371 -6.306 81.856 111.441 1.00 18.53 +ATOM 2185 NH2 ARG A 371 -6.276 79.583 111.764 1.00 20.25 +ATOM 2186 N SER A 372 -15.046 78.595 113.798 1.00 19.77 +ATOM 2187 CA SER A 372 -16.097 77.648 114.139 1.00 19.47 +ATOM 2188 C SER A 372 -17.141 77.622 113.028 1.00 19.51 +ATOM 2189 O SER A 372 -17.637 78.668 112.608 1.00 19.90 +ATOM 2190 CB SER A 372 -16.766 78.057 115.461 1.00 19.23 +ATOM 2191 OG SER A 372 -15.811 78.299 116.481 1.00 17.84 +ATOM 2192 N GLY A 373 -17.470 76.420 112.563 1.00 20.20 +ATOM 2193 CA GLY A 373 -18.451 76.255 111.500 1.00 18.97 +ATOM 2194 C GLY A 373 -18.023 76.754 110.129 1.00 18.45 +ATOM 2195 O GLY A 373 -17.066 77.525 110.001 1.00 17.82 +ATOM 2196 N PHE A 374 -18.735 76.308 109.097 1.00 17.25 +ATOM 2197 CA PHE A 374 -18.453 76.728 107.732 1.00 17.01 +ATOM 2198 C PHE A 374 -19.753 76.709 106.944 1.00 18.23 +ATOM 2199 O PHE A 374 -20.679 75.974 107.289 1.00 19.08 +ATOM 2200 CB PHE A 374 -17.445 75.800 107.060 1.00 14.96 +ATOM 2201 CG PHE A 374 -16.757 76.421 105.873 1.00 13.34 +ATOM 2202 CD1 PHE A 374 -15.686 77.293 106.053 1.00 12.93 +ATOM 2203 CD2 PHE A 374 -17.178 76.145 104.578 1.00 11.41 +ATOM 2204 CE1 PHE A 374 -15.043 77.881 104.961 1.00 10.74 +ATOM 2205 CE2 PHE A 374 -16.540 76.730 103.481 1.00 12.26 +ATOM 2206 CZ PHE A 374 -15.472 77.598 103.675 1.00 11.36 +ATOM 2207 N GLU A 375 -19.818 77.513 105.886 1.00 17.29 +ATOM 2208 CA GLU A 375 -21.020 77.599 105.070 1.00 17.11 +ATOM 2209 C GLU A 375 -20.731 78.258 103.727 1.00 16.87 +ATOM 2210 O GLU A 375 -19.817 79.071 103.607 1.00 16.61 +ATOM 2211 CB GLU A 375 -22.093 78.414 105.810 1.00 18.02 +ATOM 2212 CG GLU A 375 -21.591 79.774 106.307 1.00 20.11 +ATOM 2213 CD GLU A 375 -22.650 80.579 107.071 1.00 23.46 +ATOM 2214 OE1 GLU A 375 -23.403 79.971 107.863 1.00 26.01 +ATOM 2215 OE2 GLU A 375 -22.723 81.822 106.899 1.00 22.82 +ATOM 2216 N MET A 376 -21.512 77.889 102.718 1.00 16.51 +ATOM 2217 CA MET A 376 -21.386 78.466 101.386 1.00 17.27 +ATOM 2218 C MET A 376 -22.552 79.447 101.205 1.00 17.58 +ATOM 2219 O MET A 376 -23.679 79.158 101.610 1.00 16.79 +ATOM 2220 CB MET A 376 -21.448 77.372 100.316 1.00 16.90 +ATOM 2221 CG MET A 376 -20.255 76.424 100.317 1.00 17.16 +ATOM 2222 SD MET A 376 -18.682 77.303 100.204 1.00 19.89 +ATOM 2223 CE MET A 376 -18.813 78.054 98.585 1.00 17.28 +ATOM 2224 N ILE A 377 -22.279 80.607 100.612 1.00 17.28 +ATOM 2225 CA ILE A 377 -23.316 81.611 100.401 1.00 16.99 +ATOM 2226 C ILE A 377 -23.293 82.184 98.986 1.00 18.02 +ATOM 2227 O ILE A 377 -22.231 82.504 98.444 1.00 17.17 +ATOM 2228 CB ILE A 377 -23.165 82.779 101.396 1.00 16.83 +ATOM 2229 CG1 ILE A 377 -23.392 82.287 102.825 1.00 16.16 +ATOM 2230 CG2 ILE A 377 -24.151 83.894 101.050 1.00 18.81 +ATOM 2231 CD1 ILE A 377 -23.141 83.341 103.874 1.00 13.34 +ATOM 2232 N TRP A 378 -24.469 82.305 98.382 1.00 18.45 +ATOM 2233 CA TRP A 378 -24.555 82.861 97.044 1.00 20.48 +ATOM 2234 C TRP A 378 -25.119 84.275 97.104 1.00 21.94 +ATOM 2235 O TRP A 378 -26.285 84.491 97.459 1.00 21.36 +ATOM 2236 CB TRP A 378 -25.430 81.998 96.138 1.00 21.42 +ATOM 2237 CG TRP A 378 -25.725 82.649 94.793 1.00 23.28 +ATOM 2238 CD1 TRP A 378 -26.956 82.961 94.281 1.00 22.77 +ATOM 2239 CD2 TRP A 378 -24.768 83.055 93.802 1.00 23.00 +ATOM 2240 NE1 TRP A 378 -26.823 83.532 93.035 1.00 22.79 +ATOM 2241 CE2 TRP A 378 -25.493 83.601 92.718 1.00 22.54 +ATOM 2242 CE3 TRP A 378 -23.371 83.009 93.726 1.00 22.97 +ATOM 2243 CZ2 TRP A 378 -24.869 84.097 91.572 1.00 23.09 +ATOM 2244 CZ3 TRP A 378 -22.748 83.501 92.586 1.00 24.01 +ATOM 2245 CH2 TRP A 378 -23.499 84.039 91.522 1.00 22.75 +ATOM 2246 N ASP A 379 -24.262 85.234 96.777 1.00 23.03 +ATOM 2247 CA ASP A 379 -24.643 86.634 96.757 1.00 25.10 +ATOM 2248 C ASP A 379 -24.522 87.115 95.315 1.00 25.99 +ATOM 2249 O ASP A 379 -23.435 87.498 94.874 1.00 26.66 +ATOM 2250 CB ASP A 379 -23.717 87.466 97.656 1.00 22.53 +ATOM 2251 CG ASP A 379 -24.152 88.918 97.748 1.00 22.46 +ATOM 2252 OD1 ASP A 379 -24.725 89.432 96.765 1.00 20.39 +ATOM 2253 OD2 ASP A 379 -23.918 89.553 98.799 1.00 22.74 +ATOM 2254 N PRO A 380 -25.625 87.069 94.549 1.00 27.82 +ATOM 2255 CA PRO A 380 -25.507 87.539 93.164 1.00 28.66 +ATOM 2256 C PRO A 380 -25.094 88.994 93.257 1.00 29.52 +ATOM 2257 O PRO A 380 -25.316 89.629 94.284 1.00 30.88 +ATOM 2258 CB PRO A 380 -26.920 87.357 92.614 1.00 28.53 +ATOM 2259 CG PRO A 380 -27.790 87.573 93.827 1.00 27.91 +ATOM 2260 CD PRO A 380 -27.033 86.811 94.907 1.00 28.73 +ATOM 2261 N ASN A 381 -24.471 89.531 92.223 1.00 31.17 +ATOM 2262 CA ASN A 381 -24.070 90.937 92.300 1.00 33.92 +ATOM 2263 C ASN A 381 -23.488 91.277 93.702 1.00 32.09 +ATOM 2264 O ASN A 381 -23.840 92.293 94.299 1.00 32.39 +ATOM 2265 CB ASN A 381 -25.293 91.827 92.005 1.00 37.66 +ATOM 2266 CG ASN A 381 -26.079 91.369 90.755 1.00 41.64 +ATOM 2267 OD1 ASN A 381 -25.584 91.454 89.620 1.00 41.48 +ATOM 2268 ND2 ASN A 381 -27.311 90.879 90.971 1.00 41.73 +ATOM 2269 N GLY A 382 -22.612 90.414 94.219 1.00 30.94 +ATOM 2270 CA GLY A 382 -22.005 90.634 95.529 1.00 27.65 +ATOM 2271 C GLY A 382 -20.504 90.895 95.445 1.00 26.05 +ATOM 2272 O GLY A 382 -19.836 91.230 96.431 1.00 23.55 +ATOM 2273 N TRP A 383 -19.970 90.734 94.244 1.00 24.16 +ATOM 2274 CA TRP A 383 -18.559 90.964 93.997 1.00 23.00 +ATOM 2275 C TRP A 383 -18.319 92.451 93.827 1.00 22.56 +ATOM 2276 O TRP A 383 -17.254 92.963 94.155 1.00 22.09 +ATOM 2277 CB TRP A 383 -18.150 90.231 92.722 1.00 22.40 +ATOM 2278 CG TRP A 383 -16.741 90.455 92.284 1.00 21.43 +ATOM 2279 CD1 TRP A 383 -16.274 91.473 91.506 1.00 20.45 +ATOM 2280 CD2 TRP A 383 -15.618 89.614 92.563 1.00 21.19 +ATOM 2281 NE1 TRP A 383 -14.929 91.314 91.280 1.00 21.67 +ATOM 2282 CE2 TRP A 383 -14.501 90.180 91.920 1.00 20.79 +ATOM 2283 CE3 TRP A 383 -15.447 88.432 93.297 1.00 21.63 +ATOM 2284 CZ2 TRP A 383 -13.231 89.606 91.984 1.00 21.65 +ATOM 2285 CZ3 TRP A 383 -14.182 87.859 93.360 1.00 20.44 +ATOM 2286 CH2 TRP A 383 -13.093 88.448 92.709 1.00 20.69 +ATOM 2287 N THR A 384 -19.333 93.140 93.318 1.00 21.94 +ATOM 2288 CA THR A 384 -19.236 94.565 93.055 1.00 22.23 +ATOM 2289 C THR A 384 -20.159 95.440 93.899 1.00 22.32 +ATOM 2290 O THR A 384 -19.947 96.641 93.991 1.00 22.24 +ATOM 2291 CB THR A 384 -19.558 94.847 91.579 1.00 21.59 +ATOM 2292 OG1 THR A 384 -20.754 94.143 91.231 1.00 20.16 +ATOM 2293 CG2 THR A 384 -18.421 94.402 90.671 1.00 19.60 +ATOM 2294 N GLU A 385 -21.181 94.851 94.506 1.00 23.62 +ATOM 2295 CA GLU A 385 -22.115 95.644 95.292 1.00 25.01 +ATOM 2296 C GLU A 385 -21.858 95.563 96.781 1.00 26.30 +ATOM 2297 O GLU A 385 -21.159 94.672 97.260 1.00 26.55 +ATOM 2298 CB GLU A 385 -23.562 95.232 94.999 1.00 25.35 +ATOM 2299 CG GLU A 385 -24.023 95.463 93.556 1.00 27.40 +ATOM 2300 CD GLU A 385 -23.856 96.914 93.080 1.00 30.80 +ATOM 2301 OE1 GLU A 385 -24.180 97.847 93.853 1.00 29.91 +ATOM 2302 OE2 GLU A 385 -23.413 97.117 91.921 1.00 31.33 +ATOM 2303 N THR A 386 -22.453 96.502 97.508 1.00 27.74 +ATOM 2304 CA THR A 386 -22.289 96.590 98.947 1.00 29.05 +ATOM 2305 C THR A 386 -23.589 96.456 99.735 1.00 30.25 +ATOM 2306 O THR A 386 -24.239 97.451 100.056 1.00 34.71 +ATOM 2307 CB THR A 386 -21.655 97.928 99.322 1.00 29.05 +ATOM 2308 OG1 THR A 386 -20.395 98.062 98.656 1.00 27.18 +ATOM 2309 CG2 THR A 386 -21.457 98.010 100.821 1.00 29.32 +ATOM 2310 N ASP A 387 -23.983 95.230 100.024 1.00 29.28 +ATOM 2311 CA ASP A 387 -25.172 94.985 100.816 1.00 28.96 +ATOM 2312 C ASP A 387 -24.963 93.630 101.430 1.00 28.64 +ATOM 2313 O ASP A 387 -24.129 92.852 100.960 1.00 28.71 +ATOM 2314 CB ASP A 387 -26.468 95.008 99.983 1.00 29.47 +ATOM 2315 CG ASP A 387 -26.395 94.147 98.731 1.00 29.65 +ATOM 2316 OD1 ASP A 387 -25.874 94.642 97.712 1.00 30.59 +ATOM 2317 OD2 ASP A 387 -26.853 92.979 98.760 1.00 30.66 +ATOM 2318 N SER A 388 -25.702 93.360 102.495 1.00 27.98 +ATOM 2319 CA SER A 388 -25.588 92.098 103.195 1.00 27.22 +ATOM 2320 C SER A 388 -26.644 91.074 102.768 1.00 27.02 +ATOM 2321 O SER A 388 -26.740 90.004 103.367 1.00 27.70 +ATOM 2322 CB SER A 388 -25.681 92.352 104.704 1.00 27.92 +ATOM 2323 OG SER A 388 -26.754 93.233 105.015 1.00 27.45 +ATOM 2324 N SER A 389 -27.426 91.382 101.736 1.00 25.64 +ATOM 2325 CA SER A 389 -28.467 90.451 101.307 1.00 25.38 +ATOM 2326 C SER A 389 -27.934 89.419 100.333 1.00 25.36 +ATOM 2327 O SER A 389 -27.038 89.706 99.528 1.00 24.91 +ATOM 2328 CB SER A 389 -29.629 91.194 100.664 1.00 23.52 +ATOM 2329 OG SER A 389 -29.244 91.698 99.408 1.00 24.74 +ATOM 2330 N PHE A 390 -28.508 88.220 100.410 1.00 26.20 +ATOM 2331 CA PHE A 390 -28.098 87.098 99.566 1.00 25.73 +ATOM 2332 C PHE A 390 -29.245 86.106 99.311 1.00 24.88 +ATOM 2333 O PHE A 390 -30.221 86.028 100.071 1.00 23.45 +ATOM 2334 CB PHE A 390 -26.911 86.376 100.217 1.00 24.88 +ATOM 2335 CG PHE A 390 -27.226 85.785 101.564 1.00 23.57 +ATOM 2336 CD1 PHE A 390 -27.718 84.486 101.674 1.00 24.15 +ATOM 2337 CD2 PHE A 390 -27.039 86.529 102.723 1.00 25.15 +ATOM 2338 CE1 PHE A 390 -28.018 83.930 102.924 1.00 24.96 +ATOM 2339 CE2 PHE A 390 -27.334 85.984 103.984 1.00 26.73 +ATOM 2340 CZ PHE A 390 -27.826 84.677 104.081 1.00 24.97 +ATOM 2341 N SER A 391 -29.085 85.326 98.249 1.00 23.74 +ATOM 2342 CA SER A 391 -30.091 84.367 97.822 1.00 23.38 +ATOM 2343 C SER A 391 -30.016 82.958 98.429 1.00 23.12 +ATOM 2344 O SER A 391 -31.024 82.427 98.907 1.00 22.06 +ATOM 2345 CB SER A 391 -30.026 84.268 96.303 1.00 22.43 +ATOM 2346 OG SER A 391 -29.789 85.550 95.754 1.00 21.66 +ATOM 2347 N VAL A 392 -28.830 82.354 98.409 1.00 21.42 +ATOM 2348 CA VAL A 392 -28.683 81.001 98.925 1.00 20.22 +ATOM 2349 C VAL A 392 -27.637 80.794 100.010 1.00 19.40 +ATOM 2350 O VAL A 392 -26.591 81.439 100.018 1.00 19.56 +ATOM 2351 CB VAL A 392 -28.352 80.023 97.781 1.00 21.10 +ATOM 2352 CG1 VAL A 392 -28.441 78.588 98.286 1.00 18.94 +ATOM 2353 CG2 VAL A 392 -29.299 80.253 96.605 1.00 20.21 +ATOM 2354 N LYS A 394 -27.929 79.881 100.927 1.00 18.02 +ATOM 2355 CA LYS A 394 -26.998 79.549 101.999 1.00 17.24 +ATOM 2356 C LYS A 394 -27.033 78.041 102.230 1.00 16.32 +ATOM 2357 O LYS A 394 -28.103 77.467 102.457 1.00 15.40 +ATOM 2358 CB LYS A 394 -27.370 80.253 103.299 1.00 17.19 +ATOM 2359 CG LYS A 394 -26.420 79.937 104.451 1.00 18.22 +ATOM 2360 CD LYS A 394 -27.149 79.953 105.788 1.00 19.98 +ATOM 2361 CE LYS A 394 -26.251 80.424 106.912 1.00 23.00 +ATOM 2362 NZ LYS A 394 -25.883 81.867 106.789 1.00 23.25 +ATOM 2363 N GLN A 395 -25.867 77.406 102.155 1.00 13.81 +ATOM 2364 CA GLN A 395 -25.763 75.974 102.370 1.00 14.24 +ATOM 2365 C GLN A 395 -24.806 75.675 103.526 1.00 16.17 +ATOM 2366 O GLN A 395 -23.635 76.071 103.503 1.00 17.26 +ATOM 2367 CB GLN A 395 -25.280 75.271 101.098 1.00 13.66 +ATOM 2368 CG GLN A 395 -25.152 73.744 101.254 1.00 15.01 +ATOM 2369 CD GLN A 395 -24.640 73.043 99.996 1.00 16.19 +ATOM 2370 OE1 GLN A 395 -24.460 71.823 99.979 1.00 14.84 +ATOM 2371 NE2 GLN A 395 -24.404 73.813 98.942 1.00 16.90 +ATOM 2372 N ASP A 396 -25.310 74.987 104.544 1.00 14.76 +ATOM 2373 CA ASP A 396 -24.484 74.639 105.687 1.00 16.00 +ATOM 2374 C ASP A 396 -23.492 73.511 105.373 1.00 14.21 +ATOM 2375 O ASP A 396 -23.843 72.539 104.709 1.00 12.90 +ATOM 2376 CB ASP A 396 -25.366 74.222 106.875 1.00 16.22 +ATOM 2377 CG ASP A 396 -26.249 75.352 107.377 1.00 19.23 +ATOM 2378 OD1 ASP A 396 -25.751 76.490 107.522 1.00 20.39 +ATOM 2379 OD2 ASP A 396 -27.445 75.103 107.643 1.00 21.70 +ATOM 2380 N ILE A 397 -22.255 73.656 105.851 1.00 13.45 +ATOM 2381 CA ILE A 397 -21.218 72.634 105.672 1.00 13.78 +ATOM 2382 C ILE A 397 -20.717 72.137 107.047 1.00 14.51 +ATOM 2383 O ILE A 397 -20.451 70.943 107.227 1.00 14.47 +ATOM 2384 CB ILE A 397 -20.024 73.150 104.802 1.00 12.58 +ATOM 2385 CG1 ILE A 397 -20.328 72.952 103.312 1.00 15.62 +ATOM 2386 CG2 ILE A 397 -18.764 72.332 105.069 1.00 12.38 +ATOM 2387 CD1 ILE A 397 -21.444 73.776 102.772 1.00 15.01 +ATOM 2388 N VAL A 398 -20.594 73.046 108.016 1.00 14.52 +ATOM 2389 CA VAL A 398 -20.164 72.671 109.370 1.00 14.74 +ATOM 2390 C VAL A 398 -20.878 73.519 110.431 1.00 16.54 +ATOM 2391 O VAL A 398 -20.809 74.750 110.404 1.00 17.28 +ATOM 2392 CB VAL A 398 -18.647 72.827 109.554 1.00 13.20 +ATOM 2393 CG1 VAL A 398 -18.256 72.429 110.957 1.00 12.01 +ATOM 2394 CG2 VAL A 398 -17.908 71.965 108.548 1.00 13.46 +ATOM 2395 N ALA A 399 -21.570 72.850 111.353 1.00 17.31 +ATOM 2396 CA ALA A 399 -22.307 73.517 112.428 1.00 17.17 +ATOM 2397 C ALA A 399 -21.398 74.456 113.212 1.00 17.20 +ATOM 2398 O ALA A 399 -20.196 74.218 113.302 1.00 16.43 +ATOM 2399 CB ALA A 399 -22.925 72.477 113.363 1.00 14.81 +ATOM 2400 N ILE A 400 -21.979 75.523 113.765 1.00 18.91 +ATOM 2401 CA ILE A 400 -21.226 76.518 114.544 1.00 20.97 +ATOM 2402 C ILE A 400 -20.646 75.893 115.804 1.00 19.83 +ATOM 2403 O ILE A 400 -19.727 76.439 116.412 1.00 19.41 +ATOM 2404 CB ILE A 400 -22.115 77.689 115.035 1.00 23.87 +ATOM 2405 CG1 ILE A 400 -23.182 78.022 113.992 1.00 28.82 +ATOM 2406 CG2 ILE A 400 -21.250 78.934 115.288 1.00 23.79 +ATOM 2407 CD1 ILE A 400 -24.363 78.859 114.551 1.00 29.99 +ATOM 2408 N THR A 401 -21.198 74.749 116.190 1.00 18.56 +ATOM 2409 CA THR A 401 -20.767 74.070 117.391 1.00 18.92 +ATOM 2410 C THR A 401 -19.490 73.294 117.193 1.00 17.90 +ATOM 2411 O THR A 401 -18.941 72.747 118.139 1.00 18.07 +ATOM 2412 CB THR A 401 -21.857 73.112 117.883 1.00 20.78 +ATOM 2413 OG1 THR A 401 -22.275 72.277 116.798 1.00 20.47 +ATOM 2414 CG2 THR A 401 -23.053 73.895 118.407 1.00 20.29 +ATOM 2415 N ASP A 402 -19.001 73.256 115.965 1.00 17.82 +ATOM 2416 CA ASP A 402 -17.785 72.513 115.689 1.00 17.45 +ATOM 2417 C ASP A 402 -16.689 73.316 115.023 1.00 16.37 +ATOM 2418 O ASP A 402 -16.954 74.279 114.305 1.00 17.47 +ATOM 2419 CB ASP A 402 -18.139 71.285 114.870 1.00 17.96 +ATOM 2420 CG ASP A 402 -18.921 70.279 115.681 1.00 20.07 +ATOM 2421 OD1 ASP A 402 -18.271 69.460 116.370 1.00 20.54 +ATOM 2422 OD2 ASP A 402 -20.178 70.323 115.653 1.00 19.90 +ATOM 2423 N TRP A 403 -15.453 72.908 115.279 1.00 14.88 +ATOM 2424 CA TRP A 403 -14.293 73.586 114.737 1.00 15.72 +ATOM 2425 C TRP A 403 -14.077 73.386 113.241 1.00 17.76 +ATOM 2426 O TRP A 403 -14.202 72.271 112.706 1.00 18.36 +ATOM 2427 CB TRP A 403 -13.029 73.145 115.478 1.00 16.15 +ATOM 2428 CG TRP A 403 -13.113 73.308 116.964 1.00 18.77 +ATOM 2429 CD1 TRP A 403 -13.287 72.320 117.887 1.00 17.90 +ATOM 2430 CD2 TRP A 403 -13.094 74.543 117.696 1.00 19.96 +ATOM 2431 NE1 TRP A 403 -13.382 72.860 119.150 1.00 20.05 +ATOM 2432 CE2 TRP A 403 -13.267 74.221 119.063 1.00 19.72 +ATOM 2433 CE3 TRP A 403 -12.946 75.890 117.330 1.00 19.41 +ATOM 2434 CZ2 TRP A 403 -13.302 75.197 120.068 1.00 19.59 +ATOM 2435 CZ3 TRP A 403 -12.980 76.863 118.333 1.00 19.84 +ATOM 2436 CH2 TRP A 403 -13.157 76.508 119.685 1.00 18.77 +ATOM 2437 N SER A 404 -13.765 74.488 112.570 1.00 16.29 +ATOM 2438 CA SER A 404 -13.456 74.456 111.149 1.00 15.92 +ATOM 2439 C SER A 404 -12.042 75.030 111.084 1.00 14.65 +ATOM 2440 O SER A 404 -11.235 74.763 111.967 1.00 13.58 +ATOM 2441 CB SER A 404 -14.453 75.295 110.329 1.00 15.61 +ATOM 2442 OG SER A 404 -14.533 76.636 110.779 1.00 17.60 +ATOM 2443 N GLY A 405 -11.738 75.818 110.063 1.00 13.68 +ATOM 2444 CA GLY A 405 -10.402 76.374 109.956 1.00 13.17 +ATOM 2445 C GLY A 405 -10.127 76.855 108.552 1.00 12.57 +ATOM 2446 O GLY A 405 -10.981 77.489 107.940 1.00 13.33 +ATOM 2447 N TYR A 406 -8.941 76.567 108.032 1.00 11.64 +ATOM 2448 CA TYR A 406 -8.609 76.989 106.672 1.00 12.73 +ATOM 2449 C TYR A 406 -9.568 76.375 105.670 1.00 12.91 +ATOM 2450 O TYR A 406 -10.262 75.416 105.969 1.00 15.00 +ATOM 2451 CB TYR A 406 -7.188 76.562 106.297 1.00 10.81 +ATOM 2452 CG TYR A 406 -6.108 77.538 106.686 1.00 10.16 +ATOM 2453 CD1 TYR A 406 -6.315 78.474 107.692 1.00 9.17 +ATOM 2454 CD2 TYR A 406 -4.862 77.493 106.076 1.00 7.79 +ATOM 2455 CE1 TYR A 406 -5.307 79.334 108.080 1.00 10.25 +ATOM 2456 CE2 TYR A 406 -3.859 78.340 106.452 1.00 9.23 +ATOM 2457 CZ TYR A 406 -4.082 79.261 107.458 1.00 11.75 +ATOM 2458 OH TYR A 406 -3.066 80.096 107.856 1.00 12.88 +ATOM 2459 N SER A 407 -9.599 76.940 104.475 1.00 12.45 +ATOM 2460 CA SER A 407 -10.436 76.427 103.404 1.00 10.91 +ATOM 2461 C SER A 407 -9.875 77.017 102.125 1.00 11.11 +ATOM 2462 O SER A 407 -9.354 78.135 102.121 1.00 9.51 +ATOM 2463 CB SER A 407 -11.909 76.832 103.599 1.00 10.81 +ATOM 2464 OG SER A 407 -12.123 78.213 103.400 1.00 9.55 +ATOM 2465 N GLY A 408 -9.955 76.262 101.041 1.00 11.44 +ATOM 2466 CA GLY A 408 -9.430 76.777 99.796 1.00 13.14 +ATOM 2467 C GLY A 408 -10.141 76.191 98.610 1.00 15.28 +ATOM 2468 O GLY A 408 -10.921 75.247 98.743 1.00 17.44 +ATOM 2469 N SER A 409 -9.865 76.748 97.442 1.00 14.70 +ATOM 2470 CA SER A 409 -10.479 76.271 96.216 1.00 15.35 +ATOM 2471 C SER A 409 -9.550 75.332 95.452 1.00 15.64 +ATOM 2472 O SER A 409 -8.335 75.360 95.631 1.00 15.12 +ATOM 2473 CB SER A 409 -10.801 77.456 95.301 1.00 14.56 +ATOM 2474 OG SER A 409 -9.605 77.991 94.744 1.00 10.37 +ATOM 2475 N PHE A 410 -10.147 74.493 94.614 1.00 16.23 +ATOM 2476 CA PHE A 410 -9.408 73.603 93.721 1.00 17.60 +ATOM 2477 C PHE A 410 -10.324 73.282 92.540 1.00 18.25 +ATOM 2478 O PHE A 410 -11.550 73.399 92.639 1.00 17.63 +ATOM 2479 CB PHE A 410 -8.883 72.329 94.419 1.00 16.84 +ATOM 2480 CG PHE A 410 -9.931 71.308 94.751 1.00 17.97 +ATOM 2481 CD1 PHE A 410 -10.762 71.474 95.848 1.00 17.97 +ATOM 2482 CD2 PHE A 410 -10.025 70.131 94.011 1.00 18.42 +ATOM 2483 CE1 PHE A 410 -11.666 70.478 96.214 1.00 19.80 +ATOM 2484 CE2 PHE A 410 -10.931 69.123 94.369 1.00 18.77 +ATOM 2485 CZ PHE A 410 -11.750 69.295 95.471 1.00 17.73 +ATOM 2486 N VAL A 411 -9.741 72.898 91.415 1.00 17.62 +ATOM 2487 CA VAL A 411 -10.556 72.645 90.239 1.00 18.74 +ATOM 2488 C VAL A 411 -10.321 71.311 89.554 1.00 18.53 +ATOM 2489 O VAL A 411 -9.369 70.597 89.846 1.00 19.24 +ATOM 2490 CB VAL A 411 -10.340 73.761 89.183 1.00 19.92 +ATOM 2491 CG1 VAL A 411 -11.263 73.553 88.031 1.00 23.04 +ATOM 2492 CG2 VAL A 411 -10.597 75.113 89.781 1.00 20.72 +ATOM 2493 N GLN A 412 -11.220 70.990 88.636 1.00 18.06 +ATOM 2494 CA GLN A 412 -11.140 69.771 87.857 1.00 17.12 +ATOM 2495 C GLN A 412 -11.349 70.224 86.419 1.00 16.45 +ATOM 2496 O GLN A 412 -12.427 70.692 86.046 1.00 15.56 +ATOM 2497 CB GLN A 412 -12.227 68.781 88.300 1.00 16.77 +ATOM 2498 CG GLN A 412 -12.121 68.392 89.764 1.00 13.79 +ATOM 2499 CD GLN A 412 -12.946 67.171 90.128 1.00 13.89 +ATOM 2500 OE1 GLN A 412 -14.156 67.132 89.921 1.00 14.13 +ATOM 2501 NE2 GLN A 412 -12.287 66.170 90.690 1.00 15.23 +ATOM 2502 N HIS A 412A -10.291 70.113 85.629 1.00 16.40 +ATOM 2503 CA HIS A 412A -10.308 70.521 84.231 1.00 15.99 +ATOM 2504 C HIS A 412A -10.986 69.520 83.325 1.00 16.42 +ATOM 2505 O HIS A 412A -11.158 68.360 83.684 1.00 16.50 +ATOM 2506 CB HIS A 412A -8.883 70.706 83.720 1.00 17.61 +ATOM 2507 CG HIS A 412A -8.197 71.925 84.240 1.00 17.94 +ATOM 2508 ND1 HIS A 412A -8.143 73.104 83.529 1.00 18.22 +ATOM 2509 CD2 HIS A 412A -7.511 72.145 85.385 1.00 18.35 +ATOM 2510 CE1 HIS A 412A -7.451 73.994 84.213 1.00 19.17 +ATOM 2511 NE2 HIS A 412A -7.055 73.437 85.344 1.00 18.08 +ATOM 2512 N PRO A 412B -11.381 69.969 82.123 1.00 17.93 +ATOM 2513 CA PRO A 412B -12.040 69.140 81.110 1.00 17.79 +ATOM 2514 C PRO A 412B -11.238 67.879 80.768 1.00 18.05 +ATOM 2515 O PRO A 412B -11.812 66.823 80.523 1.00 19.06 +ATOM 2516 CB PRO A 412B -12.153 70.090 79.925 1.00 17.54 +ATOM 2517 CG PRO A 412B -12.438 71.395 80.601 1.00 17.41 +ATOM 2518 CD PRO A 412B -11.457 71.399 81.754 1.00 18.17 +ATOM 2519 N GLU A 412C -9.915 67.970 80.753 1.00 18.33 +ATOM 2520 CA GLU A 412C -9.134 66.784 80.424 1.00 19.37 +ATOM 2521 C GLU A 412C -9.243 65.703 81.509 1.00 19.87 +ATOM 2522 O GLU A 412C -8.815 64.566 81.313 1.00 21.87 +ATOM 2523 CB GLU A 412C -7.657 67.137 80.152 1.00 19.14 +ATOM 2524 CG GLU A 412C -7.226 68.570 80.466 1.00 21.55 +ATOM 2525 CD GLU A 412C -7.558 69.574 79.372 1.00 18.96 +ATOM 2526 OE1 GLU A 412C -7.199 69.336 78.209 1.00 20.85 +ATOM 2527 OE2 GLU A 412C -8.161 70.617 79.682 1.00 20.20 +ATOM 2528 N LEU A 412D -9.828 66.048 82.650 1.00 20.69 +ATOM 2529 CA LEU A 412D -9.996 65.083 83.740 1.00 20.41 +ATOM 2530 C LEU A 412D -11.436 64.628 83.815 1.00 21.07 +ATOM 2531 O LEU A 412D -11.724 63.444 83.979 1.00 21.74 +ATOM 2532 CB LEU A 412D -9.637 65.703 85.098 1.00 17.55 +ATOM 2533 CG LEU A 412D -10.171 64.925 86.316 1.00 15.64 +ATOM 2534 CD1 LEU A 412D -9.537 63.540 86.367 1.00 15.65 +ATOM 2535 CD2 LEU A 412D -9.875 65.672 87.597 1.00 13.66 +ATOM 2536 N THR A 413 -12.328 65.599 83.688 1.00 21.89 +ATOM 2537 CA THR A 413 -13.757 65.384 83.790 1.00 22.76 +ATOM 2538 C THR A 413 -14.501 65.005 82.512 1.00 22.32 +ATOM 2539 O THR A 413 -15.520 64.313 82.559 1.00 21.74 +ATOM 2540 CB THR A 413 -14.407 66.633 84.353 1.00 23.48 +ATOM 2541 OG1 THR A 413 -13.732 67.021 85.557 1.00 25.39 +ATOM 2542 CG2 THR A 413 -15.847 66.364 84.661 1.00 26.10 +ATOM 2543 N GLY A 414 -14.000 65.457 81.373 1.00 22.25 +ATOM 2544 CA GLY A 414 -14.676 65.164 80.127 1.00 21.45 +ATOM 2545 C GLY A 414 -15.663 66.276 79.821 1.00 22.37 +ATOM 2546 O GLY A 414 -16.144 66.387 78.697 1.00 24.79 +ATOM 2547 N LEU A 415 -15.977 67.094 80.822 1.00 21.25 +ATOM 2548 CA LEU A 415 -16.892 68.221 80.647 1.00 20.65 +ATOM 2549 C LEU A 415 -16.321 69.234 79.656 1.00 22.40 +ATOM 2550 O LEU A 415 -15.223 69.053 79.118 1.00 22.21 +ATOM 2551 CB LEU A 415 -17.111 68.930 81.984 1.00 19.36 +ATOM 2552 CG LEU A 415 -18.151 68.426 82.987 1.00 18.30 +ATOM 2553 CD1 LEU A 415 -18.392 66.948 82.824 1.00 18.64 +ATOM 2554 CD2 LEU A 415 -17.681 68.765 84.384 1.00 16.92 +ATOM 2555 N ASP A 416 -17.066 70.313 79.429 1.00 23.81 +ATOM 2556 CA ASP A 416 -16.623 71.370 78.518 1.00 24.02 +ATOM 2557 C ASP A 416 -16.451 72.668 79.301 1.00 22.68 +ATOM 2558 O ASP A 416 -16.460 73.752 78.729 1.00 24.29 +ATOM 2559 CB ASP A 416 -17.646 71.579 77.396 1.00 25.56 +ATOM 2560 CG ASP A 416 -18.930 72.215 77.893 1.00 28.28 +ATOM 2561 OD1 ASP A 416 -19.144 72.208 79.129 1.00 30.71 +ATOM 2562 OD2 ASP A 416 -19.728 72.711 77.055 1.00 28.65 +ATOM 2563 N CYS A 417 -16.311 72.552 80.614 1.00 20.80 +ATOM 2564 CA CYS A 417 -16.134 73.718 81.468 1.00 19.85 +ATOM 2565 C CYS A 417 -15.263 73.358 82.662 1.00 17.29 +ATOM 2566 O CYS A 417 -15.181 72.206 83.048 1.00 17.73 +ATOM 2567 CB CYS A 417 -17.495 74.230 81.950 1.00 22.51 +ATOM 2568 SG CYS A 417 -18.496 72.905 82.690 1.00 26.03 +ATOM 2569 N ILE A 418 -14.593 74.347 83.232 1.00 16.47 +ATOM 2570 CA ILE A 418 -13.746 74.125 84.400 1.00 15.50 +ATOM 2571 C ILE A 418 -14.634 74.063 85.641 1.00 15.12 +ATOM 2572 O ILE A 418 -15.294 75.033 85.970 1.00 14.80 +ATOM 2573 CB ILE A 418 -12.693 75.264 84.516 1.00 14.75 +ATOM 2574 CG1 ILE A 418 -11.606 75.032 83.464 1.00 14.84 +ATOM 2575 CG2 ILE A 418 -12.095 75.323 85.900 1.00 11.25 +ATOM 2576 CD1 ILE A 418 -10.604 76.135 83.347 1.00 14.02 +ATOM 2577 N ARG A 419 -14.648 72.909 86.310 1.00 15.24 +ATOM 2578 CA ARG A 419 -15.469 72.690 87.501 1.00 15.80 +ATOM 2579 C ARG A 419 -14.899 73.205 88.829 1.00 16.44 +ATOM 2580 O ARG A 419 -13.746 72.955 89.174 1.00 16.92 +ATOM 2581 CB ARG A 419 -15.795 71.196 87.652 1.00 16.38 +ATOM 2582 CG ARG A 419 -16.128 70.793 89.094 1.00 19.47 +ATOM 2583 CD ARG A 419 -16.603 69.345 89.244 1.00 22.54 +ATOM 2584 NE ARG A 419 -17.921 69.141 88.636 1.00 25.19 +ATOM 2585 CZ ARG A 419 -18.587 67.990 88.652 1.00 24.31 +ATOM 2586 NH1 ARG A 419 -18.068 66.926 89.246 1.00 24.90 +ATOM 2587 NH2 ARG A 419 -19.773 67.905 88.068 1.00 24.21 +ATOM 2588 N PRO A 420 -15.721 73.926 89.601 1.00 16.66 +ATOM 2589 CA PRO A 420 -15.282 74.461 90.892 1.00 16.21 +ATOM 2590 C PRO A 420 -15.587 73.506 92.060 1.00 17.90 +ATOM 2591 O PRO A 420 -16.676 72.925 92.133 1.00 17.25 +ATOM 2592 CB PRO A 420 -16.073 75.757 91.000 1.00 14.07 +ATOM 2593 CG PRO A 420 -17.374 75.368 90.412 1.00 14.66 +ATOM 2594 CD PRO A 420 -16.990 74.550 89.182 1.00 15.42 +ATOM 2595 N CYS A 421 -14.613 73.344 92.954 1.00 17.63 +ATOM 2596 CA CYS A 421 -14.753 72.501 94.142 1.00 18.08 +ATOM 2597 C CYS A 421 -14.037 73.271 95.263 1.00 16.87 +ATOM 2598 O CYS A 421 -13.494 74.345 95.028 1.00 18.19 +ATOM 2599 CB CYS A 421 -14.059 71.138 93.953 1.00 18.63 +ATOM 2600 SG CYS A 421 -14.586 70.039 92.583 1.00 20.28 +ATOM 2601 N PHE A 422 -14.043 72.742 96.477 1.00 14.73 +ATOM 2602 CA PHE A 422 -13.343 73.393 97.572 1.00 14.56 +ATOM 2603 C PHE A 422 -13.139 72.437 98.738 1.00 14.45 +ATOM 2604 O PHE A 422 -13.814 71.407 98.840 1.00 13.45 +ATOM 2605 CB PHE A 422 -14.081 74.670 98.026 1.00 15.41 +ATOM 2606 CG PHE A 422 -15.369 74.423 98.774 1.00 15.57 +ATOM 2607 CD1 PHE A 422 -15.362 74.220 100.153 1.00 15.26 +ATOM 2608 CD2 PHE A 422 -16.593 74.416 98.103 1.00 13.75 +ATOM 2609 CE1 PHE A 422 -16.554 74.017 100.859 1.00 14.67 +ATOM 2610 CE2 PHE A 422 -17.784 74.212 98.797 1.00 14.48 +ATOM 2611 CZ PHE A 422 -17.764 74.013 100.181 1.00 13.51 +ATOM 2612 N TRP A 423 -12.191 72.776 99.606 1.00 13.20 +ATOM 2613 CA TRP A 423 -11.894 71.952 100.767 1.00 12.72 +ATOM 2614 C TRP A 423 -11.930 72.786 102.040 1.00 11.72 +ATOM 2615 O TRP A 423 -11.844 74.015 101.987 1.00 11.28 +ATOM 2616 CB TRP A 423 -10.510 71.317 100.613 1.00 12.78 +ATOM 2617 CG TRP A 423 -9.416 72.312 100.333 1.00 14.32 +ATOM 2618 CD1 TRP A 423 -8.890 72.638 99.112 1.00 15.32 +ATOM 2619 CD2 TRP A 423 -8.742 73.129 101.287 1.00 14.05 +ATOM 2620 NE1 TRP A 423 -7.930 73.606 99.250 1.00 14.84 +ATOM 2621 CE2 TRP A 423 -7.818 73.928 100.574 1.00 14.98 +ATOM 2622 CE3 TRP A 423 -8.829 73.270 102.675 1.00 14.70 +ATOM 2623 CZ2 TRP A 423 -6.985 74.856 101.207 1.00 15.24 +ATOM 2624 CZ3 TRP A 423 -7.998 74.197 103.306 1.00 15.27 +ATOM 2625 CH2 TRP A 423 -7.090 74.976 102.570 1.00 14.80 +ATOM 2626 N VAL A 424 -12.064 72.112 103.180 1.00 10.74 +ATOM 2627 CA VAL A 424 -12.076 72.790 104.471 1.00 9.47 +ATOM 2628 C VAL A 424 -11.211 72.044 105.488 1.00 11.56 +ATOM 2629 O VAL A 424 -11.367 70.836 105.677 1.00 12.87 +ATOM 2630 CB VAL A 424 -13.493 72.898 105.050 1.00 7.55 +ATOM 2631 CG1 VAL A 424 -13.485 73.829 106.247 1.00 5.96 +ATOM 2632 CG2 VAL A 424 -14.457 73.404 104.002 1.00 7.69 +ATOM 2633 N GLU A 425 -10.284 72.765 106.119 1.00 12.35 +ATOM 2634 CA GLU A 425 -9.412 72.198 107.147 1.00 13.23 +ATOM 2635 C GLU A 425 -10.136 72.259 108.495 1.00 13.80 +ATOM 2636 O GLU A 425 -10.606 73.321 108.904 1.00 13.97 +ATOM 2637 CB GLU A 425 -8.109 72.998 107.256 1.00 13.56 +ATOM 2638 CG GLU A 425 -7.363 72.758 108.575 1.00 14.32 +ATOM 2639 CD GLU A 425 -6.112 73.614 108.726 1.00 15.61 +ATOM 2640 OE1 GLU A 425 -6.222 74.859 108.718 1.00 12.81 +ATOM 2641 OE2 GLU A 425 -5.014 73.035 108.858 1.00 14.33 +ATOM 2642 N LEU A 426 -10.239 71.121 109.173 1.00 13.66 +ATOM 2643 CA LEU A 426 -10.894 71.063 110.476 1.00 14.17 +ATOM 2644 C LEU A 426 -9.794 70.959 111.538 1.00 15.04 +ATOM 2645 O LEU A 426 -9.314 69.866 111.848 1.00 13.31 +ATOM 2646 CB LEU A 426 -11.821 69.847 110.528 1.00 13.92 +ATOM 2647 CG LEU A 426 -12.736 69.752 109.301 1.00 13.26 +ATOM 2648 CD1 LEU A 426 -13.362 68.381 109.212 1.00 13.25 +ATOM 2649 CD2 LEU A 426 -13.802 70.824 109.372 1.00 13.54 +ATOM 2650 N ILE A 427 -9.403 72.113 112.079 1.00 15.51 +ATOM 2651 CA ILE A 427 -8.339 72.215 113.081 1.00 16.95 +ATOM 2652 C ILE A 427 -8.735 71.803 114.495 1.00 17.50 +ATOM 2653 O ILE A 427 -9.696 72.325 115.043 1.00 17.68 +ATOM 2654 CB ILE A 427 -7.803 73.665 113.161 1.00 17.16 +ATOM 2655 CG1 ILE A 427 -7.234 74.094 111.808 1.00 18.23 +ATOM 2656 CG2 ILE A 427 -6.733 73.770 114.241 1.00 17.02 +ATOM 2657 CD1 ILE A 427 -6.877 75.568 111.743 1.00 17.04 +ATOM 2658 N ARG A 428 -7.979 70.881 115.087 1.00 18.57 +ATOM 2659 CA ARG A 428 -8.247 70.430 116.451 1.00 19.49 +ATOM 2660 C ARG A 428 -7.029 70.681 117.322 1.00 20.02 +ATOM 2661 O ARG A 428 -5.906 70.719 116.825 1.00 21.59 +ATOM 2662 CB ARG A 428 -8.583 68.933 116.488 1.00 19.83 +ATOM 2663 CG ARG A 428 -9.887 68.556 115.799 1.00 20.88 +ATOM 2664 CD ARG A 428 -11.037 69.420 116.286 1.00 20.54 +ATOM 2665 NE ARG A 428 -11.339 69.250 117.706 1.00 20.84 +ATOM 2666 CZ ARG A 428 -12.009 68.222 118.220 1.00 21.63 +ATOM 2667 NH1 ARG A 428 -12.237 68.165 119.528 1.00 22.16 +ATOM 2668 NH2 ARG A 428 -12.450 67.248 117.432 1.00 21.63 +ATOM 2669 N GLY A 429 -7.257 70.846 118.622 1.00 20.80 +ATOM 2670 CA GLY A 429 -6.165 71.080 119.555 1.00 20.92 +ATOM 2671 C GLY A 429 -5.983 72.535 119.945 1.00 21.46 +ATOM 2672 O GLY A 429 -6.957 73.259 120.173 1.00 20.84 +ATOM 2673 N ARG A 430 -4.724 72.957 120.021 1.00 22.07 +ATOM 2674 CA ARG A 430 -4.363 74.328 120.372 1.00 22.87 +ATOM 2675 C ARG A 430 -4.605 75.320 119.223 1.00 22.55 +ATOM 2676 O ARG A 430 -4.511 74.972 118.044 1.00 22.68 +ATOM 2677 CB ARG A 430 -2.894 74.366 120.813 1.00 23.97 +ATOM 2678 CG ARG A 430 -2.686 73.854 122.244 1.00 29.02 +ATOM 2679 CD ARG A 430 -1.312 73.202 122.415 1.00 33.61 +ATOM 2680 NE ARG A 430 -0.276 74.110 122.919 1.00 36.92 +ATOM 2681 CZ ARG A 430 1.000 74.073 122.533 1.00 37.89 +ATOM 2682 NH1 ARG A 430 1.404 73.176 121.631 1.00 35.82 +ATOM 2683 NH2 ARG A 430 1.875 74.928 123.053 1.00 36.99 +ATOM 2684 N PRO A 431 -4.892 76.585 119.558 1.00 22.86 +ATOM 2685 CA PRO A 431 -4.990 77.105 120.928 1.00 22.23 +ATOM 2686 C PRO A 431 -6.364 76.995 121.610 1.00 22.86 +ATOM 2687 O PRO A 431 -6.480 77.198 122.822 1.00 23.87 +ATOM 2688 CB PRO A 431 -4.552 78.552 120.758 1.00 20.89 +ATOM 2689 CG PRO A 431 -5.182 78.910 119.451 1.00 22.04 +ATOM 2690 CD PRO A 431 -4.946 77.683 118.572 1.00 21.80 +ATOM 2691 N LYS A 432 -7.400 76.669 120.847 1.00 22.95 +ATOM 2692 CA LYS A 432 -8.747 76.575 121.406 1.00 22.38 +ATOM 2693 C LYS A 432 -9.021 75.419 122.367 1.00 21.76 +ATOM 2694 O LYS A 432 -9.938 75.491 123.178 1.00 21.53 +ATOM 2695 CB LYS A 432 -9.778 76.525 120.275 1.00 21.04 +ATOM 2696 CG LYS A 432 -10.033 77.870 119.627 1.00 21.71 +ATOM 2697 CD LYS A 432 -10.394 78.903 120.691 1.00 23.27 +ATOM 2698 CE LYS A 432 -10.628 80.283 120.103 1.00 23.31 +ATOM 2699 NZ LYS A 432 -10.421 81.343 121.157 1.00 25.54 +ATOM 2700 N GLU A 433 -8.235 74.356 122.280 1.00 21.85 +ATOM 2701 CA GLU A 433 -8.454 73.193 123.133 1.00 19.94 +ATOM 2702 C GLU A 433 -7.212 72.832 123.931 1.00 18.82 +ATOM 2703 O GLU A 433 -6.089 72.971 123.449 1.00 15.10 +ATOM 2704 CB GLU A 433 -8.899 72.005 122.270 1.00 19.78 +ATOM 2705 CG GLU A 433 -10.189 72.251 121.482 1.00 20.21 +ATOM 2706 CD GLU A 433 -10.537 71.095 120.567 1.00 21.04 +ATOM 2707 OE1 GLU A 433 -9.912 70.992 119.491 1.00 20.83 +ATOM 2708 OE2 GLU A 433 -11.417 70.280 120.930 1.00 21.39 +ATOM 2709 N SER A 435 -7.435 72.348 125.149 1.00 19.64 +ATOM 2710 CA SER A 435 -6.345 71.994 126.040 1.00 20.89 +ATOM 2711 C SER A 435 -5.700 70.663 125.716 1.00 19.82 +ATOM 2712 O SER A 435 -6.069 69.620 126.255 1.00 19.84 +ATOM 2713 CB SER A 435 -6.820 72.000 127.497 1.00 22.86 +ATOM 2714 OG SER A 435 -7.688 70.913 127.749 1.00 29.23 +ATOM 2715 N THR A 436 -4.714 70.721 124.832 1.00 18.29 +ATOM 2716 CA THR A 436 -3.964 69.548 124.418 1.00 16.92 +ATOM 2717 C THR A 436 -2.548 70.064 124.251 1.00 16.71 +ATOM 2718 O THR A 436 -2.309 71.249 124.453 1.00 16.35 +ATOM 2719 CB THR A 436 -4.489 68.981 123.073 1.00 15.30 +ATOM 2720 OG1 THR A 436 -4.570 70.034 122.110 1.00 16.16 +ATOM 2721 CG2 THR A 436 -5.863 68.375 123.252 1.00 14.06 +ATOM 2722 N ILE A 437 -1.607 69.193 123.909 1.00 16.51 +ATOM 2723 CA ILE A 437 -0.234 69.641 123.724 1.00 16.13 +ATOM 2724 C ILE A 437 0.047 69.752 122.235 1.00 17.06 +ATOM 2725 O ILE A 437 1.160 70.093 121.838 1.00 16.26 +ATOM 2726 CB ILE A 437 0.806 68.641 124.315 1.00 16.53 +ATOM 2727 CG1 ILE A 437 0.811 67.343 123.495 1.00 16.01 +ATOM 2728 CG2 ILE A 437 0.499 68.354 125.774 1.00 14.58 +ATOM 2729 CD1 ILE A 437 1.848 66.329 123.954 1.00 15.11 +ATOM 2730 N TRP A 438 -0.967 69.477 121.416 1.00 16.65 +ATOM 2731 CA TRP A 438 -0.795 69.494 119.964 1.00 17.11 +ATOM 2732 C TRP A 438 -1.835 70.258 119.147 1.00 17.03 +ATOM 2733 O TRP A 438 -2.830 70.761 119.671 1.00 17.40 +ATOM 2734 CB TRP A 438 -0.769 68.053 119.449 1.00 15.54 +ATOM 2735 CG TRP A 438 -1.963 67.267 119.913 1.00 14.22 +ATOM 2736 CD1 TRP A 438 -2.130 66.675 121.131 1.00 12.52 +ATOM 2737 CD2 TRP A 438 -3.191 67.062 119.199 1.00 14.87 +ATOM 2738 NE1 TRP A 438 -3.383 66.119 121.226 1.00 10.82 +ATOM 2739 CE2 TRP A 438 -4.058 66.342 120.056 1.00 12.80 +ATOM 2740 CE3 TRP A 438 -3.647 67.419 117.919 1.00 14.00 +ATOM 2741 CZ2 TRP A 438 -5.351 65.973 119.677 1.00 11.51 +ATOM 2742 CZ3 TRP A 438 -4.944 67.048 117.543 1.00 13.22 +ATOM 2743 CH2 TRP A 438 -5.775 66.335 118.420 1.00 11.52 +ATOM 2744 N THR A 439 -1.577 70.310 117.842 1.00 16.49 +ATOM 2745 CA THR A 439 -2.457 70.945 116.871 1.00 15.92 +ATOM 2746 C THR A 439 -2.370 70.194 115.542 1.00 16.58 +ATOM 2747 O THR A 439 -1.281 70.001 115.009 1.00 16.91 +ATOM 2748 CB THR A 439 -2.061 72.391 116.595 1.00 15.29 +ATOM 2749 OG1 THR A 439 -2.208 73.173 117.780 1.00 14.39 +ATOM 2750 CG2 THR A 439 -2.940 72.957 115.513 1.00 14.97 +ATOM 2751 N SER A 440 -3.512 69.761 115.015 1.00 17.15 +ATOM 2752 CA SER A 440 -3.543 69.068 113.725 1.00 16.55 +ATOM 2753 C SER A 440 -4.903 69.311 113.090 1.00 16.11 +ATOM 2754 O SER A 440 -5.774 69.914 113.714 1.00 16.84 +ATOM 2755 CB SER A 440 -3.303 67.563 113.893 1.00 17.56 +ATOM 2756 OG SER A 440 -3.054 66.951 112.636 1.00 18.05 +ATOM 2757 N GLY A 441 -5.087 68.847 111.857 1.00 15.74 +ATOM 2758 CA GLY A 441 -6.354 69.057 111.189 1.00 14.51 +ATOM 2759 C GLY A 441 -6.837 67.930 110.300 1.00 14.63 +ATOM 2760 O GLY A 441 -6.060 67.101 109.846 1.00 12.90 +ATOM 2761 N SER A 442 -8.147 67.912 110.071 1.00 15.67 +ATOM 2762 CA SER A 442 -8.807 66.928 109.218 1.00 16.36 +ATOM 2763 C SER A 442 -9.310 67.699 108.016 1.00 14.33 +ATOM 2764 O SER A 442 -9.290 68.924 108.033 1.00 14.66 +ATOM 2765 CB SER A 442 -10.009 66.306 109.943 1.00 18.14 +ATOM 2766 OG SER A 442 -9.772 64.940 110.224 1.00 24.18 +ATOM 2767 N SER A 443 -9.776 66.995 106.988 1.00 12.79 +ATOM 2768 CA SER A 443 -10.300 67.666 105.806 1.00 12.42 +ATOM 2769 C SER A 443 -11.604 67.075 105.276 1.00 14.26 +ATOM 2770 O SER A 443 -11.935 65.922 105.538 1.00 14.93 +ATOM 2771 CB SER A 443 -9.254 67.670 104.681 1.00 11.71 +ATOM 2772 OG SER A 443 -9.099 66.396 104.077 1.00 10.69 +ATOM 2773 N ILE A 444 -12.351 67.907 104.552 1.00 15.33 +ATOM 2774 CA ILE A 444 -13.594 67.524 103.891 1.00 13.96 +ATOM 2775 C ILE A 444 -13.604 68.382 102.635 1.00 15.25 +ATOM 2776 O ILE A 444 -12.998 69.455 102.624 1.00 15.91 +ATOM 2777 CB ILE A 444 -14.860 67.834 104.730 1.00 12.56 +ATOM 2778 CG1 ILE A 444 -14.825 69.272 105.239 1.00 12.23 +ATOM 2779 CG2 ILE A 444 -14.995 66.829 105.850 1.00 11.99 +ATOM 2780 CD1 ILE A 444 -16.086 69.684 105.966 1.00 12.55 +ATOM 2781 N SER A 445 -14.254 67.917 101.570 1.00 15.96 +ATOM 2782 CA SER A 445 -14.299 68.700 100.341 1.00 16.51 +ATOM 2783 C SER A 445 -15.623 68.566 99.582 1.00 18.06 +ATOM 2784 O SER A 445 -16.384 67.611 99.783 1.00 17.89 +ATOM 2785 CB SER A 445 -13.147 68.309 99.427 1.00 17.67 +ATOM 2786 OG SER A 445 -13.340 67.007 98.910 1.00 21.51 +ATOM 2787 N PHE A 446 -15.889 69.536 98.706 1.00 18.43 +ATOM 2788 CA PHE A 446 -17.115 69.557 97.926 1.00 18.23 +ATOM 2789 C PHE A 446 -16.860 70.000 96.493 1.00 18.40 +ATOM 2790 O PHE A 446 -15.799 70.534 96.177 1.00 17.43 +ATOM 2791 CB PHE A 446 -18.124 70.508 98.574 1.00 18.88 +ATOM 2792 CG PHE A 446 -18.498 70.133 99.971 1.00 17.68 +ATOM 2793 CD1 PHE A 446 -17.626 70.357 101.027 1.00 17.01 +ATOM 2794 CD2 PHE A 446 -19.712 69.513 100.229 1.00 18.27 +ATOM 2795 CE1 PHE A 446 -17.958 69.963 102.319 1.00 16.33 +ATOM 2796 CE2 PHE A 446 -20.047 69.119 101.521 1.00 16.84 +ATOM 2797 CZ PHE A 446 -19.165 69.345 102.562 1.00 13.17 +ATOM 2798 N CYS A 447 -17.844 69.777 95.629 1.00 19.22 +ATOM 2799 CA CYS A 447 -17.729 70.174 94.233 1.00 20.65 +ATOM 2800 C CYS A 447 -19.001 70.833 93.694 1.00 21.95 +ATOM 2801 O CYS A 447 -20.100 70.558 94.178 1.00 22.24 +ATOM 2802 CB CYS A 447 -17.361 68.970 93.376 1.00 20.85 +ATOM 2803 SG CYS A 447 -15.603 68.492 93.482 1.00 23.69 +ATOM 2804 N GLY A 448 -18.822 71.693 92.689 1.00 22.32 +ATOM 2805 CA GLY A 448 -19.903 72.420 92.050 1.00 22.44 +ATOM 2806 C GLY A 448 -21.251 71.736 91.936 1.00 24.32 +ATOM 2807 O GLY A 448 -22.078 71.855 92.833 1.00 27.25 +ATOM 2808 N VAL A 449 -21.516 71.065 90.825 1.00 23.82 +ATOM 2809 CA VAL A 449 -22.793 70.360 90.669 1.00 23.45 +ATOM 2810 C VAL A 449 -24.037 71.179 90.296 1.00 23.14 +ATOM 2811 O VAL A 449 -24.286 72.247 90.846 1.00 22.19 +ATOM 2812 CB VAL A 449 -23.093 69.522 91.956 1.00 22.32 +ATOM 2813 CG1 VAL A 449 -24.546 69.139 92.041 1.00 21.37 +ATOM 2814 CG2 VAL A 449 -22.236 68.267 91.943 1.00 23.62 +ATOM 2815 N ASN A 450 -24.811 70.642 89.351 1.00 24.63 +ATOM 2816 CA ASN A 450 -26.057 71.250 88.881 1.00 26.27 +ATOM 2817 C ASN A 450 -27.240 70.718 89.649 1.00 25.72 +ATOM 2818 O ASN A 450 -28.127 71.472 90.040 1.00 28.17 +ATOM 2819 CB ASN A 450 -26.310 70.941 87.414 1.00 28.71 +ATOM 2820 CG ASN A 450 -25.764 71.997 86.511 1.00 31.27 +ATOM 2821 OD1 ASN A 450 -25.735 73.180 86.877 1.00 30.52 +ATOM 2822 ND2 ASN A 450 -25.345 71.595 85.308 1.00 32.76 +ATOM 2823 N SER A 451 -27.261 69.404 89.830 1.00 25.34 +ATOM 2824 CA SER A 451 -28.325 68.721 90.555 1.00 24.21 +ATOM 2825 C SER A 451 -28.446 69.326 91.959 1.00 23.33 +ATOM 2826 O SER A 451 -27.673 70.217 92.309 1.00 20.44 +ATOM 2827 CB SER A 451 -27.976 67.241 90.613 1.00 24.75 +ATOM 2828 OG SER A 451 -26.584 67.081 90.398 1.00 22.39 +ATOM 2829 N ASP A 452 -29.385 68.864 92.781 1.00 24.52 +ATOM 2830 CA ASP A 452 -29.457 69.501 94.085 1.00 25.60 +ATOM 2831 C ASP A 452 -28.484 68.974 95.107 1.00 23.71 +ATOM 2832 O ASP A 452 -27.736 68.024 94.879 1.00 21.53 +ATOM 2833 CB ASP A 452 -30.870 69.498 94.674 1.00 29.81 +ATOM 2834 CG ASP A 452 -31.086 70.655 95.694 1.00 34.40 +ATOM 2835 OD1 ASP A 452 -30.427 71.714 95.553 1.00 34.39 +ATOM 2836 OD2 ASP A 452 -31.929 70.518 96.620 1.00 37.38 +ATOM 2837 N THR A 453 -28.507 69.623 96.254 1.00 21.56 +ATOM 2838 CA THR A 453 -27.596 69.293 97.312 1.00 20.12 +ATOM 2839 C THR A 453 -28.351 69.479 98.602 1.00 19.04 +ATOM 2840 O THR A 453 -29.571 69.592 98.591 1.00 18.50 +ATOM 2841 CB THR A 453 -26.409 70.259 97.247 1.00 20.80 +ATOM 2842 OG1 THR A 453 -26.887 71.599 97.420 1.00 21.54 +ATOM 2843 CG2 THR A 453 -25.732 70.170 95.885 1.00 18.62 +ATOM 2844 N VAL A 454 -27.627 69.499 99.710 1.00 18.23 +ATOM 2845 CA VAL A 454 -28.244 69.706 101.004 1.00 18.43 +ATOM 2846 C VAL A 454 -27.229 70.232 101.986 1.00 19.22 +ATOM 2847 O VAL A 454 -26.025 69.986 101.854 1.00 18.55 +ATOM 2848 CB VAL A 454 -28.853 68.411 101.595 1.00 18.44 +ATOM 2849 CG1 VAL A 454 -30.122 68.057 100.848 1.00 21.61 +ATOM 2850 CG2 VAL A 454 -27.839 67.272 101.538 1.00 14.78 +ATOM 2851 N GLY A 455 -27.733 70.972 102.966 1.00 18.91 +ATOM 2852 CA GLY A 455 -26.880 71.518 103.994 1.00 18.96 +ATOM 2853 C GLY A 455 -26.915 70.540 105.148 1.00 19.42 +ATOM 2854 O GLY A 455 -27.929 69.874 105.381 1.00 18.73 +ATOM 2855 N TRP A 456 -25.802 70.449 105.861 1.00 17.78 +ATOM 2856 CA TRP A 456 -25.694 69.556 106.990 1.00 17.54 +ATOM 2857 C TRP A 456 -24.397 69.896 107.718 1.00 18.28 +ATOM 2858 O TRP A 456 -23.840 70.982 107.539 1.00 18.27 +ATOM 2859 CB TRP A 456 -25.686 68.101 106.500 1.00 18.79 +ATOM 2860 CG TRP A 456 -26.125 67.110 107.551 1.00 18.78 +ATOM 2861 CD1 TRP A 456 -27.077 67.308 108.513 1.00 17.66 +ATOM 2862 CD2 TRP A 456 -25.652 65.768 107.728 1.00 18.76 +ATOM 2863 NE1 TRP A 456 -27.225 66.178 109.278 1.00 17.65 +ATOM 2864 CE2 TRP A 456 -26.363 65.216 108.822 1.00 18.65 +ATOM 2865 CE3 TRP A 456 -24.697 64.979 107.075 1.00 18.78 +ATOM 2866 CZ2 TRP A 456 -26.149 63.912 109.276 1.00 16.61 +ATOM 2867 CZ3 TRP A 456 -24.485 63.681 107.526 1.00 19.24 +ATOM 2868 CH2 TRP A 456 -25.210 63.164 108.619 1.00 19.12 +ATOM 2869 N SER A 457 -23.916 68.986 108.552 1.00 16.49 +ATOM 2870 CA SER A 457 -22.674 69.248 109.257 1.00 16.24 +ATOM 2871 C SER A 457 -21.753 68.033 109.248 1.00 15.80 +ATOM 2872 O SER A 457 -22.083 66.994 109.814 1.00 16.67 +ATOM 2873 CB SER A 457 -22.961 69.677 110.695 1.00 14.76 +ATOM 2874 OG SER A 457 -21.768 69.722 111.449 1.00 13.41 +ATOM 2875 N TRP A 458 -20.609 68.176 108.586 1.00 14.23 +ATOM 2876 CA TRP A 458 -19.602 67.124 108.499 1.00 12.86 +ATOM 2877 C TRP A 458 -18.357 67.582 109.248 1.00 13.50 +ATOM 2878 O TRP A 458 -17.375 67.984 108.631 1.00 14.82 +ATOM 2879 CB TRP A 458 -19.217 66.870 107.046 1.00 12.37 +ATOM 2880 CG TRP A 458 -20.275 66.217 106.227 1.00 14.80 +ATOM 2881 CD1 TRP A 458 -20.520 64.877 106.109 1.00 13.56 +ATOM 2882 CD2 TRP A 458 -21.239 66.875 105.399 1.00 14.52 +ATOM 2883 NE1 TRP A 458 -21.572 64.663 105.256 1.00 13.89 +ATOM 2884 CE2 TRP A 458 -22.034 65.873 104.807 1.00 14.44 +ATOM 2885 CE3 TRP A 458 -21.508 68.217 105.099 1.00 13.40 +ATOM 2886 CZ2 TRP A 458 -23.084 66.171 103.932 1.00 15.35 +ATOM 2887 CZ3 TRP A 458 -22.549 68.511 104.229 1.00 12.96 +ATOM 2888 CH2 TRP A 458 -23.321 67.495 103.657 1.00 13.29 +ATOM 2889 N PRO A 459 -18.377 67.526 110.590 1.00 15.50 +ATOM 2890 CA PRO A 459 -17.222 67.951 111.382 1.00 14.90 +ATOM 2891 C PRO A 459 -16.161 66.859 111.571 1.00 17.22 +ATOM 2892 O PRO A 459 -16.344 65.705 111.177 1.00 16.91 +ATOM 2893 CB PRO A 459 -17.861 68.357 112.700 1.00 12.86 +ATOM 2894 CG PRO A 459 -18.880 67.290 112.868 1.00 12.22 +ATOM 2895 CD PRO A 459 -19.486 67.126 111.476 1.00 13.77 +ATOM 2896 N ASP A 460 -15.056 67.248 112.195 1.00 19.12 +ATOM 2897 CA ASP A 460 -13.951 66.344 112.476 1.00 19.62 +ATOM 2898 C ASP A 460 -14.391 65.095 113.256 1.00 19.69 +ATOM 2899 O ASP A 460 -14.047 63.970 112.893 1.00 19.43 +ATOM 2900 CB ASP A 460 -12.894 67.103 113.258 1.00 21.07 +ATOM 2901 CG ASP A 460 -11.822 66.205 113.788 1.00 23.71 +ATOM 2902 OD1 ASP A 460 -11.971 65.738 114.937 1.00 24.86 +ATOM 2903 OD2 ASP A 460 -10.843 65.957 113.046 1.00 25.18 +ATOM 2904 N GLY A 461 -15.142 65.300 114.333 1.00 19.51 +ATOM 2905 CA GLY A 461 -15.628 64.177 115.121 1.00 19.10 +ATOM 2906 C GLY A 461 -14.680 63.532 116.121 1.00 18.15 +ATOM 2907 O GLY A 461 -15.031 62.530 116.742 1.00 17.41 +ATOM 2908 N ALA A 462 -13.479 64.074 116.283 1.00 18.19 +ATOM 2909 CA ALA A 462 -12.541 63.492 117.240 1.00 19.82 +ATOM 2910 C ALA A 462 -12.880 63.991 118.639 1.00 19.93 +ATOM 2911 O ALA A 462 -13.247 65.151 118.802 1.00 19.86 +ATOM 2912 CB ALA A 462 -11.113 63.883 116.887 1.00 18.12 +ATOM 2913 N GLU A 463 -12.786 63.126 119.644 1.00 20.96 +ATOM 2914 CA GLU A 463 -13.067 63.583 120.999 1.00 23.67 +ATOM 2915 C GLU A 463 -11.773 63.826 121.764 1.00 21.83 +ATOM 2916 O GLU A 463 -10.982 62.919 121.977 1.00 20.44 +ATOM 2917 CB GLU A 463 -13.974 62.602 121.769 1.00 27.31 +ATOM 2918 CG GLU A 463 -13.414 61.225 122.048 1.00 32.61 +ATOM 2919 CD GLU A 463 -14.128 60.545 123.224 1.00 36.61 +ATOM 2920 OE1 GLU A 463 -13.908 60.974 124.388 1.00 35.27 +ATOM 2921 OE2 GLU A 463 -14.916 59.590 122.977 1.00 37.46 +ATOM 2922 N LEU A 464 -11.554 65.078 122.147 1.00 22.07 +ATOM 2923 CA LEU A 464 -10.355 65.455 122.890 1.00 21.11 +ATOM 2924 C LEU A 464 -10.642 65.518 124.393 1.00 21.98 +ATOM 2925 O LEU A 464 -11.803 65.628 124.811 1.00 22.06 +ATOM 2926 CB LEU A 464 -9.842 66.808 122.388 1.00 19.05 +ATOM 2927 CG LEU A 464 -9.395 66.819 120.924 1.00 16.37 +ATOM 2928 CD1 LEU A 464 -8.837 68.157 120.522 1.00 13.48 +ATOM 2929 CD2 LEU A 464 -8.347 65.774 120.761 1.00 16.54 +ATOM 2930 N PRO A 465 -9.590 65.427 125.227 1.00 22.07 +ATOM 2931 CA PRO A 465 -8.182 65.280 124.824 1.00 21.69 +ATOM 2932 C PRO A 465 -7.825 63.834 124.495 1.00 21.97 +ATOM 2933 O PRO A 465 -8.625 62.929 124.746 1.00 22.78 +ATOM 2934 CB PRO A 465 -7.428 65.792 126.041 1.00 21.58 +ATOM 2935 CG PRO A 465 -8.308 65.328 127.172 1.00 21.76 +ATOM 2936 CD PRO A 465 -9.697 65.676 126.677 1.00 20.56 +ATOM 2937 N PHE A 466 -6.638 63.625 123.923 1.00 20.78 +ATOM 2938 CA PHE A 466 -6.177 62.277 123.577 1.00 20.66 +ATOM 2939 C PHE A 466 -5.329 61.748 124.717 1.00 20.33 +ATOM 2940 O PHE A 466 -5.068 62.476 125.676 1.00 20.50 +ATOM 2941 CB PHE A 466 -5.341 62.295 122.290 1.00 19.26 +ATOM 2942 CG PHE A 466 -6.156 62.193 121.026 1.00 17.15 +ATOM 2943 CD1 PHE A 466 -7.508 62.532 121.016 1.00 15.68 +ATOM 2944 CD2 PHE A 466 -5.556 61.793 119.829 1.00 15.88 +ATOM 2945 CE1 PHE A 466 -8.253 62.476 119.832 1.00 14.68 +ATOM 2946 CE2 PHE A 466 -6.289 61.733 118.639 1.00 12.39 +ATOM 2947 CZ PHE A 466 -7.638 62.075 118.642 1.00 14.17 +ATOM 2948 N THR A 467 -4.896 60.489 124.611 1.00 21.13 +ATOM 2949 CA THR A 467 -4.057 59.865 125.644 1.00 20.95 +ATOM 2950 C THR A 467 -2.867 60.794 125.895 1.00 22.64 +ATOM 2951 O THR A 467 -2.182 60.696 126.915 1.00 22.22 +ATOM 2952 CB THR A 467 -3.578 58.464 125.201 1.00 19.82 +ATOM 2953 OG1 THR A 467 -4.718 57.641 124.944 1.00 19.26 +ATOM 2954 CG2 THR A 467 -2.751 57.794 126.290 1.00 18.81 +ATOM 2955 N ILE A 468 -2.674 61.710 124.943 1.00 24.65 +ATOM 2956 CA ILE A 468 -1.654 62.756 124.946 1.00 25.17 +ATOM 2957 C ILE A 468 -0.314 62.319 124.383 1.00 27.82 +ATOM 2958 O ILE A 468 0.029 62.799 123.267 1.00 28.32 +ATOM 2959 CB ILE A 468 -1.464 63.356 126.354 1.00 22.13 +ATOM 2960 CG1 ILE A 468 -2.663 64.255 126.711 1.00 21.59 +ATOM 2961 CG2 ILE A 468 -0.182 64.134 126.403 1.00 21.66 +ATOM 2962 CD1 ILE A 468 -2.739 64.663 128.207 1.00 16.55 +TER 2963 ILE A 468 +ATOM 23705 C1 G39 B 500 -3.037 80.824 111.119 1.00 25.76 +ATOM 23706 O1A G39 B 500 -3.596 81.952 111.239 1.00 25.68 +ATOM 23707 O1B G39 B 500 -3.554 79.790 111.655 1.00 25.94 +ATOM 23708 C2 G39 B 500 -1.811 80.746 110.359 1.00 25.07 +ATOM 23709 C3 G39 B 500 -1.010 79.338 110.137 1.00 25.17 +ATOM 23710 C4 G39 B 500 0.112 79.327 109.004 1.00 24.24 +ATOM 23711 C5 G39 B 500 0.945 80.601 109.144 1.00 23.29 +ATOM 23712 N5 G39 B 500 1.987 80.533 108.049 1.00 24.46 +ATOM 23713 C10 G39 B 500 3.297 80.674 108.332 1.00 23.08 +ATOM 23714 O10 G39 B 500 3.766 80.873 109.491 1.00 23.57 +ATOM 23715 C11 G39 B 500 4.243 80.586 107.191 1.00 20.33 +ATOM 23716 C6 G39 B 500 -0.003 81.869 108.959 1.00 24.45 +ATOM 23717 C7 G39 B 500 -1.270 81.929 109.770 1.00 24.63 +ATOM 23718 O7 G39 B 500 0.846 83.091 109.139 1.00 23.32 +ATOM 23719 C8 G39 B 500 1.210 84.046 108.059 1.00 25.45 +ATOM 23720 C9 G39 B 500 0.051 84.703 107.259 1.00 26.89 +ATOM 23721 C81 G39 B 500 2.091 85.080 108.734 1.00 24.61 +ATOM 23722 C82 G39 B 500 3.462 84.549 109.008 1.00 22.43 +ATOM 23723 C91 G39 B 500 -1.010 85.458 108.077 1.00 26.50 +ATOM 23724 N4 G39 B 500 0.933 78.130 109.177 1.00 23.72 +END diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/README.txt b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/README.txt new file mode 100644 index 000000000..16cdb8975 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/README.txt @@ -0,0 +1,6 @@ +################################################################################ +# Information about configuration files present in the same directory # +################################################################################ +"run-prodigy-prot-lig/data/configurations/raw_input.toml": An untouched copy of the raw input file, as provided by the user. +"run-prodigy-prot-lig/data/configurations/cleaned_input.toml": Pre-parsed input file where (eventually) some indexing and modifications were applied to ensure further processing. +"run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.toml": Final input file with detailed default parameters. diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/cleaned_input.toml b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/cleaned_input.toml new file mode 100644 index 000000000..de20674fa --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/cleaned_input.toml @@ -0,0 +1,12 @@ +run_dir = "run-prodigy-prot-lig" +molecules = "data/prot-lig.pdb" + +['topoaa.1'] +ligand_param_fname = "data/ligand-prodrg.param" +ligand_top_fname = "data/ligand-prodrg.top" +delenph = false + +['prodigy.1'] +scoring_mode = "ligand" +ligand_resname = "G39" + diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.json b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.json new file mode 100644 index 000000000..c14c6086c --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.json @@ -0,0 +1,56 @@ +{ + "cns_exec": "", + "ncores": 4, + "max_cpus": true, + "mode": "local", + "batch_type": "slurm", + "queue": "", + "queue_limit": 100, + "concat": 1, + "self_contained": false, + "clean": true, + "offline": false, + "debug": false, + "preprocess": false, + "postprocess": true, + "run_dir": "run-prodigy-prot-lig", + "molecules": [ + "data/prot-lig.pdb" + ], + "topoaa.1": { + "ligand_param_fname": "data/ligand-prodrg.param", + "ligand_top_fname": "data/ligand-prodrg.top", + "delenph": false, + "molecules": [ + "data/prot-lig.pdb" + ], + "mol1": { + "cyclicpept": false, + "nhisd": 0, + "hisd_1": NaN, + "nhise": 0, + "hise_1": NaN + }, + "autohis": true, + "log_level": "quiet", + "iniseed": 917, + "limit": true, + "set_bfactor": true, + "tolerance": 0, + "cyclicpept_dist": 2.0, + "disulphide_dist": 2.2 + }, + "prodigy.1": { + "scoring_mode": "ligand", + "ligand_resname": "G39", + "chains": [ + "A", + "B" + ], + "ligand_chain": "B", + "distance_cutoff": NaN, + "accessibility_cutoff": 0.05, + "temperature": 25.0, + "to_pkd": true + } +} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.toml b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.toml new file mode 100644 index 000000000..f78f93a02 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.toml @@ -0,0 +1,47 @@ +cns_exec = "" +ncores = 4 +max_cpus = true +mode = "local" +batch_type = "slurm" +queue = "" +queue_limit = 100 +concat = 1 +self_contained = false +clean = true +offline = false +debug = false +preprocess = false +postprocess = true +run_dir = "run-prodigy-prot-lig" +molecules = [ "data/prot-lig.pdb",] + +["topoaa.1"] +ligand_param_fname = "data/ligand-prodrg.param" +ligand_top_fname = "data/ligand-prodrg.top" +delenph = false +molecules = [ "data/prot-lig.pdb",] +autohis = true +log_level = "quiet" +iniseed = 917 +limit = true +set_bfactor = true +tolerance = 0 +cyclicpept_dist = 2.0 +disulphide_dist = 2.2 + +["prodigy.1"] +scoring_mode = "ligand" +ligand_resname = "G39" +chains = [ "A", "B",] +ligand_chain = "B" +distance_cutoff = nan +accessibility_cutoff = 0.05 +temperature = 25.0 +to_pkd = true + +["topoaa.1".mol1] +cyclicpept = false +nhisd = 0 +hisd_1 = nan +nhise = 0 +hise_1 = nan diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/raw_input.toml b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/raw_input.toml new file mode 100644 index 000000000..8c0d6253b --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/raw_input.toml @@ -0,0 +1,12 @@ +run_dir = "run-prodigy-prot-lig" +molecules = "data/prot-lig.pdb" + +[topoaa] +ligand_param_fname = "data/ligand-prodrg.param" +ligand_top_fname = "data/ligand-prodrg.top" +delenph = false + +[prodigy] +scoring_mode = "ligand" +ligand_resname = "G39" + diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.pdb b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.pdb new file mode 100644 index 000000000..e2a1bdffa --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.pdb @@ -0,0 +1,3487 @@ +REMARK FILENAME="homotrimer_haddock.pdb" +REMARK Patching histidine 98 to HISD +REMARK Patching histidine 98 to HISD +REMARK Patching histidine 98 to HISD +REMARK DATE:01-Oct-2024 16:32:31 created by user: unknown +REMARK VERSION:1.3U +ATOM 1 N SER A 2 59.765 62.037 75.182 1.00 15.00 A N +ATOM 2 HN SER A 2 60.123 61.199 75.545 1.00 15.00 A H +ATOM 3 CA SER A 2 58.567 61.999 74.352 1.00 15.00 A C +ATOM 4 CB SER A 2 58.695 60.919 73.274 1.00 15.00 A C +ATOM 5 OG SER A 2 58.712 59.622 73.847 1.00 15.00 A O +ATOM 6 HG SER A 2 57.821 59.263 73.850 1.00 15.00 A H +ATOM 7 C SER A 2 57.319 61.757 75.197 1.00 15.00 A C +ATOM 8 O SER A 2 57.404 61.238 76.310 1.00 15.00 A O +ATOM 9 N LYS A 3 56.160 62.139 74.664 1.00 15.00 A N +ATOM 10 HN LYS A 3 56.156 62.550 73.775 1.00 15.00 A H +ATOM 11 CA LYS A 3 54.894 61.962 75.373 1.00 15.00 A C +ATOM 12 CB LYS A 3 54.536 63.226 76.165 1.00 15.00 A C +ATOM 13 CG LYS A 3 54.121 64.410 75.304 1.00 15.00 A C +ATOM 14 CD LYS A 3 53.999 65.688 76.121 1.00 15.00 A C +ATOM 15 CE LYS A 3 55.366 66.241 76.494 1.00 15.00 A C +ATOM 16 NZ LYS A 3 55.282 67.644 76.989 1.00 15.00 A N +ATOM 17 HZ1 LYS A 3 56.225 67.981 77.270 1.00 15.00 A H +ATOM 18 HZ2 LYS A 3 54.648 67.697 77.811 1.00 15.00 A H +ATOM 19 HZ3 LYS A 3 54.914 68.265 76.240 1.00 15.00 A H +ATOM 20 C LYS A 3 53.761 61.588 74.416 1.00 15.00 A C +ATOM 21 O LYS A 3 53.877 61.757 73.203 1.00 15.00 A O +ATOM 22 N THR A 4 52.670 61.076 74.975 1.00 15.00 A N +ATOM 23 HN THR A 4 52.646 60.956 75.947 1.00 15.00 A H +ATOM 24 CA THR A 4 51.506 60.676 74.185 1.00 15.00 A C +ATOM 25 CB THR A 4 50.730 59.539 74.894 1.00 15.00 A C +ATOM 26 OG1 THR A 4 51.499 58.331 74.858 1.00 15.00 A O +ATOM 27 HG1 THR A 4 50.939 57.587 75.099 1.00 15.00 A H +ATOM 28 CG2 THR A 4 49.375 59.291 74.243 1.00 15.00 A C +ATOM 29 C THR A 4 50.559 61.856 73.951 1.00 15.00 A C +ATOM 30 O THR A 4 50.301 62.648 74.859 1.00 15.00 A O +ATOM 31 N ILE A 5 50.054 61.971 72.724 1.00 15.00 A N +ATOM 32 HN ILE A 5 50.321 61.326 72.037 1.00 15.00 A H +ATOM 33 CA ILE A 5 49.113 63.031 72.377 1.00 15.00 A C +ATOM 34 CB ILE A 5 49.372 63.598 70.962 1.00 15.00 A C +ATOM 35 CG1 ILE A 5 50.797 64.150 70.855 1.00 15.00 A C +ATOM 36 CG2 ILE A 5 48.355 64.683 70.630 1.00 15.00 A C +ATOM 37 CD1 ILE A 5 51.146 64.692 69.486 1.00 15.00 A C +ATOM 38 C ILE A 5 47.684 62.497 72.456 1.00 15.00 A C +ATOM 39 O ILE A 5 47.277 61.664 71.645 1.00 15.00 A O +ATOM 40 N ALA A 6 46.934 62.971 73.446 1.00 15.00 A N +ATOM 41 HN ALA A 6 47.314 63.633 74.059 1.00 15.00 A H +ATOM 42 CA ALA A 6 45.556 62.533 73.637 1.00 15.00 A C +ATOM 43 CB ALA A 6 45.420 61.765 74.943 1.00 15.00 A C +ATOM 44 C ALA A 6 44.582 63.706 73.601 1.00 15.00 A C +ATOM 45 O ALA A 6 44.637 64.600 74.446 1.00 15.00 A O +ATOM 46 N THR A 7 43.688 63.689 72.617 1.00 15.00 A N +ATOM 47 HN THR A 7 43.702 62.949 71.974 1.00 15.00 A H +ATOM 48 CA THR A 7 42.692 64.741 72.462 1.00 15.00 A C +ATOM 49 CB THR A 7 43.093 65.768 71.377 1.00 15.00 A C +ATOM 50 OG1 THR A 7 42.064 66.755 71.230 1.00 15.00 A O +ATOM 51 HG1 THR A 7 42.378 67.466 70.667 1.00 15.00 A H +ATOM 52 CG2 THR A 7 43.342 65.089 70.038 1.00 15.00 A C +ATOM 53 C THR A 7 41.310 64.161 72.155 1.00 15.00 A C +ATOM 54 O THR A 7 41.182 63.143 71.473 1.00 15.00 A O +ATOM 55 N GLU A 8 40.281 64.824 72.673 1.00 15.00 A N +ATOM 56 HN GLU A 8 40.457 65.625 73.211 1.00 15.00 A H +ATOM 57 CA GLU A 8 38.896 64.403 72.473 1.00 15.00 A C +ATOM 58 CB GLU A 8 38.014 64.957 73.602 1.00 15.00 A C +ATOM 59 CG GLU A 8 37.682 66.444 73.479 1.00 15.00 A C +ATOM 60 CD GLU A 8 38.722 67.367 74.098 1.00 15.00 A C +ATOM 61 OE1 GLU A 8 39.841 66.900 74.400 1.00 15.00 A O +ATOM 62 OE2 GLU A 8 38.415 68.563 74.277 1.00 15.00 A O +ATOM 63 C GLU A 8 38.368 64.890 71.125 1.00 15.00 A C +ATOM 64 O GLU A 8 37.280 64.506 70.693 1.00 15.00 A O +ATOM 65 N ASN A 9 39.158 65.732 70.467 1.00 15.00 A N +ATOM 66 HN ASN A 9 40.020 65.979 70.862 1.00 15.00 A H +ATOM 67 CA ASN A 9 38.785 66.293 69.175 1.00 15.00 A C +ATOM 68 CB ASN A 9 39.493 67.633 68.963 1.00 15.00 A C +ATOM 69 CG ASN A 9 39.035 68.677 69.964 1.00 15.00 A C +ATOM 70 OD1 ASN A 9 37.852 68.757 70.297 1.00 15.00 A O +ATOM 71 ND2 ASN A 9 39.972 69.476 70.466 1.00 15.00 A N +ATOM 72 HD21 ASN A 9 40.895 69.351 70.166 1.00 15.00 A H +ATOM 73 HD22 ASN A 9 39.698 70.156 71.117 1.00 15.00 A H +ATOM 74 C ASN A 9 39.071 65.320 68.033 1.00 15.00 A C +ATOM 75 O ASN A 9 38.744 65.586 66.878 1.00 15.00 A O +ATOM 76 N ALA A 10 39.688 64.194 68.375 1.00 15.00 A N +ATOM 77 HN ALA A 10 39.943 64.058 69.311 1.00 15.00 A H +ATOM 78 CA ALA A 10 40.001 63.155 67.403 1.00 15.00 A C +ATOM 79 CB ALA A 10 41.507 63.074 67.190 1.00 15.00 A C +ATOM 80 C ALA A 10 39.456 61.818 67.901 1.00 15.00 A C +ATOM 81 O ALA A 10 39.285 61.637 69.108 1.00 15.00 A O +ATOM 82 N PRO A 11 39.151 60.872 66.983 1.00 15.00 A N +ATOM 83 CA PRO A 11 38.631 59.545 67.345 1.00 15.00 A C +ATOM 84 CB PRO A 11 38.715 58.764 66.034 1.00 15.00 A C +ATOM 85 CG PRO A 11 38.599 59.806 64.979 1.00 15.00 A C +ATOM 86 CD PRO A 11 39.277 61.031 65.524 1.00 15.00 A C +ATOM 87 C PRO A 11 39.491 58.876 68.412 1.00 15.00 A C +ATOM 88 O PRO A 11 40.707 58.752 68.252 1.00 15.00 A O +ATOM 89 N ALA A 12 38.846 58.455 69.498 1.00 15.00 A N +ATOM 90 HN ALA A 12 37.874 58.578 69.547 1.00 15.00 A H +ATOM 91 CA ALA A 12 39.532 57.818 70.619 1.00 15.00 A C +ATOM 92 CB ALA A 12 38.536 57.447 71.707 1.00 15.00 A C +ATOM 93 C ALA A 12 40.340 56.595 70.195 1.00 15.00 A C +ATOM 94 O ALA A 12 39.880 55.773 69.400 1.00 15.00 A O +ATOM 95 N ALA A 13 41.553 56.494 70.732 1.00 15.00 A N +ATOM 96 HN ALA A 13 41.861 57.193 71.346 1.00 15.00 A H +ATOM 97 CA ALA A 13 42.439 55.375 70.437 1.00 15.00 A C +ATOM 98 CB ALA A 13 43.881 55.767 70.721 1.00 15.00 A C +ATOM 99 C ALA A 13 42.037 54.151 71.258 1.00 15.00 A C +ATOM 100 O ALA A 13 42.488 53.971 72.389 1.00 15.00 A O +ATOM 101 N ILE A 14 41.177 53.319 70.677 1.00 15.00 A N +ATOM 102 HN ILE A 14 40.867 53.518 69.770 1.00 15.00 A H +ATOM 103 CA ILE A 14 40.680 52.122 71.348 1.00 15.00 A C +ATOM 104 CB ILE A 14 39.292 51.711 70.805 1.00 15.00 A C +ATOM 105 CG1 ILE A 14 38.313 52.886 70.907 1.00 15.00 A C +ATOM 106 CG2 ILE A 14 38.755 50.503 71.560 1.00 15.00 A C +ATOM 107 CD1 ILE A 14 36.987 52.648 70.222 1.00 15.00 A C +ATOM 108 C ILE A 14 41.644 50.944 71.220 1.00 15.00 A C +ATOM 109 O ILE A 14 41.882 50.220 72.188 1.00 15.00 A O +ATOM 110 N GLY A 15 42.198 50.753 70.025 1.00 15.00 A N +ATOM 111 HN GLY A 15 41.982 51.366 69.290 1.00 15.00 A H +ATOM 112 CA GLY A 15 43.122 49.654 69.804 1.00 15.00 A C +ATOM 113 C GLY A 15 44.475 49.887 70.449 1.00 15.00 A C +ATOM 114 O GLY A 15 44.650 50.854 71.194 1.00 15.00 A O +ATOM 115 N PRO A 16 45.456 49.006 70.189 1.00 15.00 A N +ATOM 116 CA PRO A 16 46.799 49.139 70.749 1.00 15.00 A C +ATOM 117 CB PRO A 16 47.410 47.751 70.554 1.00 15.00 A C +ATOM 118 CG PRO A 16 46.670 47.151 69.404 1.00 15.00 A C +ATOM 119 CD PRO A 16 45.316 47.807 69.345 1.00 15.00 A C +ATOM 120 C PRO A 16 47.624 50.206 70.027 1.00 15.00 A C +ATOM 121 O PRO A 16 48.583 49.898 69.318 1.00 15.00 A O +ATOM 122 N TYR A 17 47.237 51.466 70.223 1.00 15.00 A N +ATOM 123 HN TYR A 17 46.465 51.638 70.803 1.00 15.00 A H +ATOM 124 CA TYR A 17 47.918 52.596 69.603 1.00 15.00 A C +ATOM 125 CB TYR A 17 47.613 52.641 68.097 1.00 15.00 A C +ATOM 126 CG TYR A 17 46.170 52.976 67.776 1.00 15.00 A C +ATOM 127 CD1 TYR A 17 45.779 54.285 67.517 1.00 15.00 A C +ATOM 128 CD2 TYR A 17 45.197 51.986 67.738 1.00 15.00 A C +ATOM 129 CE1 TYR A 17 44.461 54.598 67.245 1.00 15.00 A C +ATOM 130 CE2 TYR A 17 43.879 52.289 67.460 1.00 15.00 A C +ATOM 131 CZ TYR A 17 43.516 53.595 67.214 1.00 15.00 A C +ATOM 132 OH TYR A 17 42.202 53.901 66.947 1.00 15.00 A O +ATOM 133 HH TYR A 17 42.162 54.583 66.273 1.00 15.00 A H +ATOM 134 C TYR A 17 47.467 53.908 70.238 1.00 15.00 A C +ATOM 135 O TYR A 17 46.443 53.961 70.917 1.00 15.00 A O +ATOM 136 N VAL A 18 48.251 54.956 70.023 1.00 15.00 A N +ATOM 137 HN VAL A 18 49.082 54.834 69.519 1.00 15.00 A H +ATOM 138 CA VAL A 18 47.915 56.285 70.522 1.00 15.00 A C +ATOM 139 CB VAL A 18 49.036 56.890 71.396 1.00 15.00 A C +ATOM 140 CG1 VAL A 18 49.183 56.107 72.691 1.00 15.00 A C +ATOM 141 CG2 VAL A 18 50.355 56.941 70.637 1.00 15.00 A C +ATOM 142 C VAL A 18 47.642 57.199 69.333 1.00 15.00 A C +ATOM 143 O VAL A 18 48.097 56.918 68.229 1.00 15.00 A O +ATOM 144 N GLN A 19 46.895 58.277 69.551 1.00 15.00 A N +ATOM 145 HN GLN A 19 46.552 58.448 70.453 1.00 15.00 A H +ATOM 146 CA GLN A 19 46.563 59.212 68.472 1.00 15.00 A C +ATOM 147 CB GLN A 19 45.624 60.305 68.973 1.00 15.00 A C +ATOM 148 CG GLN A 19 44.222 59.819 69.300 1.00 15.00 A C +ATOM 149 CD GLN A 19 43.424 60.855 70.061 1.00 15.00 A C +ATOM 150 OE1 GLN A 19 43.987 61.655 70.801 1.00 15.00 A O +ATOM 151 NE2 GLN A 19 42.111 60.848 69.884 1.00 15.00 A N +ATOM 152 HE21 GLN A 19 41.729 60.180 69.276 1.00 15.00 A H +ATOM 153 HE22 GLN A 19 41.575 61.513 70.367 1.00 15.00 A H +ATOM 154 C GLN A 19 47.804 59.832 67.828 1.00 15.00 A C +ATOM 155 O GLN A 19 47.857 60.008 66.612 1.00 15.00 A O +ATOM 156 N GLY A 20 48.797 60.158 68.648 1.00 15.00 A N +ATOM 157 HN GLY A 20 48.700 59.990 69.608 1.00 15.00 A H +ATOM 158 CA GLY A 20 50.021 60.752 68.142 1.00 15.00 A C +ATOM 159 C GLY A 20 51.104 60.808 69.199 1.00 15.00 A C +ATOM 160 O GLY A 20 50.857 60.478 70.358 1.00 15.00 A O +ATOM 161 N VAL A 21 52.306 61.224 68.806 1.00 15.00 A N +ATOM 162 HN VAL A 21 52.446 61.471 67.868 1.00 15.00 A H +ATOM 163 CA VAL A 21 53.421 61.312 69.744 1.00 15.00 A C +ATOM 164 CB VAL A 21 54.423 60.145 69.589 1.00 15.00 A C +ATOM 165 CG1 VAL A 21 53.849 58.860 70.169 1.00 15.00 A C +ATOM 166 CG2 VAL A 21 54.816 59.951 68.130 1.00 15.00 A C +ATOM 167 C VAL A 21 54.171 62.639 69.643 1.00 15.00 A C +ATOM 168 O VAL A 21 54.460 63.130 68.551 1.00 15.00 A O +ATOM 169 N ASP A 22 54.470 63.210 70.803 1.00 15.00 A N +ATOM 170 HN ASP A 22 54.181 62.774 71.631 1.00 15.00 A H +ATOM 171 CA ASP A 22 55.207 64.463 70.892 1.00 15.00 A C +ATOM 172 CB ASP A 22 54.546 65.368 71.941 1.00 15.00 A C +ATOM 173 CG ASP A 22 55.097 66.783 71.980 1.00 15.00 A C +ATOM 174 OD1 ASP A 22 54.507 67.621 72.693 1.00 15.00 A O +ATOM 175 OD2 ASP A 22 56.113 67.057 71.307 1.00 15.00 A O +ATOM 176 C ASP A 22 56.647 64.153 71.292 1.00 15.00 A C +ATOM 177 O ASP A 22 56.934 63.897 72.460 1.00 15.00 A O +ATOM 178 N LEU A 23 57.546 64.170 70.313 1.00 15.00 A N +ATOM 179 HN LEU A 23 57.256 64.398 69.405 1.00 15.00 A H +ATOM 180 CA LEU A 23 58.956 63.864 70.555 1.00 15.00 A C +ATOM 181 CB LEU A 23 59.529 63.075 69.374 1.00 15.00 A C +ATOM 182 CG LEU A 23 58.592 62.059 68.719 1.00 15.00 A C +ATOM 183 CD1 LEU A 23 59.205 61.514 67.441 1.00 15.00 A C +ATOM 184 CD2 LEU A 23 58.266 60.930 69.682 1.00 15.00 A C +ATOM 185 C LEU A 23 59.779 65.131 70.764 1.00 15.00 A C +ATOM 186 O LEU A 23 61.007 65.110 70.656 1.00 15.00 A O +ATOM 187 N GLY A 24 59.102 66.228 71.072 1.00 15.00 A N +ATOM 188 HN GLY A 24 58.127 66.185 71.158 1.00 15.00 A H +ATOM 189 CA GLY A 24 59.789 67.485 71.275 1.00 15.00 A C +ATOM 190 C GLY A 24 59.585 68.410 70.099 1.00 15.00 A C +ATOM 191 O GLY A 24 58.560 69.072 70.002 1.00 15.00 A O +ATOM 192 N ASN A 25 60.552 68.441 69.190 1.00 15.00 A N +ATOM 193 HN ASN A 25 61.347 67.882 69.315 1.00 15.00 A H +ATOM 194 CA ASN A 25 60.455 69.288 68.009 1.00 15.00 A C +ATOM 195 CB ASN A 25 61.847 69.578 67.436 1.00 15.00 A C +ATOM 196 CG ASN A 25 61.801 70.428 66.178 1.00 15.00 A C +ATOM 197 OD1 ASN A 25 61.381 71.583 66.214 1.00 15.00 A O +ATOM 198 ND2 ASN A 25 62.235 69.859 65.060 1.00 15.00 A N +ATOM 199 HD21 ASN A 25 62.558 68.934 65.105 1.00 15.00 A H +ATOM 200 HD22 ASN A 25 62.216 70.386 64.233 1.00 15.00 A H +ATOM 201 C ASN A 25 59.569 68.644 66.948 1.00 15.00 A C +ATOM 202 O ASN A 25 58.831 69.329 66.245 1.00 15.00 A O +ATOM 203 N MET A 26 59.633 67.319 66.853 1.00 15.00 A N +ATOM 204 HN MET A 26 60.220 66.823 67.461 1.00 15.00 A H +ATOM 205 CA MET A 26 58.846 66.589 65.870 1.00 15.00 A C +ATOM 206 CB MET A 26 59.713 65.558 65.143 1.00 15.00 A C +ATOM 207 CG MET A 26 58.960 64.714 64.128 1.00 15.00 A C +ATOM 208 SD MET A 26 60.044 63.655 63.155 1.00 15.00 A S +ATOM 209 CE MET A 26 60.944 64.874 62.204 1.00 15.00 A C +ATOM 210 C MET A 26 57.624 65.913 66.487 1.00 15.00 A C +ATOM 211 O MET A 26 57.700 65.310 67.556 1.00 15.00 A O +ATOM 212 N ILE A 27 56.499 66.034 65.792 1.00 15.00 A N +ATOM 213 HN ILE A 27 56.516 66.547 64.958 1.00 15.00 A H +ATOM 214 CA ILE A 27 55.240 65.434 66.214 1.00 15.00 A C +ATOM 215 CB ILE A 27 54.162 66.519 66.490 1.00 15.00 A C +ATOM 216 CG1 ILE A 27 54.263 67.032 67.930 1.00 15.00 A C +ATOM 217 CG2 ILE A 27 52.753 66.012 66.202 1.00 15.00 A C +ATOM 218 CD1 ILE A 27 55.306 68.109 68.131 1.00 15.00 A C +ATOM 219 C ILE A 27 54.762 64.472 65.126 1.00 15.00 A C +ATOM 220 O ILE A 27 54.687 64.838 63.955 1.00 15.00 A O +ATOM 221 N ILE A 28 54.464 63.237 65.509 1.00 15.00 A N +ATOM 222 HN ILE A 28 54.544 62.994 66.455 1.00 15.00 A H +ATOM 223 CA ILE A 28 54.011 62.238 64.549 1.00 15.00 A C +ATOM 224 CB ILE A 28 55.001 61.058 64.439 1.00 15.00 A C +ATOM 225 CG1 ILE A 28 56.423 61.582 64.202 1.00 15.00 A C +ATOM 226 CG2 ILE A 28 54.587 60.122 63.312 1.00 15.00 A C +ATOM 227 CD1 ILE A 28 57.488 60.509 64.220 1.00 15.00 A C +ATOM 228 C ILE A 28 52.623 61.718 64.902 1.00 15.00 A C +ATOM 229 O ILE A 28 52.389 61.245 66.009 1.00 15.00 A O +ATOM 230 N THR A 29 51.706 61.812 63.945 1.00 15.00 A N +ATOM 231 HN THR A 29 51.961 62.188 63.078 1.00 15.00 A H +ATOM 232 CA THR A 29 50.334 61.364 64.148 1.00 15.00 A C +ATOM 233 CB THR A 29 49.326 62.344 63.506 1.00 15.00 A C +ATOM 234 OG1 THR A 29 49.270 62.120 62.090 1.00 15.00 A O +ATOM 235 HG1 THR A 29 48.729 62.798 61.680 1.00 15.00 A H +ATOM 236 CG2 THR A 29 49.737 63.786 63.765 1.00 15.00 A C +ATOM 237 C THR A 29 50.118 59.981 63.541 1.00 15.00 A C +ATOM 238 O THR A 29 50.876 59.549 62.670 1.00 15.00 A O +ATOM 239 N SER A 30 49.089 59.288 64.012 1.00 15.00 A N +ATOM 240 HN SER A 30 48.538 59.674 64.727 1.00 15.00 A H +ATOM 241 CA SER A 30 48.759 57.966 63.494 1.00 15.00 A C +ATOM 242 CB SER A 30 47.953 57.180 64.528 1.00 15.00 A C +ATOM 243 OG SER A 30 48.725 56.923 65.681 1.00 15.00 A O +ATOM 244 HG SER A 30 48.166 56.985 66.462 1.00 15.00 A H +ATOM 245 C SER A 30 47.935 58.104 62.224 1.00 15.00 A C +ATOM 246 O SER A 30 47.456 59.196 61.911 1.00 15.00 A O +ATOM 247 N GLY A 31 47.785 57.002 61.489 1.00 15.00 A N +ATOM 248 HN GLY A 31 48.227 56.172 61.769 1.00 15.00 A H +ATOM 249 CA GLY A 31 46.985 57.025 60.278 1.00 15.00 A C +ATOM 250 C GLY A 31 45.551 57.386 60.598 1.00 15.00 A C +ATOM 251 O GLY A 31 44.807 56.570 61.143 1.00 15.00 A O +ATOM 252 N GLN A 32 45.167 58.615 60.272 1.00 15.00 A N +ATOM 253 HN GLN A 32 45.800 59.211 59.817 1.00 15.00 A H +ATOM 254 CA GLN A 32 43.827 59.096 60.566 1.00 15.00 A C +ATOM 255 CB GLN A 32 43.817 60.615 60.755 1.00 15.00 A C +ATOM 256 CG GLN A 32 44.532 61.114 62.002 1.00 15.00 A C +ATOM 257 CD GLN A 32 44.168 60.336 63.251 1.00 15.00 A C +ATOM 258 OE1 GLN A 32 43.053 60.443 63.763 1.00 15.00 A O +ATOM 259 NE2 GLN A 32 45.124 59.573 63.768 1.00 15.00 A N +ATOM 260 HE21 GLN A 32 45.995 59.557 63.318 1.00 15.00 A H +ATOM 261 HE22 GLN A 32 44.922 59.062 64.578 1.00 15.00 A H +ATOM 262 C GLN A 32 42.811 58.712 59.504 1.00 15.00 A C +ATOM 263 O GLN A 32 42.968 59.035 58.327 1.00 15.00 A O +ATOM 264 N ILE A 33 41.770 58.016 59.938 1.00 15.00 A N +ATOM 265 HN ILE A 33 41.727 57.763 60.884 1.00 15.00 A H +ATOM 266 CA ILE A 33 40.693 57.618 59.049 1.00 15.00 A C +ATOM 267 CB ILE A 33 40.232 56.164 59.302 1.00 15.00 A C +ATOM 268 CG1 ILE A 33 39.904 55.935 60.780 1.00 15.00 A C +ATOM 269 CG2 ILE A 33 41.299 55.186 58.829 1.00 15.00 A C +ATOM 270 CD1 ILE A 33 39.412 54.536 61.088 1.00 15.00 A C +ATOM 271 C ILE A 33 39.533 58.605 59.207 1.00 15.00 A C +ATOM 272 O ILE A 33 39.474 59.326 60.204 1.00 15.00 A O +ATOM 273 N PRO A 34 38.614 58.670 58.225 1.00 15.00 A N +ATOM 274 CA PRO A 34 37.474 59.605 58.248 1.00 15.00 A C +ATOM 275 CB PRO A 34 36.907 59.495 56.833 1.00 15.00 A C +ATOM 276 CG PRO A 34 37.287 58.127 56.388 1.00 15.00 A C +ATOM 277 CD PRO A 34 38.628 57.855 56.998 1.00 15.00 A C +ATOM 278 C PRO A 34 36.382 59.287 59.277 1.00 15.00 A C +ATOM 279 O PRO A 34 35.200 59.233 58.937 1.00 15.00 A O +ATOM 280 N VAL A 35 36.767 59.106 60.534 1.00 15.00 A N +ATOM 281 HN VAL A 35 37.720 59.158 60.755 1.00 15.00 A H +ATOM 282 CA VAL A 35 35.801 58.826 61.591 1.00 15.00 A C +ATOM 283 CB VAL A 35 36.303 57.724 62.552 1.00 15.00 A C +ATOM 284 CG1 VAL A 35 35.375 57.581 63.752 1.00 15.00 A C +ATOM 285 CG2 VAL A 35 36.420 56.399 61.819 1.00 15.00 A C +ATOM 286 C VAL A 35 35.497 60.097 62.381 1.00 15.00 A C +ATOM 287 O VAL A 35 36.407 60.757 62.883 1.00 15.00 A O +ATOM 288 N ASN A 36 34.215 60.444 62.463 1.00 15.00 A N +ATOM 289 HN ASN A 36 33.542 59.892 62.014 1.00 15.00 A H +ATOM 290 CA ASN A 36 33.786 61.626 63.200 1.00 15.00 A C +ATOM 291 CB ASN A 36 32.310 61.924 62.899 1.00 15.00 A C +ATOM 292 CG ASN A 36 31.863 63.308 63.342 1.00 15.00 A C +ATOM 293 OD1 ASN A 36 32.119 63.731 64.464 1.00 15.00 A O +ATOM 294 ND2 ASN A 36 31.192 64.026 62.450 1.00 15.00 A N +ATOM 295 HD21 ASN A 36 31.025 63.631 61.569 1.00 15.00 A H +ATOM 296 HD22 ASN A 36 30.891 64.922 62.710 1.00 15.00 A H +ATOM 297 C ASN A 36 33.994 61.397 64.697 1.00 15.00 A C +ATOM 298 O ASN A 36 33.482 60.437 65.255 1.00 15.00 A O +ATOM 299 N PRO A 37 34.773 62.264 65.360 1.00 15.00 A N +ATOM 300 CA PRO A 37 35.048 62.138 66.800 1.00 15.00 A C +ATOM 301 CB PRO A 37 36.106 63.219 67.049 1.00 15.00 A C +ATOM 302 CG PRO A 37 35.893 64.213 65.958 1.00 15.00 A C +ATOM 303 CD PRO A 37 35.460 63.423 64.761 1.00 15.00 A C +ATOM 304 C PRO A 37 33.820 62.395 67.680 1.00 15.00 A C +ATOM 305 O PRO A 37 33.795 62.009 68.848 1.00 15.00 A O +ATOM 306 N LYS A 38 32.801 63.032 67.108 1.00 15.00 A N +ATOM 307 HN LYS A 38 32.869 63.287 66.165 1.00 15.00 A H +ATOM 308 CA LYS A 38 31.583 63.362 67.845 1.00 15.00 A C +ATOM 309 CB LYS A 38 31.037 64.712 67.372 1.00 15.00 A C +ATOM 310 CG LYS A 38 29.759 65.158 68.064 1.00 15.00 A C +ATOM 311 CD LYS A 38 29.195 66.415 67.426 1.00 15.00 A C +ATOM 312 CE LYS A 38 30.150 67.591 67.570 1.00 15.00 A C +ATOM 313 NZ LYS A 38 30.411 67.921 68.998 1.00 15.00 A N +ATOM 314 HZ1 LYS A 38 30.811 67.096 69.488 1.00 15.00 A H +ATOM 315 HZ2 LYS A 38 29.524 68.192 69.469 1.00 15.00 A H +ATOM 316 HZ3 LYS A 38 31.083 68.713 69.067 1.00 15.00 A H +ATOM 317 C LYS A 38 30.499 62.285 67.734 1.00 15.00 A C +ATOM 318 O LYS A 38 29.796 62.010 68.707 1.00 15.00 A O +ATOM 319 N THR A 39 30.359 61.678 66.558 1.00 15.00 A N +ATOM 320 HN THR A 39 30.954 61.916 65.817 1.00 15.00 A H +ATOM 321 CA THR A 39 29.332 60.653 66.359 1.00 15.00 A C +ATOM 322 CB THR A 39 28.415 60.975 65.159 1.00 15.00 A C +ATOM 323 OG1 THR A 39 29.189 61.063 63.955 1.00 15.00 A O +ATOM 324 HG1 THR A 39 28.677 60.717 63.220 1.00 15.00 A H +ATOM 325 CG2 THR A 39 27.675 62.286 65.380 1.00 15.00 A C +ATOM 326 C THR A 39 29.927 59.261 66.174 1.00 15.00 A C +ATOM 327 O THR A 39 29.299 58.259 66.511 1.00 15.00 A O +ATOM 328 N GLY A 40 31.139 59.207 65.638 1.00 15.00 A N +ATOM 329 HN GLY A 40 31.597 60.041 65.401 1.00 15.00 A H +ATOM 330 CA GLY A 40 31.793 57.932 65.401 1.00 15.00 A C +ATOM 331 C GLY A 40 31.433 57.366 64.042 1.00 15.00 A C +ATOM 332 O GLY A 40 31.812 56.244 63.706 1.00 15.00 A O +ATOM 333 N GLU A 41 30.703 58.159 63.258 1.00 15.00 A N +ATOM 334 HN GLU A 41 30.452 59.048 63.585 1.00 15.00 A H +ATOM 335 CA GLU A 41 30.264 57.748 61.930 1.00 15.00 A C +ATOM 336 CB GLU A 41 28.882 58.329 61.624 1.00 15.00 A C +ATOM 337 CG GLU A 41 27.799 57.950 62.620 1.00 15.00 A C +ATOM 338 CD GLU A 41 26.459 58.563 62.269 1.00 15.00 A C +ATOM 339 OE1 GLU A 41 26.444 59.708 61.768 1.00 15.00 A O +ATOM 340 OE2 GLU A 41 25.424 57.902 62.495 1.00 15.00 A O +ATOM 341 C GLU A 41 31.242 58.197 60.854 1.00 15.00 A C +ATOM 342 O GLU A 41 32.055 59.095 61.067 1.00 15.00 A O +ATOM 343 N VAL A 42 31.143 57.567 59.689 1.00 15.00 A N +ATOM 344 HN VAL A 42 30.470 56.862 59.586 1.00 15.00 A H +ATOM 345 CA VAL A 42 32.005 57.891 58.559 1.00 15.00 A C +ATOM 346 CB VAL A 42 32.838 56.664 58.120 1.00 15.00 A C +ATOM 347 CG1 VAL A 42 33.705 56.994 56.913 1.00 15.00 A C +ATOM 348 CG2 VAL A 42 33.695 56.155 59.268 1.00 15.00 A C +ATOM 349 C VAL A 42 31.174 58.382 57.375 1.00 15.00 A C +ATOM 350 O VAL A 42 30.258 57.693 56.926 1.00 15.00 A O +ATOM 351 N PRO A 43 31.475 59.593 56.865 1.00 15.00 A N +ATOM 352 CA PRO A 43 30.763 60.171 55.716 1.00 15.00 A C +ATOM 353 CB PRO A 43 31.434 61.538 55.527 1.00 15.00 A C +ATOM 354 CG PRO A 43 32.750 61.421 56.217 1.00 15.00 A C +ATOM 355 CD PRO A 43 32.526 60.491 57.371 1.00 15.00 A C +ATOM 356 C PRO A 43 30.947 59.320 54.460 1.00 15.00 A C +ATOM 357 O PRO A 43 32.009 58.744 54.246 1.00 15.00 A O +ATOM 358 N ALA A 44 29.905 59.234 53.640 1.00 15.00 A N +ATOM 359 HN ALA A 44 29.079 59.710 53.864 1.00 15.00 A H +ATOM 360 CA ALA A 44 29.962 58.445 52.413 1.00 15.00 A C +ATOM 361 CB ALA A 44 28.563 58.160 51.890 1.00 15.00 A C +ATOM 362 C ALA A 44 30.802 59.133 51.343 1.00 15.00 A C +ATOM 363 O ALA A 44 31.618 58.492 50.681 1.00 15.00 A O +ATOM 364 N ASP A 45 30.596 60.441 51.182 1.00 15.00 A N +ATOM 365 HN ASP A 45 29.927 60.888 51.742 1.00 15.00 A H +ATOM 366 CA ASP A 45 31.330 61.225 50.193 1.00 15.00 A C +ATOM 367 CB ASP A 45 30.873 62.686 50.235 1.00 15.00 A C +ATOM 368 CG ASP A 45 31.435 63.511 49.096 1.00 15.00 A C +ATOM 369 OD1 ASP A 45 32.291 64.376 49.362 1.00 15.00 A O +ATOM 370 OD2 ASP A 45 31.020 63.291 47.939 1.00 15.00 A O +ATOM 371 C ASP A 45 32.837 61.129 50.424 1.00 15.00 A C +ATOM 372 O ASP A 45 33.308 61.225 51.558 1.00 15.00 A O +ATOM 373 N VAL A 46 33.585 60.935 49.339 1.00 15.00 A N +ATOM 374 HN VAL A 46 33.149 60.886 48.465 1.00 15.00 A H +ATOM 375 CA VAL A 46 35.038 60.803 49.414 1.00 15.00 A C +ATOM 376 CB VAL A 46 35.633 60.219 48.110 1.00 15.00 A C +ATOM 377 CG1 VAL A 46 35.454 61.172 46.936 1.00 15.00 A C +ATOM 378 CG2 VAL A 46 37.094 59.837 48.293 1.00 15.00 A C +ATOM 379 C VAL A 46 35.719 62.125 49.776 1.00 15.00 A C +ATOM 380 O VAL A 46 36.739 62.134 50.466 1.00 15.00 A O +ATOM 381 N ALA A 47 35.146 63.240 49.320 1.00 15.00 A N +ATOM 382 HN ALA A 47 34.334 63.173 48.775 1.00 15.00 A H +ATOM 383 CA ALA A 47 35.697 64.558 49.619 1.00 15.00 A C +ATOM 384 CB ALA A 47 35.053 65.625 48.747 1.00 15.00 A C +ATOM 385 C ALA A 47 35.493 64.881 51.092 1.00 15.00 A C +ATOM 386 O ALA A 47 36.340 65.512 51.725 1.00 15.00 A O +ATOM 387 N ALA A 48 34.359 64.433 51.629 1.00 15.00 A N +ATOM 388 HN ALA A 48 33.721 63.952 51.060 1.00 15.00 A H +ATOM 389 CA ALA A 48 34.039 64.642 53.034 1.00 15.00 A C +ATOM 390 CB ALA A 48 32.566 64.364 53.292 1.00 15.00 A C +ATOM 391 C ALA A 48 34.916 63.748 53.904 1.00 15.00 A C +ATOM 392 O ALA A 48 35.259 64.104 55.030 1.00 15.00 A O +ATOM 393 N GLN A 49 35.278 62.581 53.363 1.00 15.00 A N +ATOM 394 HN GLN A 49 34.954 62.351 52.466 1.00 15.00 A H +ATOM 395 CA GLN A 49 36.136 61.637 54.068 1.00 15.00 A C +ATOM 396 CB GLN A 49 36.142 60.277 53.365 1.00 15.00 A C +ATOM 397 CG GLN A 49 34.964 59.386 53.717 1.00 15.00 A C +ATOM 398 CD GLN A 49 35.216 57.928 53.385 1.00 15.00 A C +ATOM 399 OE1 GLN A 49 36.358 57.474 53.371 1.00 15.00 A O +ATOM 400 NE2 GLN A 49 34.149 57.183 53.129 1.00 15.00 A N +ATOM 401 HE21 GLN A 49 33.267 57.609 53.167 1.00 15.00 A H +ATOM 402 HE22 GLN A 49 34.286 56.236 52.917 1.00 15.00 A H +ATOM 403 C GLN A 49 37.558 62.175 54.154 1.00 15.00 A C +ATOM 404 O GLN A 49 38.239 61.998 55.164 1.00 15.00 A O +ATOM 405 N ALA A 50 37.996 62.835 53.085 1.00 15.00 A N +ATOM 406 HN ALA A 50 37.403 62.934 52.310 1.00 15.00 A H +ATOM 407 CA ALA A 50 39.332 63.414 53.031 1.00 15.00 A C +ATOM 408 CB ALA A 50 39.654 63.877 51.618 1.00 15.00 A C +ATOM 409 C ALA A 50 39.455 64.573 54.013 1.00 15.00 A C +ATOM 410 O ALA A 50 40.495 64.753 54.644 1.00 15.00 A O +ATOM 411 N ARG A 51 38.377 65.345 54.147 1.00 15.00 A N +ATOM 412 HN ARG A 51 37.576 65.140 53.618 1.00 15.00 A H +ATOM 413 CA ARG A 51 38.356 66.484 55.056 1.00 15.00 A C +ATOM 414 CB ARG A 51 37.197 67.429 54.727 1.00 15.00 A C +ATOM 415 CG ARG A 51 37.128 68.656 55.623 1.00 15.00 A C +ATOM 416 CD ARG A 51 36.183 69.710 55.065 1.00 15.00 A C +ATOM 417 NE ARG A 51 36.720 70.359 53.869 1.00 15.00 A N +ATOM 418 HE ARG A 51 36.423 70.020 53.000 1.00 15.00 A H +ATOM 419 CZ ARG A 51 37.578 71.379 53.899 1.00 15.00 A C +ATOM 420 NH1 ARG A 51 38.002 71.867 55.059 1.00 15.00 A N +ATOM 421 HH11 ARG A 51 37.666 71.454 55.953 1.00 15.00 A H +ATOM 422 HH12 ARG A 51 38.672 72.665 55.075 1.00 15.00 A H +ATOM 423 NH2 ARG A 51 38.013 71.913 52.766 1.00 15.00 A N +ATOM 424 HH21 ARG A 51 37.685 71.537 51.854 1.00 15.00 A H +ATOM 425 HH22 ARG A 51 38.681 72.711 52.789 1.00 15.00 A H +ATOM 426 C ARG A 51 38.285 66.032 56.512 1.00 15.00 A C +ATOM 427 O ARG A 51 38.883 66.653 57.385 1.00 15.00 A O +ATOM 428 N GLN A 52 37.556 64.943 56.766 1.00 15.00 A N +ATOM 429 HN GLN A 52 37.094 64.495 56.028 1.00 15.00 A H +ATOM 430 CA GLN A 52 37.426 64.409 58.118 1.00 15.00 A C +ATOM 431 CB GLN A 52 36.328 63.342 58.183 1.00 15.00 A C +ATOM 432 CG GLN A 52 36.061 62.786 59.577 1.00 15.00 A C +ATOM 433 CD GLN A 52 35.601 63.843 60.565 1.00 15.00 A C +ATOM 434 OE1 GLN A 52 34.409 64.130 60.676 1.00 15.00 A O +ATOM 435 NE2 GLN A 52 36.546 64.419 61.301 1.00 15.00 A N +ATOM 436 HE21 GLN A 52 37.474 64.134 61.167 1.00 15.00 A H +ATOM 437 HE22 GLN A 52 36.275 65.104 61.947 1.00 15.00 A H +ATOM 438 C GLN A 52 38.761 63.849 58.602 1.00 15.00 A C +ATOM 439 O GLN A 52 39.125 64.010 59.765 1.00 15.00 A O +ATOM 440 N SER A 53 39.489 63.192 57.697 1.00 15.00 A N +ATOM 441 HN SER A 53 39.132 63.074 56.792 1.00 15.00 A H +ATOM 442 CA SER A 53 40.799 62.636 58.021 1.00 15.00 A C +ATOM 443 CB SER A 53 41.328 61.782 56.866 1.00 15.00 A C +ATOM 444 OG SER A 53 40.606 60.570 56.748 1.00 15.00 A O +ATOM 445 HG SER A 53 41.012 60.023 56.069 1.00 15.00 A H +ATOM 446 C SER A 53 41.783 63.761 58.314 1.00 15.00 A C +ATOM 447 O SER A 53 42.610 63.656 59.218 1.00 15.00 A O +ATOM 448 N LEU A 54 41.676 64.841 57.539 1.00 15.00 A N +ATOM 449 HN LEU A 54 40.995 64.853 56.835 1.00 15.00 A H +ATOM 450 CA LEU A 54 42.540 66.005 57.706 1.00 15.00 A C +ATOM 451 CB LEU A 54 42.429 66.935 56.496 1.00 15.00 A C +ATOM 452 CG LEU A 54 43.158 66.481 55.229 1.00 15.00 A C +ATOM 453 CD1 LEU A 54 42.731 67.319 54.035 1.00 15.00 A C +ATOM 454 CD2 LEU A 54 44.665 66.556 55.425 1.00 15.00 A C +ATOM 455 C LEU A 54 42.197 66.760 58.986 1.00 15.00 A C +ATOM 456 O LEU A 54 43.077 67.318 59.640 1.00 15.00 A O +ATOM 457 N ASP A 55 40.908 66.772 59.337 1.00 15.00 A N +ATOM 458 HN ASP A 55 40.255 66.320 58.761 1.00 15.00 A H +ATOM 459 CA ASP A 55 40.443 67.440 60.549 1.00 15.00 A C +ATOM 460 CB ASP A 55 38.916 67.558 60.562 1.00 15.00 A C +ATOM 461 CG ASP A 55 38.410 68.804 59.858 1.00 15.00 A C +ATOM 462 OD1 ASP A 55 37.286 68.763 59.314 1.00 15.00 A O +ATOM 463 OD2 ASP A 55 39.136 69.820 59.853 1.00 15.00 A O +ATOM 464 C ASP A 55 40.916 66.689 61.785 1.00 15.00 A C +ATOM 465 O ASP A 55 41.183 67.292 62.824 1.00 15.00 A O +ATOM 466 N ASN A 56 41.019 65.365 61.661 1.00 15.00 A N +ATOM 467 HN ASN A 56 40.773 64.946 60.809 1.00 15.00 A H +ATOM 468 CA ASN A 56 41.484 64.524 62.758 1.00 15.00 A C +ATOM 469 CB ASN A 56 41.165 63.051 62.493 1.00 15.00 A C +ATOM 470 CG ASN A 56 39.688 62.736 62.622 1.00 15.00 A C +ATOM 471 OD1 ASN A 56 38.937 63.468 63.268 1.00 15.00 A O +ATOM 472 ND2 ASN A 56 39.265 61.633 62.019 1.00 15.00 A N +ATOM 473 HD21 ASN A 56 39.920 61.092 61.531 1.00 15.00 A H +ATOM 474 HD22 ASN A 56 38.315 61.400 62.092 1.00 15.00 A H +ATOM 475 C ASN A 56 42.980 64.712 62.963 1.00 15.00 A C +ATOM 476 O ASN A 56 43.471 64.683 64.091 1.00 15.00 A O +ATOM 477 N VAL A 57 43.699 64.904 61.854 1.00 15.00 A N +ATOM 478 HN VAL A 57 43.245 64.888 60.986 1.00 15.00 A H +ATOM 479 CA VAL A 57 45.137 65.137 61.897 1.00 15.00 A C +ATOM 480 CB VAL A 57 45.745 65.136 60.472 1.00 15.00 A C +ATOM 481 CG1 VAL A 57 47.166 65.682 60.479 1.00 15.00 A C +ATOM 482 CG2 VAL A 57 45.723 63.739 59.879 1.00 15.00 A C +ATOM 483 C VAL A 57 45.396 66.489 62.550 1.00 15.00 A C +ATOM 484 O VAL A 57 46.295 66.633 63.376 1.00 15.00 A O +ATOM 485 N LYS A 58 44.570 67.464 62.174 1.00 15.00 A N +ATOM 486 HN LYS A 58 43.873 67.261 61.515 1.00 15.00 A H +ATOM 487 CA LYS A 58 44.657 68.818 62.701 1.00 15.00 A C +ATOM 488 CB LYS A 58 43.632 69.707 61.989 1.00 15.00 A C +ATOM 489 CG LYS A 58 43.357 71.037 62.672 1.00 15.00 A C +ATOM 490 CD LYS A 58 42.196 71.764 62.015 1.00 15.00 A C +ATOM 491 CE LYS A 58 41.869 73.051 62.754 1.00 15.00 A C +ATOM 492 NZ LYS A 58 40.882 73.883 62.015 1.00 15.00 A N +ATOM 493 HZ1 LYS A 58 41.018 74.888 62.248 1.00 15.00 A H +ATOM 494 HZ2 LYS A 58 39.914 73.607 62.273 1.00 15.00 A H +ATOM 495 HZ3 LYS A 58 41.005 73.757 60.989 1.00 15.00 A H +ATOM 496 C LYS A 58 44.412 68.835 64.208 1.00 15.00 A C +ATOM 497 O LYS A 58 45.092 69.544 64.943 1.00 15.00 A O +ATOM 498 N ALA A 59 43.441 68.039 64.656 1.00 15.00 A N +ATOM 499 HN ALA A 59 42.941 67.495 64.013 1.00 15.00 A H +ATOM 500 CA ALA A 59 43.096 67.957 66.073 1.00 15.00 A C +ATOM 501 CB ALA A 59 41.873 67.075 66.266 1.00 15.00 A C +ATOM 502 C ALA A 59 44.263 67.449 66.916 1.00 15.00 A C +ATOM 503 O ALA A 59 44.490 67.930 68.025 1.00 15.00 A O +ATOM 504 N ILE A 60 44.999 66.477 66.382 1.00 15.00 A N +ATOM 505 HN ILE A 60 44.762 66.133 65.496 1.00 15.00 A H +ATOM 506 CA ILE A 60 46.149 65.902 67.081 1.00 15.00 A C +ATOM 507 CB ILE A 60 46.566 64.556 66.450 1.00 15.00 A C +ATOM 508 CG1 ILE A 60 45.418 63.551 66.549 1.00 15.00 A C +ATOM 509 CG2 ILE A 60 47.818 64.001 67.116 1.00 15.00 A C +ATOM 510 CD1 ILE A 60 45.620 62.311 65.712 1.00 15.00 A C +ATOM 511 C ILE A 60 47.337 66.866 67.067 1.00 15.00 A C +ATOM 512 O ILE A 60 48.042 67.012 68.066 1.00 15.00 A O +ATOM 513 N VAL A 61 47.544 67.524 65.929 1.00 15.00 A N +ATOM 514 HN VAL A 61 46.944 67.365 65.170 1.00 15.00 A H +ATOM 515 CA VAL A 61 48.640 68.477 65.775 1.00 15.00 A C +ATOM 516 CB VAL A 61 48.800 68.918 64.301 1.00 15.00 A C +ATOM 517 CG1 VAL A 61 49.812 70.044 64.169 1.00 15.00 A C +ATOM 518 CG2 VAL A 61 49.218 67.738 63.437 1.00 15.00 A C +ATOM 519 C VAL A 61 48.437 69.701 66.673 1.00 15.00 A C +ATOM 520 O VAL A 61 49.381 70.189 67.293 1.00 15.00 A O +ATOM 521 N GLU A 62 47.192 70.175 66.753 1.00 15.00 A N +ATOM 522 HN GLU A 62 46.481 69.734 66.243 1.00 15.00 A H +ATOM 523 CA GLU A 62 46.861 71.334 67.578 1.00 15.00 A C +ATOM 524 CB GLU A 62 45.505 71.920 67.186 1.00 15.00 A C +ATOM 525 CG GLU A 62 45.487 72.576 65.815 1.00 15.00 A C +ATOM 526 CD GLU A 62 44.205 73.340 65.552 1.00 15.00 A C +ATOM 527 OE1 GLU A 62 44.249 74.320 64.779 1.00 15.00 A O +ATOM 528 OE2 GLU A 62 43.157 72.959 66.116 1.00 15.00 A O +ATOM 529 C GLU A 62 46.876 70.992 69.062 1.00 15.00 A C +ATOM 530 O GLU A 62 47.071 71.868 69.905 1.00 15.00 A O +ATOM 531 N ALA A 63 46.666 69.713 69.377 1.00 15.00 A N +ATOM 532 HN ALA A 63 46.507 69.064 68.660 1.00 15.00 A H +ATOM 533 CA ALA A 63 46.677 69.258 70.763 1.00 15.00 A C +ATOM 534 CB ALA A 63 46.067 67.869 70.877 1.00 15.00 A C +ATOM 535 C ALA A 63 48.102 69.260 71.303 1.00 15.00 A C +ATOM 536 O ALA A 63 48.323 69.276 72.513 1.00 15.00 A O +ATOM 537 N ALA A 64 49.064 69.247 70.382 1.00 15.00 A N +ATOM 538 HN ALA A 64 48.813 69.223 69.435 1.00 15.00 A H +ATOM 539 CA ALA A 64 50.474 69.268 70.738 1.00 15.00 A C +ATOM 540 CB ALA A 64 51.279 68.452 69.737 1.00 15.00 A C +ATOM 541 C ALA A 64 50.992 70.704 70.792 1.00 15.00 A C +ATOM 542 O ALA A 64 52.157 70.940 71.103 1.00 15.00 A O +ATOM 543 N GLY A 65 50.115 71.659 70.485 1.00 15.00 A N +ATOM 544 HN GLY A 65 49.197 71.409 70.248 1.00 15.00 A H +ATOM 545 CA GLY A 65 50.499 73.060 70.510 1.00 15.00 A C +ATOM 546 C GLY A 65 51.002 73.568 69.170 1.00 15.00 A C +ATOM 547 O GLY A 65 51.635 74.621 69.101 1.00 15.00 A O +ATOM 548 N LEU A 66 50.725 72.821 68.104 1.00 15.00 A N +ATOM 549 HN LEU A 66 50.218 71.989 68.221 1.00 15.00 A H +ATOM 550 CA LEU A 66 51.156 73.209 66.763 1.00 15.00 A C +ATOM 551 CB LEU A 66 52.008 72.108 66.123 1.00 15.00 A C +ATOM 552 CG LEU A 66 53.387 71.867 66.740 1.00 15.00 A C +ATOM 553 CD1 LEU A 66 54.134 70.795 65.964 1.00 15.00 A C +ATOM 554 CD2 LEU A 66 54.191 73.157 66.778 1.00 15.00 A C +ATOM 555 C LEU A 66 49.965 73.539 65.867 1.00 15.00 A C +ATOM 556 O LEU A 66 48.813 73.366 66.262 1.00 15.00 A O +ATOM 557 N LYS A 67 50.254 74.019 64.661 1.00 15.00 A N +ATOM 558 HN LYS A 67 51.196 74.138 64.408 1.00 15.00 A H +ATOM 559 CA LYS A 67 49.212 74.376 63.702 1.00 15.00 A C +ATOM 560 CB LYS A 67 49.372 75.838 63.268 1.00 15.00 A C +ATOM 561 CG LYS A 67 49.465 76.841 64.405 1.00 15.00 A C +ATOM 562 CD LYS A 67 49.700 78.244 63.868 1.00 15.00 A C +ATOM 563 CE LYS A 67 49.748 79.273 64.986 1.00 15.00 A C +ATOM 564 NZ LYS A 67 49.900 80.657 64.456 1.00 15.00 A N +ATOM 565 HZ1 LYS A 67 50.801 80.746 63.943 1.00 15.00 A H +ATOM 566 HZ2 LYS A 67 49.889 81.343 65.237 1.00 15.00 A H +ATOM 567 HZ3 LYS A 67 49.119 80.878 63.804 1.00 15.00 A H +ATOM 568 C LYS A 67 49.289 73.486 62.465 1.00 15.00 A C +ATOM 569 O LYS A 67 50.195 72.663 62.336 1.00 15.00 A O +ATOM 570 N VAL A 68 48.333 73.663 61.553 1.00 15.00 A N +ATOM 571 HN VAL A 68 47.630 74.323 61.724 1.00 15.00 A H +ATOM 572 CA VAL A 68 48.302 72.899 60.307 1.00 15.00 A C +ATOM 573 CB VAL A 68 46.958 73.098 59.566 1.00 15.00 A C +ATOM 574 CG1 VAL A 68 46.985 72.483 58.174 1.00 15.00 A C +ATOM 575 CG2 VAL A 68 45.821 72.502 60.378 1.00 15.00 A C +ATOM 576 C VAL A 68 49.470 73.321 59.410 1.00 15.00 A C +ATOM 577 O VAL A 68 49.960 72.541 58.590 1.00 15.00 A O +ATOM 578 N GLY A 69 49.927 74.560 59.601 1.00 15.00 A N +ATOM 579 HN GLY A 69 49.499 75.126 60.277 1.00 15.00 A H +ATOM 580 CA GLY A 69 51.040 75.081 58.829 1.00 15.00 A C +ATOM 581 C GLY A 69 52.371 74.505 59.263 1.00 15.00 A C +ATOM 582 O GLY A 69 53.384 74.688 58.587 1.00 15.00 A O +ATOM 583 N ASP A 70 52.367 73.805 60.393 1.00 15.00 A N +ATOM 584 HN ASP A 70 51.526 73.699 60.885 1.00 15.00 A H +ATOM 585 CA ASP A 70 53.579 73.196 60.919 1.00 15.00 A C +ATOM 586 CB ASP A 70 53.564 73.185 62.448 1.00 15.00 A C +ATOM 587 CG ASP A 70 53.655 74.583 63.029 1.00 15.00 A C +ATOM 588 OD1 ASP A 70 52.925 74.874 63.998 1.00 15.00 A O +ATOM 589 OD2 ASP A 70 54.453 75.391 62.508 1.00 15.00 A O +ATOM 590 C ASP A 70 53.790 71.792 60.357 1.00 15.00 A C +ATOM 591 O ASP A 70 54.852 71.198 60.538 1.00 15.00 A O +ATOM 592 N ILE A 71 52.767 71.265 59.676 1.00 15.00 A N +ATOM 593 HN ILE A 71 51.939 71.782 59.587 1.00 15.00 A H +ATOM 594 CA ILE A 71 52.854 69.941 59.063 1.00 15.00 A C +ATOM 595 CB ILE A 71 51.471 69.445 58.589 1.00 15.00 A C +ATOM 596 CG1 ILE A 71 50.486 69.411 59.765 1.00 15.00 A C +ATOM 597 CG2 ILE A 71 51.586 68.067 57.955 1.00 15.00 A C +ATOM 598 CD1 ILE A 71 49.063 69.080 59.370 1.00 15.00 A C +ATOM 599 C ILE A 71 53.823 69.994 57.880 1.00 15.00 A C +ATOM 600 O ILE A 71 53.647 70.793 56.961 1.00 15.00 A O +ATOM 601 N VAL A 72 54.848 69.142 57.913 1.00 15.00 A N +ATOM 602 HN VAL A 72 54.923 68.515 58.661 1.00 15.00 A H +ATOM 603 CA VAL A 72 55.870 69.129 56.866 1.00 15.00 A C +ATOM 604 CB VAL A 72 57.278 69.349 57.454 1.00 15.00 A C +ATOM 605 CG1 VAL A 72 57.409 70.757 58.013 1.00 15.00 A C +ATOM 606 CG2 VAL A 72 57.579 68.314 58.529 1.00 15.00 A C +ATOM 607 C VAL A 72 55.887 67.862 56.003 1.00 15.00 A C +ATOM 608 O VAL A 72 56.522 67.851 54.952 1.00 15.00 A O +ATOM 609 N LYS A 73 55.211 66.798 56.433 1.00 15.00 A N +ATOM 610 HN LYS A 73 54.713 66.850 57.275 1.00 15.00 A H +ATOM 611 CA LYS A 73 55.196 65.552 55.658 1.00 15.00 A C +ATOM 612 CB LYS A 73 56.467 64.727 55.924 1.00 15.00 A C +ATOM 613 CG LYS A 73 56.484 63.344 55.276 1.00 15.00 A C +ATOM 614 CD LYS A 73 56.415 63.430 53.757 1.00 15.00 A C +ATOM 615 CE LYS A 73 56.688 62.082 53.101 1.00 15.00 A C +ATOM 616 NZ LYS A 73 55.676 61.052 53.466 1.00 15.00 A N +ATOM 617 HZ1 LYS A 73 55.684 60.890 54.493 1.00 15.00 A H +ATOM 618 HZ2 LYS A 73 55.893 60.154 52.985 1.00 15.00 A H +ATOM 619 HZ3 LYS A 73 54.726 61.363 53.182 1.00 15.00 A H +ATOM 620 C LYS A 73 53.953 64.715 55.940 1.00 15.00 A C +ATOM 621 O LYS A 73 53.610 64.469 57.090 1.00 15.00 A O +ATOM 622 N THR A 74 53.280 64.279 54.875 1.00 15.00 A N +ATOM 623 HN THR A 74 53.600 64.516 53.979 1.00 15.00 A H +ATOM 624 CA THR A 74 52.077 63.462 55.005 1.00 15.00 A C +ATOM 625 CB THR A 74 50.794 64.285 54.750 1.00 15.00 A C +ATOM 626 OG1 THR A 74 50.721 64.647 53.367 1.00 15.00 A O +ATOM 627 HG1 THR A 74 51.266 65.423 53.210 1.00 15.00 A H +ATOM 628 CG2 THR A 74 50.769 65.549 55.599 1.00 15.00 A C +ATOM 629 C THR A 74 52.094 62.288 54.025 1.00 15.00 A C +ATOM 630 O THR A 74 52.707 62.363 52.960 1.00 15.00 A O +ATOM 631 N THR A 75 51.428 61.202 54.401 1.00 15.00 A N +ATOM 632 HN THR A 75 50.991 61.193 55.277 1.00 15.00 A H +ATOM 633 CA THR A 75 51.326 60.017 53.550 1.00 15.00 A C +ATOM 634 CB THR A 75 52.070 58.807 54.150 1.00 15.00 A C +ATOM 635 OG1 THR A 75 53.433 59.166 54.412 1.00 15.00 A O +ATOM 636 HG1 THR A 75 53.919 58.387 54.703 1.00 15.00 A H +ATOM 637 CG2 THR A 75 52.049 57.634 53.183 1.00 15.00 A C +ATOM 638 C THR A 75 49.850 59.676 53.348 1.00 15.00 A C +ATOM 639 O THR A 75 49.173 59.222 54.273 1.00 15.00 A O +ATOM 640 N VAL A 76 49.358 59.902 52.133 1.00 15.00 A N +ATOM 641 HN VAL A 76 49.959 60.225 51.427 1.00 15.00 A H +ATOM 642 CA VAL A 76 47.953 59.675 51.817 1.00 15.00 A C +ATOM 643 CB VAL A 76 47.397 60.788 50.902 1.00 15.00 A C +ATOM 644 CG1 VAL A 76 45.898 60.633 50.712 1.00 15.00 A C +ATOM 645 CG2 VAL A 76 47.727 62.163 51.464 1.00 15.00 A C +ATOM 646 C VAL A 76 47.677 58.313 51.182 1.00 15.00 A C +ATOM 647 O VAL A 76 48.023 58.065 50.027 1.00 15.00 A O +ATOM 648 N PHE A 77 47.043 57.437 51.957 1.00 15.00 A N +ATOM 649 HN PHE A 77 46.830 57.688 52.881 1.00 15.00 A H +ATOM 650 CA PHE A 77 46.665 56.112 51.483 1.00 15.00 A C +ATOM 651 CB PHE A 77 46.776 55.087 52.615 1.00 15.00 A C +ATOM 652 CG PHE A 77 48.125 55.003 53.267 1.00 15.00 A C +ATOM 653 CD1 PHE A 77 48.343 55.577 54.509 1.00 15.00 A C +ATOM 654 CD2 PHE A 77 49.168 54.335 52.649 1.00 15.00 A C +ATOM 655 CE1 PHE A 77 49.577 55.486 55.123 1.00 15.00 A C +ATOM 656 CE2 PHE A 77 50.406 54.242 53.255 1.00 15.00 A C +ATOM 657 CZ PHE A 77 50.611 54.817 54.495 1.00 15.00 A C +ATOM 658 C PHE A 77 45.216 56.157 51.012 1.00 15.00 A C +ATOM 659 O PHE A 77 44.315 56.441 51.797 1.00 15.00 A O +ATOM 660 N VAL A 78 44.987 55.891 49.734 1.00 15.00 A N +ATOM 661 HN VAL A 78 45.739 55.668 49.144 1.00 15.00 A H +ATOM 662 CA VAL A 78 43.632 55.919 49.193 1.00 15.00 A C +ATOM 663 CB VAL A 78 43.471 56.968 48.071 1.00 15.00 A C +ATOM 664 CG1 VAL A 78 43.661 58.374 48.622 1.00 15.00 A C +ATOM 665 CG2 VAL A 78 44.440 56.699 46.927 1.00 15.00 A C +ATOM 666 C VAL A 78 43.197 54.550 48.682 1.00 15.00 A C +ATOM 667 O VAL A 78 44.027 53.706 48.356 1.00 15.00 A O +ATOM 668 N LYS A 79 41.887 54.336 48.627 1.00 15.00 A N +ATOM 669 HN LYS A 79 41.276 55.046 48.916 1.00 15.00 A H +ATOM 670 CA LYS A 79 41.334 53.075 48.149 1.00 15.00 A C +ATOM 671 CB LYS A 79 39.994 52.788 48.844 1.00 15.00 A C +ATOM 672 CG LYS A 79 39.216 51.608 48.277 1.00 15.00 A C +ATOM 673 CD LYS A 79 39.954 50.295 48.480 1.00 15.00 A C +ATOM 674 CE LYS A 79 39.404 49.211 47.564 1.00 15.00 A C +ATOM 675 NZ LYS A 79 39.696 49.493 46.131 1.00 15.00 A N +ATOM 676 HZ1 LYS A 79 39.304 48.740 45.531 1.00 15.00 A H +ATOM 677 HZ2 LYS A 79 40.724 49.541 45.978 1.00 15.00 A H +ATOM 678 HZ3 LYS A 79 39.273 50.401 45.852 1.00 15.00 A H +ATOM 679 C LYS A 79 41.163 53.112 46.631 1.00 15.00 A C +ATOM 680 O LYS A 79 41.215 52.081 45.958 1.00 15.00 A O +ATOM 681 N ASP A 80 40.971 54.315 46.098 1.00 15.00 A N +ATOM 682 HN ASP A 80 40.947 55.098 46.687 1.00 15.00 A H +ATOM 683 CA ASP A 80 40.801 54.503 44.664 1.00 15.00 A C +ATOM 684 CB ASP A 80 39.313 54.502 44.294 1.00 15.00 A C +ATOM 685 CG ASP A 80 39.061 54.205 42.825 1.00 15.00 A C +ATOM 686 OD1 ASP A 80 37.882 54.033 42.452 1.00 15.00 A O +ATOM 687 OD2 ASP A 80 40.038 54.141 42.049 1.00 15.00 A O +ATOM 688 C ASP A 80 41.455 55.808 44.220 1.00 15.00 A C +ATOM 689 O ASP A 80 41.075 56.889 44.672 1.00 15.00 A O +ATOM 690 N LEU A 81 42.448 55.696 43.336 1.00 15.00 A N +ATOM 691 HN LEU A 81 42.709 54.804 43.025 1.00 15.00 A H +ATOM 692 CA LEU A 81 43.156 56.864 42.822 1.00 15.00 A C +ATOM 693 CB LEU A 81 44.518 56.472 42.247 1.00 15.00 A C +ATOM 694 CG LEU A 81 45.702 56.530 43.211 1.00 15.00 A C +ATOM 695 CD1 LEU A 81 46.946 55.964 42.551 1.00 15.00 A C +ATOM 696 CD2 LEU A 81 45.953 57.958 43.672 1.00 15.00 A C +ATOM 697 C LEU A 81 42.335 57.608 41.776 1.00 15.00 A C +ATOM 698 O LEU A 81 42.713 58.693 41.337 1.00 15.00 A O +ATOM 699 N ASN A 82 41.211 57.014 41.372 1.00 15.00 A N +ATOM 700 HN ASN A 82 40.973 56.139 41.745 1.00 15.00 A H +ATOM 701 CA ASN A 82 40.328 57.638 40.395 1.00 15.00 A C +ATOM 702 CB ASN A 82 39.350 56.613 39.811 1.00 15.00 A C +ATOM 703 CG ASN A 82 39.957 55.788 38.692 1.00 15.00 A C +ATOM 704 OD1 ASN A 82 40.824 56.259 37.954 1.00 15.00 A O +ATOM 705 ND2 ASN A 82 39.501 54.548 38.559 1.00 15.00 A N +ATOM 706 HD21 ASN A 82 38.811 54.240 39.182 1.00 15.00 A H +ATOM 707 HD22 ASN A 82 39.872 53.992 37.841 1.00 15.00 A H +ATOM 708 C ASN A 82 39.563 58.793 41.037 1.00 15.00 A C +ATOM 709 O ASN A 82 39.010 59.649 40.349 1.00 15.00 A O +ATOM 710 N ASP A 83 39.553 58.802 42.370 1.00 15.00 A N +ATOM 711 HN ASP A 83 40.015 58.084 42.851 1.00 15.00 A H +ATOM 712 CA ASP A 83 38.882 59.842 43.141 1.00 15.00 A C +ATOM 713 CB ASP A 83 38.130 59.217 44.325 1.00 15.00 A C +ATOM 714 CG ASP A 83 36.798 58.600 43.953 1.00 15.00 A C +ATOM 715 OD1 ASP A 83 36.407 57.604 44.599 1.00 15.00 A O +ATOM 716 OD2 ASP A 83 36.140 59.117 43.027 1.00 15.00 A O +ATOM 717 C ASP A 83 39.899 60.831 43.700 1.00 15.00 A C +ATOM 718 O ASP A 83 39.566 61.651 44.554 1.00 15.00 A O +ATOM 719 N PHE A 84 41.137 60.765 43.209 1.00 15.00 A N +ATOM 720 HN PHE A 84 41.338 60.124 42.494 1.00 15.00 A H +ATOM 721 CA PHE A 84 42.195 61.637 43.709 1.00 15.00 A C +ATOM 722 CB PHE A 84 43.592 61.105 43.399 1.00 15.00 A C +ATOM 723 CG PHE A 84 44.578 61.403 44.493 1.00 15.00 A C +ATOM 724 CD1 PHE A 84 45.597 62.320 44.300 1.00 15.00 A C +ATOM 725 CD2 PHE A 84 44.475 60.772 45.722 1.00 15.00 A C +ATOM 726 CE1 PHE A 84 46.495 62.602 45.312 1.00 15.00 A C +ATOM 727 CE2 PHE A 84 45.370 61.047 46.737 1.00 15.00 A C +ATOM 728 CZ PHE A 84 46.381 61.964 46.532 1.00 15.00 A C +ATOM 729 C PHE A 84 42.046 63.096 43.295 1.00 15.00 A C +ATOM 730 O PHE A 84 42.566 63.979 43.969 1.00 15.00 A O +ATOM 731 N ALA A 85 41.353 63.355 42.189 1.00 15.00 A N +ATOM 732 HN ALA A 85 40.986 62.614 41.662 1.00 15.00 A H +ATOM 733 CA ALA A 85 41.137 64.730 41.744 1.00 15.00 A C +ATOM 734 CB ALA A 85 40.456 64.753 40.385 1.00 15.00 A C +ATOM 735 C ALA A 85 40.293 65.471 42.779 1.00 15.00 A C +ATOM 736 O ALA A 85 40.514 66.650 43.056 1.00 15.00 A O +ATOM 737 N THR A 86 39.339 64.744 43.357 1.00 15.00 A N +ATOM 738 HN THR A 86 39.225 63.811 43.081 1.00 15.00 A H +ATOM 739 CA THR A 86 38.455 65.284 44.381 1.00 15.00 A C +ATOM 740 CB THR A 86 37.225 64.373 44.566 1.00 15.00 A C +ATOM 741 OG1 THR A 86 36.563 64.203 43.308 1.00 15.00 A O +ATOM 742 HG1 THR A 86 36.737 63.321 42.971 1.00 15.00 A H +ATOM 743 CG2 THR A 86 36.248 64.975 45.560 1.00 15.00 A C +ATOM 744 C THR A 86 39.201 65.410 45.710 1.00 15.00 A C +ATOM 745 O THR A 86 39.034 66.390 46.438 1.00 15.00 A O +ATOM 746 N VAL A 87 40.030 64.409 46.014 1.00 15.00 A N +ATOM 747 HN VAL A 87 40.111 63.654 45.395 1.00 15.00 A H +ATOM 748 CA VAL A 87 40.820 64.403 47.244 1.00 15.00 A C +ATOM 749 CB VAL A 87 41.542 63.049 47.444 1.00 15.00 A C +ATOM 750 CG1 VAL A 87 42.513 63.110 48.615 1.00 15.00 A C +ATOM 751 CG2 VAL A 87 40.531 61.933 47.656 1.00 15.00 A C +ATOM 752 C VAL A 87 41.846 65.536 47.233 1.00 15.00 A C +ATOM 753 O VAL A 87 42.064 66.192 48.248 1.00 15.00 A O +ATOM 754 N ASN A 88 42.460 65.762 46.070 1.00 15.00 A N +ATOM 755 HN ASN A 88 42.236 65.200 45.299 1.00 15.00 A H +ATOM 756 CA ASN A 88 43.457 66.818 45.908 1.00 15.00 A C +ATOM 757 CB ASN A 88 44.103 66.746 44.521 1.00 15.00 A C +ATOM 758 CG ASN A 88 45.497 66.155 44.551 1.00 15.00 A C +ATOM 759 OD1 ASN A 88 46.184 66.213 45.568 1.00 15.00 A O +ATOM 760 ND2 ASN A 88 45.927 65.590 43.429 1.00 15.00 A N +ATOM 761 HD21 ASN A 88 45.327 65.586 42.653 1.00 15.00 A H +ATOM 762 HD22 ASN A 88 46.826 65.201 43.421 1.00 15.00 A H +ATOM 763 C ASN A 88 42.846 68.197 46.115 1.00 15.00 A C +ATOM 764 O ASN A 88 43.472 69.075 46.705 1.00 15.00 A O +ATOM 765 N ALA A 89 41.622 68.381 45.620 1.00 15.00 A N +ATOM 766 HN ALA A 89 41.182 67.640 45.151 1.00 15.00 A H +ATOM 767 CA ALA A 89 40.918 69.654 45.753 1.00 15.00 A C +ATOM 768 CB ALA A 89 39.643 69.648 44.924 1.00 15.00 A C +ATOM 769 C ALA A 89 40.609 69.963 47.216 1.00 15.00 A C +ATOM 770 O ALA A 89 40.766 71.097 47.664 1.00 15.00 A O +ATOM 771 N THR A 90 40.171 68.944 47.953 1.00 15.00 A N +ATOM 772 HN THR A 90 40.059 68.066 47.531 1.00 15.00 A H +ATOM 773 CA THR A 90 39.852 69.095 49.370 1.00 15.00 A C +ATOM 774 CB THR A 90 39.074 67.870 49.898 1.00 15.00 A C +ATOM 775 OG1 THR A 90 37.799 67.797 49.249 1.00 15.00 A O +ATOM 776 HG1 THR A 90 37.825 67.126 48.564 1.00 15.00 A H +ATOM 777 CG2 THR A 90 38.862 67.957 51.403 1.00 15.00 A C +ATOM 778 C THR A 90 41.130 69.283 50.189 1.00 15.00 A C +ATOM 779 O THR A 90 41.169 70.080 51.127 1.00 15.00 A O +ATOM 780 N TYR A 91 42.171 68.547 49.809 1.00 15.00 A N +ATOM 781 HN TYR A 91 42.064 67.937 49.050 1.00 15.00 A H +ATOM 782 CA TYR A 91 43.466 68.611 50.478 1.00 15.00 A C +ATOM 783 CB TYR A 91 44.398 67.560 49.863 1.00 15.00 A C +ATOM 784 CG TYR A 91 45.730 67.391 50.557 1.00 15.00 A C +ATOM 785 CD1 TYR A 91 45.951 66.332 51.427 1.00 15.00 A C +ATOM 786 CD2 TYR A 91 46.769 68.286 50.338 1.00 15.00 A C +ATOM 787 CE1 TYR A 91 47.174 66.162 52.047 1.00 15.00 A C +ATOM 788 CE2 TYR A 91 47.993 68.124 50.952 1.00 15.00 A C +ATOM 789 CZ TYR A 91 48.188 67.067 51.811 1.00 15.00 A C +ATOM 790 OH TYR A 91 49.407 66.904 52.422 1.00 15.00 A O +ATOM 791 HH TYR A 91 49.693 65.991 52.328 1.00 15.00 A H +ATOM 792 C TYR A 91 44.082 70.001 50.330 1.00 15.00 A C +ATOM 793 O TYR A 91 44.586 70.573 51.297 1.00 15.00 A O +ATOM 794 N GLU A 92 44.030 70.533 49.110 1.00 15.00 A N +ATOM 795 HN GLU A 92 43.612 70.021 48.386 1.00 15.00 A H +ATOM 796 CA GLU A 92 44.576 71.852 48.817 1.00 15.00 A C +ATOM 797 CB GLU A 92 44.568 72.109 47.308 1.00 15.00 A C +ATOM 798 CG GLU A 92 45.065 73.487 46.905 1.00 15.00 A C +ATOM 799 CD GLU A 92 45.529 73.543 45.463 1.00 15.00 A C +ATOM 800 OE1 GLU A 92 46.346 74.430 45.141 1.00 15.00 A O +ATOM 801 OE2 GLU A 92 45.081 72.699 44.659 1.00 15.00 A O +ATOM 802 C GLU A 92 43.796 72.941 49.540 1.00 15.00 A C +ATOM 803 O GLU A 92 44.384 73.862 50.104 1.00 15.00 A O +ATOM 804 N ALA A 93 42.470 72.821 49.521 1.00 15.00 A N +ATOM 805 HN ALA A 93 42.066 72.058 49.055 1.00 15.00 A H +ATOM 806 CA ALA A 93 41.603 73.790 50.176 1.00 15.00 A C +ATOM 807 CB ALA A 93 40.142 73.479 49.890 1.00 15.00 A C +ATOM 808 C ALA A 93 41.858 73.822 51.677 1.00 15.00 A C +ATOM 809 O ALA A 93 41.912 74.890 52.275 1.00 15.00 A O +ATOM 810 N PHE A 94 42.032 72.641 52.269 1.00 15.00 A N +ATOM 811 HN PHE A 94 41.989 71.828 51.724 1.00 15.00 A H +ATOM 812 CA PHE A 94 42.282 72.515 53.703 1.00 15.00 A C +ATOM 813 CB PHE A 94 42.432 71.038 54.086 1.00 15.00 A C +ATOM 814 CG PHE A 94 42.574 70.792 55.562 1.00 15.00 A C +ATOM 815 CD1 PHE A 94 41.458 70.761 56.384 1.00 15.00 A C +ATOM 816 CD2 PHE A 94 43.823 70.590 56.128 1.00 15.00 A C +ATOM 817 CE1 PHE A 94 41.585 70.532 57.741 1.00 15.00 A C +ATOM 818 CE2 PHE A 94 43.956 70.362 57.484 1.00 15.00 A C +ATOM 819 CZ PHE A 94 42.836 70.334 58.293 1.00 15.00 A C +ATOM 820 C PHE A 94 43.518 73.302 54.138 1.00 15.00 A C +ATOM 821 O PHE A 94 43.464 74.065 55.099 1.00 15.00 A O +ATOM 822 N PHE A 95 44.626 73.123 53.420 1.00 15.00 A N +ATOM 823 HN PHE A 95 44.606 72.512 52.653 1.00 15.00 A H +ATOM 824 CA PHE A 95 45.870 73.816 53.751 1.00 15.00 A C +ATOM 825 CB PHE A 95 47.079 73.134 53.107 1.00 15.00 A C +ATOM 826 CG PHE A 95 47.495 71.877 53.818 1.00 15.00 A C +ATOM 827 CD1 PHE A 95 46.977 70.649 53.445 1.00 15.00 A C +ATOM 828 CD2 PHE A 95 48.392 71.927 54.872 1.00 15.00 A C +ATOM 829 CE1 PHE A 95 47.348 69.494 54.105 1.00 15.00 A C +ATOM 830 CE2 PHE A 95 48.770 70.776 55.535 1.00 15.00 A C +ATOM 831 CZ PHE A 95 48.244 69.557 55.153 1.00 15.00 A C +ATOM 832 C PHE A 95 45.822 75.309 53.417 1.00 15.00 A C +ATOM 833 O PHE A 95 46.482 76.114 54.072 1.00 15.00 A O +ATOM 834 N THR A 96 45.038 75.674 52.403 1.00 15.00 A N +ATOM 835 HN THR A 96 44.547 74.986 51.905 1.00 15.00 A H +ATOM 836 CA THR A 96 44.895 77.076 52.013 1.00 15.00 A C +ATOM 837 CB THR A 96 44.214 77.213 50.631 1.00 15.00 A C +ATOM 838 OG1 THR A 96 45.035 76.601 49.629 1.00 15.00 A O +ATOM 839 HG1 THR A 96 45.210 75.689 49.872 1.00 15.00 A H +ATOM 840 CG2 THR A 96 43.997 78.677 50.266 1.00 15.00 A C +ATOM 841 C THR A 96 44.082 77.831 53.067 1.00 15.00 A C +ATOM 842 O THR A 96 44.328 79.008 53.337 1.00 15.00 A O +ATOM 843 N GLU A 97 43.126 77.122 53.671 1.00 15.00 A N +ATOM 844 HN GLU A 97 42.995 76.187 53.407 1.00 15.00 A H +ATOM 845 CA GLU A 97 42.265 77.688 54.708 1.00 15.00 A C +ATOM 846 CB GLU A 97 41.173 76.682 55.086 1.00 15.00 A C +ATOM 847 CG GLU A 97 40.062 76.529 54.060 1.00 15.00 A C +ATOM 848 CD GLU A 97 39.393 75.169 54.125 1.00 15.00 A C +ATOM 849 OE1 GLU A 97 39.549 74.475 55.153 1.00 15.00 A O +ATOM 850 OE2 GLU A 97 38.717 74.795 53.145 1.00 15.00 A O +ATOM 851 C GLU A 97 43.061 78.041 55.960 1.00 15.00 A C +ATOM 852 O GLU A 97 42.675 78.924 56.724 1.00 15.00 A O +ATOM 853 N HIS A 98 44.173 77.344 56.165 1.00 15.00 A N +ATOM 854 HN HIS A 98 44.439 76.663 55.512 1.00 15.00 A H +ATOM 855 CA HIS A 98 45.010 77.573 57.334 1.00 15.00 A C +ATOM 856 CB HIS A 98 45.417 76.238 57.963 1.00 15.00 A C +ATOM 857 CG HIS A 98 44.266 75.470 58.536 1.00 15.00 A C +ATOM 858 ND1 HIS A 98 43.531 74.544 57.829 1.00 15.00 A N +ATOM 859 HD1 HIS A 98 43.672 74.287 56.893 1.00 15.00 A H +ATOM 860 CD2 HIS A 98 43.722 75.509 59.776 1.00 15.00 A C +ATOM 861 CE1 HIS A 98 42.584 74.063 58.642 1.00 15.00 A C +ATOM 862 NE2 HIS A 98 42.658 74.616 59.836 1.00 15.00 A N +ATOM 863 C HIS A 98 46.249 78.399 57.004 1.00 15.00 A C +ATOM 864 O HIS A 98 47.137 78.539 57.847 1.00 15.00 A O +ATOM 865 N ASN A 99 46.294 78.953 55.781 1.00 15.00 A N +ATOM 866 HN ASN A 99 45.541 78.815 55.169 1.00 15.00 A H +ATOM 867 CA ASN A 99 47.434 79.763 55.331 1.00 15.00 A C +ATOM 868 CB ASN A 99 47.444 81.108 56.070 1.00 15.00 A C +ATOM 869 CG ASN A 99 48.428 82.107 55.492 1.00 15.00 A C +ATOM 870 OD1 ASN A 99 48.651 82.154 54.282 1.00 15.00 A O +ATOM 871 ND2 ASN A 99 49.030 82.909 56.364 1.00 15.00 A N +ATOM 872 HD21 ASN A 99 48.806 82.811 57.313 1.00 15.00 A H +ATOM 873 HD22 ASN A 99 49.674 83.564 56.023 1.00 15.00 A H +ATOM 874 C ASN A 99 48.736 78.998 55.573 1.00 15.00 A C +ATOM 875 O ASN A 99 49.719 79.539 56.081 1.00 15.00 A O +ATOM 876 N ALA A 100 48.725 77.726 55.195 1.00 15.00 A N +ATOM 877 HN ALA A 100 47.926 77.367 54.757 1.00 15.00 A H +ATOM 878 CA ALA A 100 49.862 76.853 55.410 1.00 15.00 A C +ATOM 879 CB ALA A 100 49.396 75.621 56.165 1.00 15.00 A C +ATOM 880 C ALA A 100 50.531 76.420 54.118 1.00 15.00 A C +ATOM 881 O ALA A 100 49.871 76.193 53.103 1.00 15.00 A O +ATOM 882 N THR A 101 51.854 76.307 54.173 1.00 15.00 A N +ATOM 883 HN THR A 101 52.317 76.538 55.004 1.00 15.00 A H +ATOM 884 CA THR A 101 52.634 75.855 53.035 1.00 15.00 A C +ATOM 885 CB THR A 101 54.139 76.117 53.258 1.00 15.00 A C +ATOM 886 OG1 THR A 101 54.358 77.520 53.442 1.00 15.00 A O +ATOM 887 HG1 THR A 101 53.544 77.996 53.263 1.00 15.00 A H +ATOM 888 CG2 THR A 101 54.963 75.633 52.070 1.00 15.00 A C +ATOM 889 C THR A 101 52.416 74.358 52.874 1.00 15.00 A C +ATOM 890 O THR A 101 52.445 73.616 53.858 1.00 15.00 A O +ATOM 891 N PHE A 102 52.170 73.925 51.645 1.00 15.00 A N +ATOM 892 HN PHE A 102 52.136 74.569 50.907 1.00 15.00 A H +ATOM 893 CA PHE A 102 51.949 72.514 51.367 1.00 15.00 A C +ATOM 894 CB PHE A 102 51.723 72.296 49.873 1.00 15.00 A C +ATOM 895 CG PHE A 102 50.578 73.094 49.319 1.00 15.00 A C +ATOM 896 CD1 PHE A 102 50.741 73.867 48.181 1.00 15.00 A C +ATOM 897 CD2 PHE A 102 49.340 73.075 49.940 1.00 15.00 A C +ATOM 898 CE1 PHE A 102 49.689 74.605 47.672 1.00 15.00 A C +ATOM 899 CE2 PHE A 102 48.284 73.809 49.438 1.00 15.00 A C +ATOM 900 CZ PHE A 102 48.458 74.577 48.301 1.00 15.00 A C +ATOM 901 C PHE A 102 53.123 71.677 51.859 1.00 15.00 A C +ATOM 902 O PHE A 102 54.278 71.999 51.595 1.00 15.00 A O +ATOM 903 N PRO A 103 52.843 70.606 52.607 1.00 15.00 A N +ATOM 904 CA PRO A 103 53.870 69.725 53.146 1.00 15.00 A C +ATOM 905 CB PRO A 103 53.164 69.043 54.333 1.00 15.00 A C +ATOM 906 CG PRO A 103 51.742 69.515 54.319 1.00 15.00 A C +ATOM 907 CD PRO A 103 51.501 70.163 52.989 1.00 15.00 A C +ATOM 908 C PRO A 103 54.278 68.668 52.133 1.00 15.00 A C +ATOM 909 O PRO A 103 53.584 68.458 51.136 1.00 15.00 A O +ATOM 910 N ALA A 104 55.431 68.039 52.361 1.00 15.00 A N +ATOM 911 HN ALA A 104 55.989 68.319 53.119 1.00 15.00 A H +ATOM 912 CA ALA A 104 55.890 66.962 51.490 1.00 15.00 A C +ATOM 913 CB ALA A 104 57.273 66.493 51.916 1.00 15.00 A C +ATOM 914 C ALA A 104 54.885 65.818 51.593 1.00 15.00 A C +ATOM 915 O ALA A 104 54.306 65.607 52.656 1.00 15.00 A O +ATOM 916 N ARG A 105 54.647 65.090 50.513 1.00 15.00 A N +ATOM 917 HN ARG A 105 55.119 65.275 49.670 1.00 15.00 A H +ATOM 918 CA ARG A 105 53.660 64.029 50.585 1.00 15.00 A C +ATOM 919 CB ARG A 105 52.250 64.638 50.459 1.00 15.00 A C +ATOM 920 CG ARG A 105 51.345 63.962 49.452 1.00 15.00 A C +ATOM 921 CD ARG A 105 50.992 64.901 48.317 1.00 15.00 A C +ATOM 922 NE ARG A 105 49.804 65.717 48.579 1.00 15.00 A N +ATOM 923 HE ARG A 105 49.793 66.258 49.403 1.00 15.00 A H +ATOM 924 CZ ARG A 105 48.754 65.767 47.737 1.00 15.00 A C +ATOM 925 NH1 ARG A 105 48.768 65.046 46.630 1.00 15.00 A N +ATOM 926 HH11 ARG A 105 49.585 64.452 46.414 1.00 15.00 A H +ATOM 927 HH12 ARG A 105 47.963 65.070 45.980 1.00 15.00 A H +ATOM 928 NH2 ARG A 105 47.737 66.592 47.956 1.00 15.00 A N +ATOM 929 HH21 ARG A 105 47.749 67.220 48.789 1.00 15.00 A H +ATOM 930 HH22 ARG A 105 46.929 66.620 47.295 1.00 15.00 A H +ATOM 931 C ARG A 105 53.878 62.847 49.618 1.00 15.00 A C +ATOM 932 O ARG A 105 54.413 62.992 48.513 1.00 15.00 A O +ATOM 933 N SER A 106 53.479 61.665 50.095 1.00 15.00 A N +ATOM 934 HN SER A 106 53.128 61.622 51.007 1.00 15.00 A H +ATOM 935 CA SER A 106 53.539 60.435 49.322 1.00 15.00 A C +ATOM 936 CB SER A 106 54.353 59.363 50.047 1.00 15.00 A C +ATOM 937 OG SER A 106 55.723 59.704 50.092 1.00 15.00 A O +ATOM 938 HG SER A 106 55.814 60.623 50.339 1.00 15.00 A H +ATOM 939 C SER A 106 52.103 59.970 49.113 1.00 15.00 A C +ATOM 940 O SER A 106 51.289 60.045 50.036 1.00 15.00 A O +ATOM 941 N CSP A 107 51.779 59.534 47.903 1.00 15.00 A N +ATOM 942 HN CSP A 107 52.463 59.498 47.208 1.00 15.00 A H +ATOM 943 CA CSP A 107 50.414 59.118 47.583 1.00 15.00 A C +ATOM 944 CB CSP A 107 49.760 60.176 46.660 0.67 15.00 A C +ATOM 945 SG CSP A 107 50.439 61.858 46.826 0.67 15.00 A S +ATOM 946 P CSP A 107 51.448 62.012 44.987 0.67 15.00 A P +ATOM 947 O1P CSP A 107 51.589 60.551 45.205 0.67 15.00 A O +ATOM 948 O2P CSP A 107 50.962 62.021 43.586 0.67 15.00 A O +ATOM 949 O3P CSP A 107 50.428 63.236 45.252 0.67 15.00 A O +ATOM 950 C CSP A 107 50.378 57.743 46.912 1.00 15.00 A C +ATOM 951 O CSP A 107 50.976 57.548 45.856 1.00 15.00 A O +ATOM 952 N VAL A 108 49.675 56.792 47.527 1.00 15.00 A N +ATOM 953 HN VAL A 108 49.223 57.004 48.367 1.00 15.00 A H +ATOM 954 CA VAL A 108 49.560 55.435 46.968 1.00 15.00 A C +ATOM 955 CB VAL A 108 50.581 54.439 47.580 1.00 15.00 A C +ATOM 956 CG1 VAL A 108 52.013 54.871 47.333 1.00 15.00 A C +ATOM 957 CG2 VAL A 108 50.321 54.219 49.066 1.00 15.00 A C +ATOM 958 C VAL A 108 48.155 54.858 47.163 1.00 15.00 A C +ATOM 959 O VAL A 108 47.455 55.218 48.108 1.00 15.00 A O +ATOM 960 N GLU A 109 47.748 53.962 46.259 1.00 15.00 A N +ATOM 961 HN GLU A 109 48.341 53.732 45.512 1.00 15.00 A H +ATOM 962 CA GLU A 109 46.441 53.312 46.355 1.00 15.00 A C +ATOM 963 CB GLU A 109 45.778 53.198 44.976 1.00 15.00 A C +ATOM 964 CG GLU A 109 44.352 52.662 45.005 1.00 15.00 A C +ATOM 965 CD GLU A 109 43.857 52.239 43.635 1.00 15.00 A C +ATOM 966 OE1 GLU A 109 43.516 51.049 43.467 1.00 15.00 A O +ATOM 967 OE2 GLU A 109 43.811 53.096 42.729 1.00 15.00 A O +ATOM 968 C GLU A 109 46.623 51.928 46.962 1.00 15.00 A C +ATOM 969 O GLU A 109 47.354 51.105 46.423 1.00 15.00 A O +ATOM 970 N VAL A 110 45.974 51.680 48.090 1.00 15.00 A N +ATOM 971 HN VAL A 110 45.399 52.375 48.476 1.00 15.00 A H +ATOM 972 CA VAL A 110 46.094 50.394 48.768 1.00 15.00 A C +ATOM 973 CB VAL A 110 46.194 50.572 50.297 1.00 15.00 A C +ATOM 974 CG1 VAL A 110 47.467 51.328 50.653 1.00 15.00 A C +ATOM 975 CG2 VAL A 110 44.970 51.302 50.828 1.00 15.00 A C +ATOM 976 C VAL A 110 44.935 49.464 48.434 1.00 15.00 A C +ATOM 977 O VAL A 110 43.969 49.862 47.777 1.00 15.00 A O +ATOM 978 N ALA A 111 45.050 48.219 48.882 1.00 15.00 A N +ATOM 979 HN ALA A 111 45.845 47.964 49.390 1.00 15.00 A H +ATOM 980 CA ALA A 111 44.023 47.229 48.645 1.00 15.00 A C +ATOM 981 CB ALA A 111 44.518 45.830 49.006 1.00 15.00 A C +ATOM 982 C ALA A 111 42.789 47.568 49.450 1.00 15.00 A C +ATOM 983 O ALA A 111 41.672 47.606 48.926 1.00 15.00 A O +ATOM 984 N ARG A 112 42.988 47.787 50.736 1.00 15.00 A N +ATOM 985 HN ARG A 112 43.894 47.705 51.111 1.00 15.00 A H +ATOM 986 CA ARG A 112 41.889 48.116 51.606 1.00 15.00 A C +ATOM 987 CB ARG A 112 41.180 46.833 52.018 1.00 15.00 A C +ATOM 988 CG ARG A 112 39.737 47.059 52.382 1.00 15.00 A C +ATOM 989 CD ARG A 112 39.417 46.382 53.687 1.00 15.00 A C +ATOM 990 NE ARG A 112 39.195 44.963 53.514 1.00 15.00 A N +ATOM 991 HE ARG A 112 39.719 44.493 52.812 1.00 15.00 A H +ATOM 992 CZ ARG A 112 38.355 44.272 54.266 1.00 15.00 A C +ATOM 993 NH1 ARG A 112 37.672 44.887 55.239 1.00 15.00 A N +ATOM 994 HH11 ARG A 112 36.997 44.363 55.837 1.00 15.00 A H +ATOM 995 HH12 ARG A 112 37.790 45.909 55.384 1.00 15.00 A H +ATOM 996 NH2 ARG A 112 38.213 42.979 54.058 1.00 15.00 A N +ATOM 997 HH21 ARG A 112 38.749 42.523 53.297 1.00 15.00 A H +ATOM 998 HH22 ARG A 112 37.549 42.419 54.641 1.00 15.00 A H +ATOM 999 C ARG A 112 42.372 48.890 52.841 1.00 15.00 A C +ATOM 1000 O ARG A 112 43.543 48.802 53.224 1.00 15.00 A O +ATOM 1001 N LEU A 113 41.463 49.645 53.465 1.00 15.00 A N +ATOM 1002 HN LEU A 113 40.549 49.674 53.119 1.00 15.00 A H +ATOM 1003 CA LEU A 113 41.784 50.429 54.652 1.00 15.00 A C +ATOM 1004 CB LEU A 113 41.628 51.921 54.337 1.00 15.00 A C +ATOM 1005 CG LEU A 113 42.663 52.512 53.378 1.00 15.00 A C +ATOM 1006 CD1 LEU A 113 42.197 53.844 52.816 1.00 15.00 A C +ATOM 1007 CD2 LEU A 113 44.003 52.665 54.074 1.00 15.00 A C +ATOM 1008 C LEU A 113 40.870 50.032 55.813 1.00 15.00 A C +ATOM 1009 O LEU A 113 39.812 49.445 55.588 1.00 15.00 A O +ATOM 1010 N PRO A 114 41.278 50.323 57.068 1.00 15.00 A N +ATOM 1011 CA PRO A 114 40.483 49.995 58.260 1.00 15.00 A C +ATOM 1012 CB PRO A 114 41.241 50.690 59.392 1.00 15.00 A C +ATOM 1013 CG PRO A 114 42.644 50.766 58.903 1.00 15.00 A C +ATOM 1014 CD PRO A 114 42.550 50.981 57.423 1.00 15.00 A C +ATOM 1015 C PRO A 114 39.060 50.538 58.167 1.00 15.00 A C +ATOM 1016 O PRO A 114 38.855 51.719 57.871 1.00 15.00 A O +ATOM 1017 N LYS A 115 38.089 49.652 58.406 1.00 15.00 A N +ATOM 1018 HN LYS A 115 38.341 48.731 58.628 1.00 15.00 A H +ATOM 1019 CA LYS A 115 36.664 49.996 58.353 1.00 15.00 A C +ATOM 1020 CB LYS A 115 36.329 51.188 59.257 1.00 15.00 A C +ATOM 1021 CG LYS A 115 36.563 50.936 60.738 1.00 15.00 A C +ATOM 1022 CD LYS A 115 36.184 52.152 61.564 1.00 15.00 A C +ATOM 1023 CE LYS A 115 36.174 51.830 63.048 1.00 15.00 A C +ATOM 1024 NZ LYS A 115 34.883 52.209 63.684 1.00 15.00 A N +ATOM 1025 HZ1 LYS A 115 34.708 53.227 63.558 1.00 15.00 A H +ATOM 1026 HZ2 LYS A 115 34.908 51.996 64.701 1.00 15.00 A H +ATOM 1027 HZ3 LYS A 115 34.102 51.678 63.248 1.00 15.00 A H +ATOM 1028 C LYS A 115 36.177 50.241 56.923 1.00 15.00 A C +ATOM 1029 O LYS A 115 35.110 50.822 56.719 1.00 15.00 A O +ATOM 1030 N ASP A 116 36.967 49.788 55.941 1.00 15.00 A N +ATOM 1031 HN ASP A 116 37.803 49.337 56.180 1.00 15.00 A H +ATOM 1032 CA ASP A 116 36.635 49.944 54.521 1.00 15.00 A C +ATOM 1033 CB ASP A 116 35.341 49.205 54.158 1.00 15.00 A C +ATOM 1034 CG ASP A 116 35.552 47.718 53.959 1.00 15.00 A C +ATOM 1035 OD1 ASP A 116 35.352 46.954 54.926 1.00 15.00 A O +ATOM 1036 OD2 ASP A 116 35.917 47.315 52.833 1.00 15.00 A O +ATOM 1037 C ASP A 116 36.557 51.407 54.091 1.00 15.00 A C +ATOM 1038 O ASP A 116 35.818 51.751 53.166 1.00 15.00 A O +ATOM 1039 N VAL A 117 37.331 52.266 54.753 1.00 15.00 A N +ATOM 1040 HN VAL A 117 37.905 51.937 55.475 1.00 15.00 A H +ATOM 1041 CA VAL A 117 37.337 53.688 54.423 1.00 15.00 A C +ATOM 1042 CB VAL A 117 37.960 54.560 55.534 1.00 15.00 A C +ATOM 1043 CG1 VAL A 117 37.159 54.437 56.821 1.00 15.00 A C +ATOM 1044 CG2 VAL A 117 39.417 54.194 55.769 1.00 15.00 A C +ATOM 1045 C VAL A 117 38.036 53.946 53.091 1.00 15.00 A C +ATOM 1046 O VAL A 117 38.735 53.079 52.565 1.00 15.00 A O +ATOM 1047 N LYS A 118 37.841 55.140 52.551 1.00 15.00 A N +ATOM 1048 HN LYS A 118 37.285 55.795 53.025 1.00 15.00 A H +ATOM 1049 CA LYS A 118 38.430 55.502 51.269 1.00 15.00 A C +ATOM 1050 CB LYS A 118 37.428 56.296 50.427 1.00 15.00 A C +ATOM 1051 CG LYS A 118 36.107 55.586 50.183 1.00 15.00 A C +ATOM 1052 CD LYS A 118 35.102 56.518 49.526 1.00 15.00 A C +ATOM 1053 CE LYS A 118 33.760 55.837 49.316 1.00 15.00 A C +ATOM 1054 NZ LYS A 118 32.764 56.764 48.711 1.00 15.00 A N +ATOM 1055 HZ1 LYS A 118 32.601 57.574 49.344 1.00 15.00 A H +ATOM 1056 HZ2 LYS A 118 31.862 56.272 48.558 1.00 15.00 A H +ATOM 1057 HZ3 LYS A 118 33.114 57.118 47.798 1.00 15.00 A H +ATOM 1058 C LYS A 118 39.731 56.293 51.407 1.00 15.00 A C +ATOM 1059 O LYS A 118 40.380 56.585 50.401 1.00 15.00 A O +ATOM 1060 N ILE A 119 40.124 56.640 52.637 1.00 15.00 A N +ATOM 1061 HN ILE A 119 39.586 56.379 53.413 1.00 15.00 A H +ATOM 1062 CA ILE A 119 41.354 57.408 52.826 1.00 15.00 A C +ATOM 1063 CB ILE A 119 41.177 58.881 52.381 1.00 15.00 A C +ATOM 1064 CG1 ILE A 119 42.527 59.601 52.300 1.00 15.00 A C +ATOM 1065 CG2 ILE A 119 40.216 59.623 53.302 1.00 15.00 A C +ATOM 1066 CD1 ILE A 119 42.452 60.978 51.683 1.00 15.00 A C +ATOM 1067 C ILE A 119 41.909 57.356 54.256 1.00 15.00 A C +ATOM 1068 O ILE A 119 41.164 57.298 55.234 1.00 15.00 A O +ATOM 1069 N GLU A 120 43.238 57.358 54.346 1.00 15.00 A N +ATOM 1070 HN GLU A 120 43.762 57.352 53.517 1.00 15.00 A H +ATOM 1071 CA GLU A 120 43.953 57.358 55.619 1.00 15.00 A C +ATOM 1072 CB GLU A 120 44.427 55.952 55.984 1.00 15.00 A C +ATOM 1073 CG GLU A 120 45.051 55.860 57.368 1.00 15.00 A C +ATOM 1074 CD GLU A 120 45.543 54.468 57.695 1.00 15.00 A C +ATOM 1075 OE1 GLU A 120 46.631 54.348 58.297 1.00 15.00 A O +ATOM 1076 OE2 GLU A 120 44.841 53.498 57.349 1.00 15.00 A O +ATOM 1077 C GLU A 120 45.149 58.297 55.496 1.00 15.00 A C +ATOM 1078 O GLU A 120 45.953 58.159 54.575 1.00 15.00 A O +ATOM 1079 N ILE A 121 45.269 59.254 56.411 1.00 15.00 A N +ATOM 1080 HN ILE A 121 44.620 59.308 57.144 1.00 15.00 A H +ATOM 1081 CA ILE A 121 46.359 60.221 56.334 1.00 15.00 A C +ATOM 1082 CB ILE A 121 45.834 61.626 55.951 1.00 15.00 A C +ATOM 1083 CG1 ILE A 121 44.964 61.559 54.690 1.00 15.00 A C +ATOM 1084 CG2 ILE A 121 46.989 62.598 55.748 1.00 15.00 A C +ATOM 1085 CD1 ILE A 121 44.188 62.827 54.411 1.00 15.00 A C +ATOM 1086 C ILE A 121 47.177 60.338 57.620 1.00 15.00 A C +ATOM 1087 O ILE A 121 46.647 60.663 58.683 1.00 15.00 A O +ATOM 1088 N GLU A 122 48.475 60.062 57.504 1.00 15.00 A N +ATOM 1089 HN GLU A 122 48.817 59.753 56.640 1.00 15.00 A H +ATOM 1090 CA GLU A 122 49.406 60.202 58.621 1.00 15.00 A C +ATOM 1091 CB GLU A 122 50.345 58.993 58.722 1.00 15.00 A C +ATOM 1092 CG GLU A 122 51.197 58.749 57.485 1.00 15.00 A C +ATOM 1093 CD GLU A 122 52.358 57.803 57.738 1.00 15.00 A C +ATOM 1094 OE1 GLU A 122 53.339 57.849 56.968 1.00 15.00 A O +ATOM 1095 OE2 GLU A 122 52.292 57.019 58.706 1.00 15.00 A O +ATOM 1096 C GLU A 122 50.204 61.484 58.389 1.00 15.00 A C +ATOM 1097 O GLU A 122 50.412 61.874 57.240 1.00 15.00 A O +ATOM 1098 N ALA A 123 50.652 62.148 59.450 1.00 15.00 A N +ATOM 1099 HN ALA A 123 50.493 61.796 60.351 1.00 15.00 A H +ATOM 1100 CA ALA A 123 51.384 63.398 59.272 1.00 15.00 A C +ATOM 1101 CB ALA A 123 50.425 64.579 59.276 1.00 15.00 A C +ATOM 1102 C ALA A 123 52.503 63.621 60.282 1.00 15.00 A C +ATOM 1103 O ALA A 123 52.478 63.105 61.400 1.00 15.00 A O +ATOM 1104 N ILE A 124 53.482 64.413 59.853 1.00 15.00 A N +ATOM 1105 HN ILE A 124 53.428 64.767 58.941 1.00 15.00 A H +ATOM 1106 CA ILE A 124 54.633 64.774 60.667 1.00 15.00 A C +ATOM 1107 CB ILE A 124 55.939 64.211 60.055 1.00 15.00 A C +ATOM 1108 CG1 ILE A 124 55.916 62.677 60.054 1.00 15.00 A C +ATOM 1109 CG2 ILE A 124 57.163 64.732 60.798 1.00 15.00 A C +ATOM 1110 CD1 ILE A 124 57.111 62.040 59.380 1.00 15.00 A C +ATOM 1111 C ILE A 124 54.728 66.299 60.742 1.00 15.00 A C +ATOM 1112 O ILE A 124 54.742 66.972 59.715 1.00 15.00 A O +ATOM 1113 N ALA A 125 54.777 66.838 61.956 1.00 15.00 A N +ATOM 1114 HN ALA A 125 54.765 66.250 62.741 1.00 15.00 A H +ATOM 1115 CA ALA A 125 54.855 68.283 62.150 1.00 15.00 A C +ATOM 1116 CB ALA A 125 53.575 68.795 62.794 1.00 15.00 A C +ATOM 1117 C ALA A 125 56.065 68.661 62.999 1.00 15.00 A C +ATOM 1118 O ALA A 125 56.557 67.853 63.778 1.00 15.00 A O +ATOM 1119 N VAL A 126 56.544 69.891 62.841 1.00 15.00 A N +ATOM 1120 HN VAL A 126 56.114 70.496 62.202 1.00 15.00 A H +ATOM 1121 CA VAL A 126 57.700 70.362 63.601 1.00 15.00 A C +ATOM 1122 CB VAL A 126 58.988 70.410 62.747 1.00 15.00 A C +ATOM 1123 CG1 VAL A 126 59.488 69.007 62.442 1.00 15.00 A C +ATOM 1124 CG2 VAL A 126 58.759 71.193 61.463 1.00 15.00 A C +ATOM 1125 C VAL A 126 57.448 71.735 64.216 1.00 15.00 A C +ATOM 1126 O VAL A 126 56.688 72.539 63.677 1.00 15.00 A O +ATOM 1127 N ARG A 127 58.088 71.995 65.353 1.00 15.00 A N +ATOM 1128 HN ARG A 127 58.673 71.309 65.739 1.00 15.00 A H +ATOM 1129 CA ARG A 127 57.942 73.272 66.042 1.00 15.00 A C +ATOM 1130 CB ARG A 127 58.246 73.119 67.535 1.00 15.00 A C +ATOM 1131 CG ARG A 127 57.455 72.012 68.216 1.00 15.00 A C +ATOM 1132 CD ARG A 127 57.520 72.134 69.728 1.00 15.00 A C +ATOM 1133 NE ARG A 127 56.782 71.065 70.403 1.00 15.00 A N +ATOM 1134 HE ARG A 127 57.276 70.249 70.633 1.00 15.00 A H +ATOM 1135 CZ ARG A 127 55.491 71.134 70.709 1.00 15.00 A C +ATOM 1136 NH1 ARG A 127 54.789 72.216 70.403 1.00 15.00 A N +ATOM 1137 HH11 ARG A 127 53.779 72.267 70.644 1.00 15.00 A H +ATOM 1138 HH12 ARG A 127 55.249 73.014 69.917 1.00 15.00 A H +ATOM 1139 NH2 ARG A 127 54.903 70.125 71.335 1.00 15.00 A N +ATOM 1140 HH21 ARG A 127 55.450 69.275 71.586 1.00 15.00 A H +ATOM 1141 HH22 ARG A 127 53.892 70.181 71.575 1.00 15.00 A H +ATOM 1142 C ARG A 127 58.843 74.331 65.412 1.00 15.00 A C +ATOM 1143 O ARG A 127 58.460 75.495 65.290 1.00 15.00 A O +ATOM 1144 N ARG A 128 60.044 73.918 65.017 1.00 15.00 A N +ATOM 1145 HN ARG A 128 60.297 72.982 65.163 1.00 15.00 A H +ATOM 1146 CA ARG A 128 60.996 74.818 64.378 1.00 15.00 A C +ATOM 1147 CB ARG A 128 62.364 74.729 65.054 1.00 15.00 A C +ATOM 1148 CG ARG A 128 62.596 75.776 66.129 1.00 15.00 A C +ATOM 1149 CD ARG A 128 64.026 75.724 66.636 1.00 15.00 A C +ATOM 1150 NE ARG A 128 64.711 77.007 66.487 1.00 15.00 A N +ATOM 1151 HE ARG A 128 64.288 77.686 65.919 1.00 15.00 A H +ATOM 1152 CZ ARG A 128 65.871 77.291 67.072 1.00 15.00 A C +ATOM 1153 NH1 ARG A 128 66.463 76.386 67.839 1.00 15.00 A N +ATOM 1154 HH11 ARG A 128 66.020 75.455 67.979 1.00 15.00 A H +ATOM 1155 HH12 ARG A 128 67.369 76.606 68.299 1.00 15.00 A H +ATOM 1156 NH2 ARG A 128 66.435 78.479 66.897 1.00 15.00 A N +ATOM 1157 HH21 ARG A 128 65.972 79.192 66.299 1.00 15.00 A H +ATOM 1158 HH22 ARG A 128 67.342 78.698 67.359 1.00 15.00 A H +ATOM 1159 C ARG A 128 61.131 74.498 62.895 1.00 15.00 A C +ATOM 1160 O ARG A 128 61.245 73.334 62.510 1.00 15.00 A O +ATOM 1161 N SER B 2 62.025 75.204 59.750 1.00 15.00 B N +ATOM 1162 HN SER B 2 62.201 76.164 59.657 1.00 15.00 B H +ATOM 1163 CA SER B 2 61.977 74.369 58.556 1.00 15.00 B C +ATOM 1164 CB SER B 2 60.889 73.300 58.691 1.00 15.00 B C +ATOM 1165 OG SER B 2 59.605 73.890 58.803 1.00 15.00 B O +ATOM 1166 HG SER B 2 59.622 74.768 58.414 1.00 15.00 B H +ATOM 1167 C SER B 2 61.740 75.209 57.303 1.00 15.00 B C +ATOM 1168 O SER B 2 61.211 76.318 57.381 1.00 15.00 B O +ATOM 1169 N LYS B 3 62.133 74.673 56.148 1.00 15.00 B N +ATOM 1170 HN LYS B 3 62.549 73.786 56.151 1.00 15.00 B H +ATOM 1171 CA LYS B 3 61.962 75.376 54.879 1.00 15.00 B C +ATOM 1172 CB LYS B 3 63.228 76.166 54.521 1.00 15.00 B C +ATOM 1173 CG LYS B 3 64.413 75.303 54.116 1.00 15.00 B C +ATOM 1174 CD LYS B 3 65.692 76.119 53.996 1.00 15.00 B C +ATOM 1175 CE LYS B 3 66.247 76.485 55.364 1.00 15.00 B C +ATOM 1176 NZ LYS B 3 67.647 76.988 55.281 1.00 15.00 B N +ATOM 1177 HZ1 LYS B 3 68.266 76.255 54.878 1.00 15.00 B H +ATOM 1178 HZ2 LYS B 3 67.995 77.235 56.229 1.00 15.00 B H +ATOM 1179 HZ3 LYS B 3 67.689 77.833 54.677 1.00 15.00 B H +ATOM 1180 C LYS B 3 61.590 74.416 53.746 1.00 15.00 B C +ATOM 1181 O LYS B 3 61.767 73.204 53.861 1.00 15.00 B O +ATOM 1182 N THR B 4 61.072 74.974 52.658 1.00 15.00 B N +ATOM 1183 HN THR B 4 60.946 75.945 52.636 1.00 15.00 B H +ATOM 1184 CA THR B 4 60.672 74.185 51.494 1.00 15.00 B C +ATOM 1185 CB THR B 4 59.544 74.903 50.714 1.00 15.00 B C +ATOM 1186 OG1 THR B 4 58.344 74.917 51.496 1.00 15.00 B O +ATOM 1187 HG1 THR B 4 57.636 75.326 50.992 1.00 15.00 B H +ATOM 1188 CG2 THR B 4 59.268 74.229 49.377 1.00 15.00 B C +ATOM 1189 C THR B 4 61.854 73.949 50.550 1.00 15.00 B C +ATOM 1190 O THR B 4 62.646 74.856 50.292 1.00 15.00 B O +ATOM 1191 N ILE B 5 61.970 72.721 50.047 1.00 15.00 B N +ATOM 1192 HN ILE B 5 61.324 72.033 50.315 1.00 15.00 B H +ATOM 1193 CA ILE B 5 63.031 72.373 49.110 1.00 15.00 B C +ATOM 1194 CB ILE B 5 63.599 70.958 49.369 1.00 15.00 B C +ATOM 1195 CG1 ILE B 5 64.150 70.853 50.795 1.00 15.00 B C +ATOM 1196 CG2 ILE B 5 64.685 70.627 48.355 1.00 15.00 B C +ATOM 1197 CD1 ILE B 5 64.693 69.485 51.146 1.00 15.00 B C +ATOM 1198 C ILE B 5 62.499 72.452 47.681 1.00 15.00 B C +ATOM 1199 O ILE B 5 61.668 71.640 47.271 1.00 15.00 B O +ATOM 1200 N ALA B 6 62.971 73.445 46.932 1.00 15.00 B N +ATOM 1201 HN ALA B 6 63.631 74.059 47.315 1.00 15.00 B H +ATOM 1202 CA ALA B 6 62.533 73.637 45.555 1.00 15.00 B C +ATOM 1203 CB ALA B 6 61.766 74.944 45.420 1.00 15.00 B C +ATOM 1204 C ALA B 6 63.707 73.602 44.581 1.00 15.00 B C +ATOM 1205 O ALA B 6 64.601 74.446 44.637 1.00 15.00 B O +ATOM 1206 N THR B 7 63.691 72.617 43.689 1.00 15.00 B N +ATOM 1207 HN THR B 7 62.950 71.974 43.702 1.00 15.00 B H +ATOM 1208 CA THR B 7 64.742 72.462 42.693 1.00 15.00 B C +ATOM 1209 CB THR B 7 65.769 71.377 43.096 1.00 15.00 B C +ATOM 1210 OG1 THR B 7 66.760 71.233 42.069 1.00 15.00 B O +ATOM 1211 HG1 THR B 7 67.300 70.461 42.250 1.00 15.00 B H +ATOM 1212 CG2 THR B 7 65.090 70.036 43.339 1.00 15.00 B C +ATOM 1213 C THR B 7 64.163 72.154 41.311 1.00 15.00 B C +ATOM 1214 O THR B 7 63.147 71.470 41.183 1.00 15.00 B O +ATOM 1215 N GLU B 8 64.825 72.674 40.282 1.00 15.00 B N +ATOM 1216 HN GLU B 8 65.625 73.213 40.458 1.00 15.00 B H +ATOM 1217 CA GLU B 8 64.404 72.472 38.898 1.00 15.00 B C +ATOM 1218 CB GLU B 8 64.957 73.602 38.015 1.00 15.00 B C +ATOM 1219 CG GLU B 8 66.444 73.479 37.682 1.00 15.00 B C +ATOM 1220 CD GLU B 8 67.367 74.098 38.722 1.00 15.00 B C +ATOM 1221 OE1 GLU B 8 66.900 74.401 39.840 1.00 15.00 B O +ATOM 1222 OE2 GLU B 8 68.563 74.277 38.415 1.00 15.00 B O +ATOM 1223 C GLU B 8 64.890 71.125 38.369 1.00 15.00 B C +ATOM 1224 O GLU B 8 64.506 70.692 37.281 1.00 15.00 B O +ATOM 1225 N ASN B 9 65.733 70.467 39.160 1.00 15.00 B N +ATOM 1226 HN ASN B 9 65.980 70.862 40.021 1.00 15.00 B H +ATOM 1227 CA ASN B 9 66.294 69.175 38.786 1.00 15.00 B C +ATOM 1228 CB ASN B 9 67.634 68.963 39.494 1.00 15.00 B C +ATOM 1229 CG ASN B 9 68.678 69.964 39.035 1.00 15.00 B C +ATOM 1230 OD1 ASN B 9 68.758 70.296 37.852 1.00 15.00 B O +ATOM 1231 ND2 ASN B 9 69.476 70.466 39.972 1.00 15.00 B N +ATOM 1232 HD21 ASN B 9 69.351 70.168 40.896 1.00 15.00 B H +ATOM 1233 HD22 ASN B 9 70.156 71.118 39.698 1.00 15.00 B H +ATOM 1234 C ASN B 9 65.321 68.033 39.072 1.00 15.00 B C +ATOM 1235 O ASN B 9 65.587 66.878 38.745 1.00 15.00 B O +ATOM 1236 N ALA B 10 64.194 68.375 39.688 1.00 15.00 B N +ATOM 1237 HN ALA B 10 64.057 69.311 39.943 1.00 15.00 B H +ATOM 1238 CA ALA B 10 63.155 67.403 40.001 1.00 15.00 B C +ATOM 1239 CB ALA B 10 63.074 67.190 41.507 1.00 15.00 B C +ATOM 1240 C ALA B 10 61.818 67.901 39.456 1.00 15.00 B C +ATOM 1241 O ALA B 10 61.637 69.108 39.285 1.00 15.00 B O +ATOM 1242 N PRO B 11 60.872 66.983 39.151 1.00 15.00 B N +ATOM 1243 CA PRO B 11 59.545 67.345 38.631 1.00 15.00 B C +ATOM 1244 CB PRO B 11 58.764 66.034 38.715 1.00 15.00 B C +ATOM 1245 CG PRO B 11 59.806 64.979 38.599 1.00 15.00 B C +ATOM 1246 CD PRO B 11 61.031 65.524 39.277 1.00 15.00 B C +ATOM 1247 C PRO B 11 58.876 68.412 39.491 1.00 15.00 B C +ATOM 1248 O PRO B 11 58.752 68.253 40.707 1.00 15.00 B O +ATOM 1249 N ALA B 12 58.455 69.498 38.846 1.00 15.00 B N +ATOM 1250 HN ALA B 12 58.578 69.547 37.874 1.00 15.00 B H +ATOM 1251 CA ALA B 12 57.818 70.619 39.532 1.00 15.00 B C +ATOM 1252 CB ALA B 12 57.447 71.707 38.536 1.00 15.00 B C +ATOM 1253 C ALA B 12 56.595 70.195 40.340 1.00 15.00 B C +ATOM 1254 O ALA B 12 55.773 69.400 39.880 1.00 15.00 B O +ATOM 1255 N ALA B 13 56.494 70.732 41.553 1.00 15.00 B N +ATOM 1256 HN ALA B 13 57.193 71.346 41.862 1.00 15.00 B H +ATOM 1257 CA ALA B 13 55.375 70.436 42.438 1.00 15.00 B C +ATOM 1258 CB ALA B 13 55.766 70.720 43.881 1.00 15.00 B C +ATOM 1259 C ALA B 13 54.151 71.258 42.037 1.00 15.00 B C +ATOM 1260 O ALA B 13 53.971 72.388 42.489 1.00 15.00 B O +ATOM 1261 N ILE B 14 53.319 70.677 41.177 1.00 15.00 B N +ATOM 1262 HN ILE B 14 53.518 69.770 40.866 1.00 15.00 B H +ATOM 1263 CA ILE B 14 52.122 71.348 40.680 1.00 15.00 B C +ATOM 1264 CB ILE B 14 51.712 70.805 39.292 1.00 15.00 B C +ATOM 1265 CG1 ILE B 14 52.886 70.907 38.313 1.00 15.00 B C +ATOM 1266 CG2 ILE B 14 50.503 71.560 38.755 1.00 15.00 B C +ATOM 1267 CD1 ILE B 14 52.648 70.222 36.986 1.00 15.00 B C +ATOM 1268 C ILE B 14 50.944 71.220 41.644 1.00 15.00 B C +ATOM 1269 O ILE B 14 50.220 72.188 41.881 1.00 15.00 B O +ATOM 1270 N GLY B 15 50.753 70.025 42.198 1.00 15.00 B N +ATOM 1271 HN GLY B 15 51.365 69.290 41.982 1.00 15.00 B H +ATOM 1272 CA GLY B 15 49.654 69.804 43.121 1.00 15.00 B C +ATOM 1273 C GLY B 15 49.887 70.449 44.474 1.00 15.00 B C +ATOM 1274 O GLY B 15 50.854 71.193 44.650 1.00 15.00 B O +ATOM 1275 N PRO B 16 49.006 70.189 45.455 1.00 15.00 B N +ATOM 1276 CA PRO B 16 49.140 70.749 46.799 1.00 15.00 B C +ATOM 1277 CB PRO B 16 47.752 70.553 47.410 1.00 15.00 B C +ATOM 1278 CG PRO B 16 47.150 69.405 46.669 1.00 15.00 B C +ATOM 1279 CD PRO B 16 47.806 69.345 45.316 1.00 15.00 B C +ATOM 1280 C PRO B 16 50.206 70.026 47.623 1.00 15.00 B C +ATOM 1281 O PRO B 16 49.898 69.314 48.581 1.00 15.00 B O +ATOM 1282 N TYR B 17 51.466 70.223 47.237 1.00 15.00 B N +ATOM 1283 HN TYR B 17 51.638 70.805 46.465 1.00 15.00 B H +ATOM 1284 CA TYR B 17 52.597 69.604 47.918 1.00 15.00 B C +ATOM 1285 CB TYR B 17 52.642 68.098 47.614 1.00 15.00 B C +ATOM 1286 CG TYR B 17 52.975 67.775 46.170 1.00 15.00 B C +ATOM 1287 CD1 TYR B 17 54.282 67.510 45.778 1.00 15.00 B C +ATOM 1288 CD2 TYR B 17 51.984 67.741 45.198 1.00 15.00 B C +ATOM 1289 CE1 TYR B 17 54.593 67.236 44.461 1.00 15.00 B C +ATOM 1290 CE2 TYR B 17 52.284 67.461 43.880 1.00 15.00 B C +ATOM 1291 CZ TYR B 17 53.589 67.209 43.516 1.00 15.00 B C +ATOM 1292 OH TYR B 17 53.893 66.940 42.202 1.00 15.00 B O +ATOM 1293 HH TYR B 17 54.543 66.235 42.160 1.00 15.00 B H +ATOM 1294 C TYR B 17 53.908 70.238 47.466 1.00 15.00 B C +ATOM 1295 O TYR B 17 53.962 70.917 46.441 1.00 15.00 B O +ATOM 1296 N VAL B 18 54.957 70.025 48.250 1.00 15.00 B N +ATOM 1297 HN VAL B 18 54.834 69.521 49.082 1.00 15.00 B H +ATOM 1298 CA VAL B 18 56.285 70.523 47.915 1.00 15.00 B C +ATOM 1299 CB VAL B 18 56.889 71.396 49.035 1.00 15.00 B C +ATOM 1300 CG1 VAL B 18 56.104 72.690 49.184 1.00 15.00 B C +ATOM 1301 CG2 VAL B 18 56.942 70.637 50.354 1.00 15.00 B C +ATOM 1302 C VAL B 18 57.199 69.334 47.641 1.00 15.00 B C +ATOM 1303 O VAL B 18 56.916 68.229 48.094 1.00 15.00 B O +ATOM 1304 N GLN B 19 58.277 69.551 46.895 1.00 15.00 B N +ATOM 1305 HN GLN B 19 58.450 70.454 46.553 1.00 15.00 B H +ATOM 1306 CA GLN B 19 59.212 68.472 46.563 1.00 15.00 B C +ATOM 1307 CB GLN B 19 60.306 68.973 45.624 1.00 15.00 B C +ATOM 1308 CG GLN B 19 59.819 69.300 44.222 1.00 15.00 B C +ATOM 1309 CD GLN B 19 60.856 70.060 43.424 1.00 15.00 B C +ATOM 1310 OE1 GLN B 19 61.656 70.800 43.987 1.00 15.00 B O +ATOM 1311 NE2 GLN B 19 60.848 69.884 42.111 1.00 15.00 B N +ATOM 1312 HE21 GLN B 19 60.180 69.277 41.729 1.00 15.00 B H +ATOM 1313 HE22 GLN B 19 61.513 70.367 41.575 1.00 15.00 B H +ATOM 1314 C GLN B 19 59.831 67.828 47.804 1.00 15.00 B C +ATOM 1315 O GLN B 19 60.007 66.612 47.857 1.00 15.00 B O +ATOM 1316 N GLY B 20 60.157 68.648 48.797 1.00 15.00 B N +ATOM 1317 HN GLY B 20 59.990 69.607 48.701 1.00 15.00 B H +ATOM 1318 CA GLY B 20 60.752 68.141 50.021 1.00 15.00 B C +ATOM 1319 C GLY B 20 60.808 69.198 51.104 1.00 15.00 B C +ATOM 1320 O GLY B 20 60.479 70.357 50.857 1.00 15.00 B O +ATOM 1321 N VAL B 21 61.224 68.805 52.306 1.00 15.00 B N +ATOM 1322 HN VAL B 21 61.471 67.867 52.446 1.00 15.00 B H +ATOM 1323 CA VAL B 21 61.313 69.743 53.421 1.00 15.00 B C +ATOM 1324 CB VAL B 21 60.145 69.588 54.423 1.00 15.00 B C +ATOM 1325 CG1 VAL B 21 58.860 70.168 53.849 1.00 15.00 B C +ATOM 1326 CG2 VAL B 21 59.951 68.130 54.817 1.00 15.00 B C +ATOM 1327 C VAL B 21 62.639 69.642 54.171 1.00 15.00 B C +ATOM 1328 O VAL B 21 63.132 68.551 54.458 1.00 15.00 B O +ATOM 1329 N ASP B 22 63.209 70.803 54.471 1.00 15.00 B N +ATOM 1330 HN ASP B 22 62.772 71.631 54.183 1.00 15.00 B H +ATOM 1331 CA ASP B 22 64.462 70.893 55.207 1.00 15.00 B C +ATOM 1332 CB ASP B 22 65.367 71.941 54.546 1.00 15.00 B C +ATOM 1333 CG ASP B 22 66.783 71.981 55.097 1.00 15.00 B C +ATOM 1334 OD1 ASP B 22 67.621 72.693 54.507 1.00 15.00 B O +ATOM 1335 OD2 ASP B 22 67.056 71.309 56.114 1.00 15.00 B O +ATOM 1336 C ASP B 22 64.153 71.293 56.648 1.00 15.00 B C +ATOM 1337 O ASP B 22 63.896 72.461 56.934 1.00 15.00 B O +ATOM 1338 N LEU B 23 64.169 70.314 57.546 1.00 15.00 B N +ATOM 1339 HN LEU B 23 64.397 69.406 57.256 1.00 15.00 B H +ATOM 1340 CA LEU B 23 63.864 70.556 58.957 1.00 15.00 B C +ATOM 1341 CB LEU B 23 63.075 69.374 59.529 1.00 15.00 B C +ATOM 1342 CG LEU B 23 62.059 68.720 58.592 1.00 15.00 B C +ATOM 1343 CD1 LEU B 23 61.515 67.441 59.205 1.00 15.00 B C +ATOM 1344 CD2 LEU B 23 60.930 69.683 58.266 1.00 15.00 B C +ATOM 1345 C LEU B 23 65.131 70.764 59.780 1.00 15.00 B C +ATOM 1346 O LEU B 23 65.110 70.657 61.007 1.00 15.00 B O +ATOM 1347 N GLY B 24 66.228 71.072 59.103 1.00 15.00 B N +ATOM 1348 HN GLY B 24 66.185 71.157 58.127 1.00 15.00 B H +ATOM 1349 CA GLY B 24 67.485 71.274 59.789 1.00 15.00 B C +ATOM 1350 C GLY B 24 68.410 70.098 59.584 1.00 15.00 B C +ATOM 1351 O GLY B 24 69.072 70.001 58.559 1.00 15.00 B O +ATOM 1352 N ASN B 25 68.442 69.189 60.552 1.00 15.00 B N +ATOM 1353 HN ASN B 25 67.884 69.314 61.347 1.00 15.00 B H +ATOM 1354 CA ASN B 25 69.290 68.008 60.454 1.00 15.00 B C +ATOM 1355 CB ASN B 25 69.581 67.435 61.846 1.00 15.00 B C +ATOM 1356 CG ASN B 25 70.429 66.176 61.799 1.00 15.00 B C +ATOM 1357 OD1 ASN B 25 71.584 66.210 61.378 1.00 15.00 B O +ATOM 1358 ND2 ASN B 25 69.859 65.059 62.235 1.00 15.00 B N +ATOM 1359 HD21 ASN B 25 68.935 65.106 62.559 1.00 15.00 B H +ATOM 1360 HD22 ASN B 25 70.384 64.232 62.215 1.00 15.00 B H +ATOM 1361 C ASN B 25 68.644 66.947 59.569 1.00 15.00 B C +ATOM 1362 O ASN B 25 69.329 66.244 58.831 1.00 15.00 B O +ATOM 1363 N MET B 26 67.320 66.853 59.633 1.00 15.00 B N +ATOM 1364 HN MET B 26 66.824 67.462 60.219 1.00 15.00 B H +ATOM 1365 CA MET B 26 66.588 65.871 58.846 1.00 15.00 B C +ATOM 1366 CB MET B 26 65.558 65.143 59.713 1.00 15.00 B C +ATOM 1367 CG MET B 26 64.714 64.128 58.960 1.00 15.00 B C +ATOM 1368 SD MET B 26 63.655 63.155 60.045 1.00 15.00 B S +ATOM 1369 CE MET B 26 64.874 62.204 60.944 1.00 15.00 B C +ATOM 1370 C MET B 26 65.913 66.487 57.624 1.00 15.00 B C +ATOM 1371 O MET B 26 65.309 67.556 57.699 1.00 15.00 B O +ATOM 1372 N ILE B 27 66.034 65.792 56.499 1.00 15.00 B N +ATOM 1373 HN ILE B 27 66.548 64.958 56.516 1.00 15.00 B H +ATOM 1374 CA ILE B 27 65.434 66.212 55.240 1.00 15.00 B C +ATOM 1375 CB ILE B 27 66.518 66.489 54.162 1.00 15.00 B C +ATOM 1376 CG1 ILE B 27 67.031 67.930 54.264 1.00 15.00 B C +ATOM 1377 CG2 ILE B 27 66.012 66.203 52.753 1.00 15.00 B C +ATOM 1378 CD1 ILE B 27 68.109 68.131 55.306 1.00 15.00 B C +ATOM 1379 C ILE B 27 64.474 65.122 54.761 1.00 15.00 B C +ATOM 1380 O ILE B 27 64.842 63.952 54.687 1.00 15.00 B O +ATOM 1381 N ILE B 28 63.239 65.503 54.463 1.00 15.00 B N +ATOM 1382 HN ILE B 28 62.994 66.448 54.542 1.00 15.00 B H +ATOM 1383 CA ILE B 28 62.241 64.541 54.010 1.00 15.00 B C +ATOM 1384 CB ILE B 28 61.061 64.434 54.999 1.00 15.00 B C +ATOM 1385 CG1 ILE B 28 61.582 64.198 56.422 1.00 15.00 B C +ATOM 1386 CG2 ILE B 28 60.123 63.308 54.586 1.00 15.00 B C +ATOM 1387 CD1 ILE B 28 60.508 64.221 57.486 1.00 15.00 B C +ATOM 1388 C ILE B 28 61.722 64.899 52.622 1.00 15.00 B C +ATOM 1389 O ILE B 28 61.245 66.007 52.393 1.00 15.00 B O +ATOM 1390 N THR B 29 61.816 63.948 51.699 1.00 15.00 B N +ATOM 1391 HN THR B 29 62.193 63.078 51.948 1.00 15.00 B H +ATOM 1392 CA THR B 29 61.366 64.160 50.329 1.00 15.00 B C +ATOM 1393 CB THR B 29 62.363 63.567 49.308 1.00 15.00 B C +ATOM 1394 OG1 THR B 29 62.133 62.159 49.162 1.00 15.00 B O +ATOM 1395 HG1 THR B 29 62.309 61.719 49.996 1.00 15.00 B H +ATOM 1396 CG2 THR B 29 63.800 63.793 49.761 1.00 15.00 B C +ATOM 1397 C THR B 29 59.994 63.531 50.101 1.00 15.00 B C +ATOM 1398 O THR B 29 59.583 62.631 50.836 1.00 15.00 B O +ATOM 1399 N SER B 30 59.287 64.016 49.087 1.00 15.00 B N +ATOM 1400 HN SER B 30 59.659 64.748 48.551 1.00 15.00 B H +ATOM 1401 CA SER B 30 57.970 63.488 48.752 1.00 15.00 B C +ATOM 1402 CB SER B 30 57.180 64.518 47.943 1.00 15.00 B C +ATOM 1403 OG SER B 30 56.931 65.678 48.706 1.00 15.00 B O +ATOM 1404 HG SER B 30 56.836 66.434 48.117 1.00 15.00 B H +ATOM 1405 C SER B 30 58.109 62.217 47.931 1.00 15.00 B C +ATOM 1406 O SER B 30 59.203 61.900 47.457 1.00 15.00 B O +ATOM 1407 N GLY B 31 57.006 61.484 47.780 1.00 15.00 B N +ATOM 1408 HN GLY B 31 56.175 61.767 48.219 1.00 15.00 B H +ATOM 1409 CA GLY B 31 57.026 60.272 46.982 1.00 15.00 B C +ATOM 1410 C GLY B 31 57.386 60.593 45.548 1.00 15.00 B C +ATOM 1411 O GLY B 31 56.570 61.137 44.803 1.00 15.00 B O +ATOM 1412 N GLN B 32 58.616 60.270 45.165 1.00 15.00 B N +ATOM 1413 HN GLN B 32 59.212 59.816 45.798 1.00 15.00 B H +ATOM 1414 CA GLN B 32 59.098 60.565 43.825 1.00 15.00 B C +ATOM 1415 CB GLN B 32 60.617 60.755 43.817 1.00 15.00 B C +ATOM 1416 CG GLN B 32 61.115 62.002 44.533 1.00 15.00 B C +ATOM 1417 CD GLN B 32 60.336 63.251 44.168 1.00 15.00 B C +ATOM 1418 OE1 GLN B 32 60.440 63.760 43.052 1.00 15.00 B O +ATOM 1419 NE2 GLN B 32 59.575 63.769 45.124 1.00 15.00 B N +ATOM 1420 HE21 GLN B 32 59.561 63.321 45.997 1.00 15.00 B H +ATOM 1421 HE22 GLN B 32 59.063 64.579 44.922 1.00 15.00 B H +ATOM 1422 C GLN B 32 58.715 59.505 42.809 1.00 15.00 B C +ATOM 1423 O GLN B 32 59.042 58.328 42.962 1.00 15.00 B O +ATOM 1424 N ILE B 33 58.014 59.938 41.771 1.00 15.00 B N +ATOM 1425 HN ILE B 33 57.757 60.883 41.730 1.00 15.00 B H +ATOM 1426 CA ILE B 33 57.617 59.050 40.692 1.00 15.00 B C +ATOM 1427 CB ILE B 33 56.163 59.302 40.231 1.00 15.00 B C +ATOM 1428 CG1 ILE B 33 55.934 60.780 39.904 1.00 15.00 B C +ATOM 1429 CG2 ILE B 33 55.185 58.829 41.299 1.00 15.00 B C +ATOM 1430 CD1 ILE B 33 54.535 61.088 39.412 1.00 15.00 B C +ATOM 1431 C ILE B 33 58.604 59.208 39.533 1.00 15.00 B C +ATOM 1432 O ILE B 33 59.324 60.206 39.474 1.00 15.00 B O +ATOM 1433 N PRO B 34 58.671 58.225 38.615 1.00 15.00 B N +ATOM 1434 CA PRO B 34 59.606 58.249 37.475 1.00 15.00 B C +ATOM 1435 CB PRO B 34 59.496 56.833 36.908 1.00 15.00 B C +ATOM 1436 CG PRO B 34 58.129 56.387 37.289 1.00 15.00 B C +ATOM 1437 CD PRO B 34 57.859 56.996 38.631 1.00 15.00 B C +ATOM 1438 C PRO B 34 59.288 59.277 36.382 1.00 15.00 B C +ATOM 1439 O PRO B 34 59.234 58.937 35.201 1.00 15.00 B O +ATOM 1440 N VAL B 35 59.106 60.534 36.768 1.00 15.00 B N +ATOM 1441 HN VAL B 35 59.158 60.756 37.721 1.00 15.00 B H +ATOM 1442 CA VAL B 35 58.826 61.591 35.802 1.00 15.00 B C +ATOM 1443 CB VAL B 35 57.725 62.552 36.303 1.00 15.00 B C +ATOM 1444 CG1 VAL B 35 57.581 63.752 35.375 1.00 15.00 B C +ATOM 1445 CG2 VAL B 35 56.399 61.820 36.420 1.00 15.00 B C +ATOM 1446 C VAL B 35 60.097 62.380 35.497 1.00 15.00 B C +ATOM 1447 O VAL B 35 60.757 62.883 36.406 1.00 15.00 B O +ATOM 1448 N ASN B 36 60.445 62.461 34.215 1.00 15.00 B N +ATOM 1449 HN ASN B 36 59.892 62.012 33.543 1.00 15.00 B H +ATOM 1450 CA ASN B 36 61.626 63.198 33.785 1.00 15.00 B C +ATOM 1451 CB ASN B 36 61.922 62.896 32.309 1.00 15.00 B C +ATOM 1452 CG ASN B 36 63.304 63.342 31.859 1.00 15.00 B C +ATOM 1453 OD1 ASN B 36 63.723 64.467 32.108 1.00 15.00 B O +ATOM 1454 ND2 ASN B 36 64.025 62.450 31.192 1.00 15.00 B N +ATOM 1455 HD21 ASN B 36 63.634 61.566 31.029 1.00 15.00 B H +ATOM 1456 HD22 ASN B 36 64.920 62.711 30.889 1.00 15.00 B H +ATOM 1457 C ASN B 36 61.398 64.695 33.992 1.00 15.00 B C +ATOM 1458 O ASN B 36 60.440 65.254 33.476 1.00 15.00 B O +ATOM 1459 N PRO B 37 62.264 65.358 34.773 1.00 15.00 B N +ATOM 1460 CA PRO B 37 62.138 66.799 35.048 1.00 15.00 B C +ATOM 1461 CB PRO B 37 63.219 67.047 36.105 1.00 15.00 B C +ATOM 1462 CG PRO B 37 64.212 65.956 35.895 1.00 15.00 B C +ATOM 1463 CD PRO B 37 63.421 64.759 35.463 1.00 15.00 B C +ATOM 1464 C PRO B 37 62.395 67.679 33.820 1.00 15.00 B C +ATOM 1465 O PRO B 37 62.005 68.846 33.794 1.00 15.00 B O +ATOM 1466 N LYS B 38 63.035 67.109 32.802 1.00 15.00 B N +ATOM 1467 HN LYS B 38 63.293 66.166 32.871 1.00 15.00 B H +ATOM 1468 CA LYS B 38 63.364 67.846 31.585 1.00 15.00 B C +ATOM 1469 CB LYS B 38 64.714 67.372 31.037 1.00 15.00 B C +ATOM 1470 CG LYS B 38 65.159 68.062 29.758 1.00 15.00 B C +ATOM 1471 CD LYS B 38 66.418 67.425 29.196 1.00 15.00 B C +ATOM 1472 CE LYS B 38 67.592 67.570 30.153 1.00 15.00 B C +ATOM 1473 NZ LYS B 38 67.923 68.999 30.411 1.00 15.00 B N +ATOM 1474 HZ1 LYS B 38 68.695 69.069 31.106 1.00 15.00 B H +ATOM 1475 HZ2 LYS B 38 67.089 69.496 30.784 1.00 15.00 B H +ATOM 1476 HZ3 LYS B 38 68.221 69.461 29.529 1.00 15.00 B H +ATOM 1477 C LYS B 38 62.287 67.738 30.501 1.00 15.00 B C +ATOM 1478 O LYS B 38 62.014 68.711 29.797 1.00 15.00 B O +ATOM 1479 N THR B 39 61.677 66.564 30.362 1.00 15.00 B N +ATOM 1480 HN THR B 39 61.913 65.824 30.959 1.00 15.00 B H +ATOM 1481 CA THR B 39 60.653 66.365 29.334 1.00 15.00 B C +ATOM 1482 CB THR B 39 60.977 65.166 28.417 1.00 15.00 B C +ATOM 1483 OG1 THR B 39 61.076 63.964 29.194 1.00 15.00 B O +ATOM 1484 HG1 THR B 39 61.262 64.188 30.107 1.00 15.00 B H +ATOM 1485 CG2 THR B 39 62.284 65.394 27.672 1.00 15.00 B C +ATOM 1486 C THR B 39 59.260 66.176 29.927 1.00 15.00 B C +ATOM 1487 O THR B 39 58.258 66.512 29.298 1.00 15.00 B O +ATOM 1488 N GLY B 40 59.206 65.641 31.139 1.00 15.00 B N +ATOM 1489 HN GLY B 40 60.039 65.408 31.599 1.00 15.00 B H +ATOM 1490 CA GLY B 40 57.931 65.401 31.791 1.00 15.00 B C +ATOM 1491 C GLY B 40 57.367 64.040 31.432 1.00 15.00 B C +ATOM 1492 O GLY B 40 56.248 63.701 31.817 1.00 15.00 B O +ATOM 1493 N GLU B 41 58.158 63.259 30.698 1.00 15.00 B N +ATOM 1494 HN GLU B 41 59.045 63.588 30.441 1.00 15.00 B H +ATOM 1495 CA GLU B 41 57.748 61.929 30.260 1.00 15.00 B C +ATOM 1496 CB GLU B 41 58.329 61.622 28.878 1.00 15.00 B C +ATOM 1497 CG GLU B 41 57.953 62.621 27.796 1.00 15.00 B C +ATOM 1498 CD GLU B 41 58.556 62.262 26.452 1.00 15.00 B C +ATOM 1499 OE1 GLU B 41 59.694 61.745 26.431 1.00 15.00 B O +ATOM 1500 OE2 GLU B 41 57.894 62.499 25.420 1.00 15.00 B O +ATOM 1501 C GLU B 41 58.197 60.854 31.239 1.00 15.00 B C +ATOM 1502 O GLU B 41 59.095 61.069 32.053 1.00 15.00 B O +ATOM 1503 N VAL B 42 57.567 59.689 31.141 1.00 15.00 B N +ATOM 1504 HN VAL B 42 56.862 59.585 30.468 1.00 15.00 B H +ATOM 1505 CA VAL B 42 57.891 58.560 32.004 1.00 15.00 B C +ATOM 1506 CB VAL B 42 56.664 58.120 32.838 1.00 15.00 B C +ATOM 1507 CG1 VAL B 42 56.994 56.914 33.704 1.00 15.00 B C +ATOM 1508 CG2 VAL B 42 56.156 59.270 33.695 1.00 15.00 B C +ATOM 1509 C VAL B 42 58.383 57.375 31.174 1.00 15.00 B C +ATOM 1510 O VAL B 42 57.692 56.924 30.259 1.00 15.00 B O +ATOM 1511 N PRO B 43 59.593 56.865 31.475 1.00 15.00 B N +ATOM 1512 CA PRO B 43 60.171 55.715 30.763 1.00 15.00 B C +ATOM 1513 CB PRO B 43 61.538 55.527 31.434 1.00 15.00 B C +ATOM 1514 CG PRO B 43 61.421 56.217 32.750 1.00 15.00 B C +ATOM 1515 CD PRO B 43 60.492 57.371 32.525 1.00 15.00 B C +ATOM 1516 C PRO B 43 59.320 54.460 30.947 1.00 15.00 B C +ATOM 1517 O PRO B 43 58.744 54.245 32.009 1.00 15.00 B O +ATOM 1518 N ALA B 44 59.234 53.640 29.905 1.00 15.00 B N +ATOM 1519 HN ALA B 44 59.710 53.864 29.079 1.00 15.00 B H +ATOM 1520 CA ALA B 44 58.445 52.413 29.962 1.00 15.00 B C +ATOM 1521 CB ALA B 44 58.160 51.891 28.563 1.00 15.00 B C +ATOM 1522 C ALA B 44 59.133 51.343 30.802 1.00 15.00 B C +ATOM 1523 O ALA B 44 58.491 50.681 31.617 1.00 15.00 B O +ATOM 1524 N ASP B 45 60.441 51.183 30.596 1.00 15.00 B N +ATOM 1525 HN ASP B 45 60.888 51.743 29.927 1.00 15.00 B H +ATOM 1526 CA ASP B 45 61.225 50.194 31.330 1.00 15.00 B C +ATOM 1527 CB ASP B 45 62.686 50.236 30.874 1.00 15.00 B C +ATOM 1528 CG ASP B 45 63.512 49.096 31.434 1.00 15.00 B C +ATOM 1529 OD1 ASP B 45 64.377 49.361 32.289 1.00 15.00 B O +ATOM 1530 OD2 ASP B 45 63.290 47.940 31.018 1.00 15.00 B O +ATOM 1531 C ASP B 45 61.128 50.424 32.837 1.00 15.00 B C +ATOM 1532 O ASP B 45 61.224 51.558 33.308 1.00 15.00 B O +ATOM 1533 N VAL B 46 60.935 49.339 33.585 1.00 15.00 B N +ATOM 1534 HN VAL B 46 60.887 48.465 33.148 1.00 15.00 B H +ATOM 1535 CA VAL B 46 60.803 49.414 35.038 1.00 15.00 B C +ATOM 1536 CB VAL B 46 60.219 48.110 35.632 1.00 15.00 B C +ATOM 1537 CG1 VAL B 46 61.173 46.936 35.455 1.00 15.00 B C +ATOM 1538 CG2 VAL B 46 59.837 48.293 37.094 1.00 15.00 B C +ATOM 1539 C VAL B 46 62.125 49.777 35.719 1.00 15.00 B C +ATOM 1540 O VAL B 46 62.134 50.467 36.738 1.00 15.00 B O +ATOM 1541 N ALA B 47 63.240 49.320 35.147 1.00 15.00 B N +ATOM 1542 HN ALA B 47 63.173 48.774 34.335 1.00 15.00 B H +ATOM 1543 CA ALA B 47 64.558 49.619 35.697 1.00 15.00 B C +ATOM 1544 CB ALA B 47 65.625 48.747 35.053 1.00 15.00 B C +ATOM 1545 C ALA B 47 64.881 51.092 35.493 1.00 15.00 B C +ATOM 1546 O ALA B 47 65.512 51.725 36.339 1.00 15.00 B O +ATOM 1547 N ALA B 48 64.433 51.629 34.359 1.00 15.00 B N +ATOM 1548 HN ALA B 48 63.952 51.060 33.721 1.00 15.00 B H +ATOM 1549 CA ALA B 48 64.642 53.033 34.038 1.00 15.00 B C +ATOM 1550 CB ALA B 48 64.364 53.291 32.565 1.00 15.00 B C +ATOM 1551 C ALA B 48 63.748 53.904 34.915 1.00 15.00 B C +ATOM 1552 O ALA B 48 64.104 55.031 35.256 1.00 15.00 B O +ATOM 1553 N GLN B 49 62.581 53.363 35.278 1.00 15.00 B N +ATOM 1554 HN GLN B 49 62.352 52.466 34.955 1.00 15.00 B H +ATOM 1555 CA GLN B 49 61.637 54.068 36.136 1.00 15.00 B C +ATOM 1556 CB GLN B 49 60.278 53.365 36.142 1.00 15.00 B C +ATOM 1557 CG GLN B 49 59.387 53.717 34.965 1.00 15.00 B C +ATOM 1558 CD GLN B 49 57.928 53.385 35.216 1.00 15.00 B C +ATOM 1559 OE1 GLN B 49 57.474 53.371 36.358 1.00 15.00 B O +ATOM 1560 NE2 GLN B 49 57.183 53.129 34.149 1.00 15.00 B N +ATOM 1561 HE21 GLN B 49 57.610 53.167 33.267 1.00 15.00 B H +ATOM 1562 HE22 GLN B 49 56.237 52.917 34.285 1.00 15.00 B H +ATOM 1563 C GLN B 49 62.176 54.155 37.558 1.00 15.00 B C +ATOM 1564 O GLN B 49 62.001 55.166 38.237 1.00 15.00 B O +ATOM 1565 N ALA B 50 62.835 53.085 37.997 1.00 15.00 B N +ATOM 1566 HN ALA B 50 62.932 52.310 37.404 1.00 15.00 B H +ATOM 1567 CA ALA B 50 63.414 53.032 39.332 1.00 15.00 B C +ATOM 1568 CB ALA B 50 63.876 51.618 39.655 1.00 15.00 B C +ATOM 1569 C ALA B 50 64.573 54.013 39.454 1.00 15.00 B C +ATOM 1570 O ALA B 50 64.754 54.644 40.494 1.00 15.00 B O +ATOM 1571 N ARG B 51 65.344 54.147 38.376 1.00 15.00 B N +ATOM 1572 HN ARG B 51 65.140 53.619 37.575 1.00 15.00 B H +ATOM 1573 CA ARG B 51 66.484 55.056 38.355 1.00 15.00 B C +ATOM 1574 CB ARG B 51 67.429 54.727 37.196 1.00 15.00 B C +ATOM 1575 CG ARG B 51 68.657 55.623 37.128 1.00 15.00 B C +ATOM 1576 CD ARG B 51 69.711 55.066 36.181 1.00 15.00 B C +ATOM 1577 NE ARG B 51 70.358 53.869 36.722 1.00 15.00 B N +ATOM 1578 HE ARG B 51 70.020 53.000 36.422 1.00 15.00 B H +ATOM 1579 CZ ARG B 51 71.381 53.899 37.576 1.00 15.00 B C +ATOM 1580 NH1 ARG B 51 71.866 55.059 38.003 1.00 15.00 B N +ATOM 1581 HH11 ARG B 51 72.665 55.075 38.672 1.00 15.00 B H +ATOM 1582 HH12 ARG B 51 71.454 55.953 37.666 1.00 15.00 B H +ATOM 1583 NH2 ARG B 51 71.913 52.766 38.013 1.00 15.00 B N +ATOM 1584 HH21 ARG B 51 72.711 52.789 38.682 1.00 15.00 B H +ATOM 1585 HH22 ARG B 51 71.537 51.854 37.684 1.00 15.00 B H +ATOM 1586 C ARG B 51 66.032 56.513 38.284 1.00 15.00 B C +ATOM 1587 O ARG B 51 66.654 57.385 38.882 1.00 15.00 B O +ATOM 1588 N GLN B 52 64.945 56.768 37.553 1.00 15.00 B N +ATOM 1589 HN GLN B 52 64.496 56.030 37.091 1.00 15.00 B H +ATOM 1590 CA GLN B 52 64.412 58.120 37.424 1.00 15.00 B C +ATOM 1591 CB GLN B 52 63.343 58.184 36.327 1.00 15.00 B C +ATOM 1592 CG GLN B 52 62.786 59.578 36.060 1.00 15.00 B C +ATOM 1593 CD GLN B 52 63.843 60.567 35.600 1.00 15.00 B C +ATOM 1594 OE1 GLN B 52 64.129 60.678 34.409 1.00 15.00 B O +ATOM 1595 NE2 GLN B 52 64.419 61.302 36.546 1.00 15.00 B N +ATOM 1596 HE21 GLN B 52 64.134 61.167 37.474 1.00 15.00 B H +ATOM 1597 HE22 GLN B 52 65.104 61.948 36.276 1.00 15.00 B H +ATOM 1598 C GLN B 52 63.851 58.601 38.760 1.00 15.00 B C +ATOM 1599 O GLN B 52 64.009 59.764 39.125 1.00 15.00 B O +ATOM 1600 N SER B 53 63.197 57.693 39.484 1.00 15.00 B N +ATOM 1601 HN SER B 53 63.082 56.789 39.124 1.00 15.00 B H +ATOM 1602 CA SER B 53 62.641 58.011 40.795 1.00 15.00 B C +ATOM 1603 CB SER B 53 61.793 56.850 41.318 1.00 15.00 B C +ATOM 1604 OG SER B 53 60.492 56.875 40.765 1.00 15.00 B O +ATOM 1605 HG SER B 53 59.903 57.352 41.356 1.00 15.00 B H +ATOM 1606 C SER B 53 63.763 58.308 41.780 1.00 15.00 B C +ATOM 1607 O SER B 53 63.655 59.213 42.605 1.00 15.00 B O +ATOM 1608 N LEU B 54 64.845 57.535 41.676 1.00 15.00 B N +ATOM 1609 HN LEU B 54 64.859 56.830 40.996 1.00 15.00 B H +ATOM 1610 CA LEU B 54 66.007 57.706 42.540 1.00 15.00 B C +ATOM 1611 CB LEU B 54 66.938 56.496 42.432 1.00 15.00 B C +ATOM 1612 CG LEU B 54 66.482 55.230 43.159 1.00 15.00 B C +ATOM 1613 CD1 LEU B 54 67.319 54.035 42.731 1.00 15.00 B C +ATOM 1614 CD2 LEU B 54 66.556 55.424 44.666 1.00 15.00 B C +ATOM 1615 C LEU B 54 66.761 58.986 42.196 1.00 15.00 B C +ATOM 1616 O LEU B 54 67.318 59.641 43.076 1.00 15.00 B O +ATOM 1617 N ASP B 55 66.772 59.336 40.907 1.00 15.00 B N +ATOM 1618 HN ASP B 55 66.321 58.760 40.254 1.00 15.00 B H +ATOM 1619 CA ASP B 55 67.439 60.549 40.442 1.00 15.00 B C +ATOM 1620 CB ASP B 55 67.558 60.562 38.915 1.00 15.00 B C +ATOM 1621 CG ASP B 55 68.804 59.858 38.410 1.00 15.00 B C +ATOM 1622 OD1 ASP B 55 68.764 59.314 37.286 1.00 15.00 B O +ATOM 1623 OD2 ASP B 55 69.820 59.854 39.136 1.00 15.00 B O +ATOM 1624 C ASP B 55 66.689 61.785 40.916 1.00 15.00 B C +ATOM 1625 O ASP B 55 67.292 62.824 41.183 1.00 15.00 B O +ATOM 1626 N ASN B 56 65.365 61.661 41.018 1.00 15.00 B N +ATOM 1627 HN ASN B 56 64.946 60.809 40.772 1.00 15.00 B H +ATOM 1628 CA ASN B 56 64.524 62.758 41.483 1.00 15.00 B C +ATOM 1629 CB ASN B 56 63.052 62.494 41.165 1.00 15.00 B C +ATOM 1630 CG ASN B 56 62.736 62.622 39.687 1.00 15.00 B C +ATOM 1631 OD1 ASN B 56 63.469 63.267 38.936 1.00 15.00 B O +ATOM 1632 ND2 ASN B 56 61.633 62.020 39.265 1.00 15.00 B N +ATOM 1633 HD21 ASN B 56 61.091 61.533 39.920 1.00 15.00 B H +ATOM 1634 HD22 ASN B 56 61.400 62.092 38.315 1.00 15.00 B H +ATOM 1635 C ASN B 56 64.713 62.962 42.980 1.00 15.00 B C +ATOM 1636 O ASN B 56 64.685 64.090 43.471 1.00 15.00 B O +ATOM 1637 N VAL B 57 64.905 61.854 43.697 1.00 15.00 B N +ATOM 1638 HN VAL B 57 64.889 60.985 43.243 1.00 15.00 B H +ATOM 1639 CA VAL B 57 65.138 61.896 45.136 1.00 15.00 B C +ATOM 1640 CB VAL B 57 65.137 60.471 45.744 1.00 15.00 B C +ATOM 1641 CG1 VAL B 57 65.682 60.478 47.165 1.00 15.00 B C +ATOM 1642 CG2 VAL B 57 63.739 59.878 45.721 1.00 15.00 B C +ATOM 1643 C VAL B 57 66.489 62.549 45.397 1.00 15.00 B C +ATOM 1644 O VAL B 57 66.631 63.376 46.295 1.00 15.00 B O +ATOM 1645 N LYS B 58 67.467 62.175 44.573 1.00 15.00 B N +ATOM 1646 HN LYS B 58 67.268 61.516 43.875 1.00 15.00 B H +ATOM 1647 CA LYS B 58 68.819 62.706 44.667 1.00 15.00 B C +ATOM 1648 CB LYS B 58 69.722 61.985 43.659 1.00 15.00 B C +ATOM 1649 CG LYS B 58 71.034 62.690 43.355 1.00 15.00 B C +ATOM 1650 CD LYS B 58 71.821 61.949 42.288 1.00 15.00 B C +ATOM 1651 CE LYS B 58 72.963 62.799 41.755 1.00 15.00 B C +ATOM 1652 NZ LYS B 58 73.866 62.019 40.866 1.00 15.00 B N +ATOM 1653 HZ1 LYS B 58 74.179 62.608 40.068 1.00 15.00 B H +ATOM 1654 HZ2 LYS B 58 73.371 61.183 40.495 1.00 15.00 B H +ATOM 1655 HZ3 LYS B 58 74.703 61.703 41.398 1.00 15.00 B H +ATOM 1656 C LYS B 58 68.837 64.211 44.414 1.00 15.00 B C +ATOM 1657 O LYS B 58 69.546 64.949 45.091 1.00 15.00 B O +ATOM 1658 N ALA B 59 68.039 64.656 43.443 1.00 15.00 B N +ATOM 1659 HN ALA B 59 67.495 64.011 42.944 1.00 15.00 B H +ATOM 1660 CA ALA B 59 67.957 66.073 43.095 1.00 15.00 B C +ATOM 1661 CB ALA B 59 67.074 66.264 41.872 1.00 15.00 B C +ATOM 1662 C ALA B 59 67.449 66.916 44.262 1.00 15.00 B C +ATOM 1663 O ALA B 59 67.929 68.026 44.487 1.00 15.00 B O +ATOM 1664 N ILE B 60 66.477 66.382 44.999 1.00 15.00 B N +ATOM 1665 HN ILE B 60 66.134 65.496 44.762 1.00 15.00 B H +ATOM 1666 CA ILE B 60 65.903 67.081 46.149 1.00 15.00 B C +ATOM 1667 CB ILE B 60 64.556 66.451 46.566 1.00 15.00 B C +ATOM 1668 CG1 ILE B 60 63.551 66.549 45.417 1.00 15.00 B C +ATOM 1669 CG2 ILE B 60 64.001 67.116 47.817 1.00 15.00 B C +ATOM 1670 CD1 ILE B 60 62.311 65.712 45.620 1.00 15.00 B C +ATOM 1671 C ILE B 60 66.866 67.067 47.337 1.00 15.00 B C +ATOM 1672 O ILE B 60 67.013 68.066 48.042 1.00 15.00 B O +ATOM 1673 N VAL B 61 67.524 65.929 47.544 1.00 15.00 B N +ATOM 1674 HN VAL B 61 67.364 65.169 46.944 1.00 15.00 B H +ATOM 1675 CA VAL B 61 68.477 65.775 48.640 1.00 15.00 B C +ATOM 1676 CB VAL B 61 68.918 64.301 48.800 1.00 15.00 B C +ATOM 1677 CG1 VAL B 61 70.044 64.169 49.812 1.00 15.00 B C +ATOM 1678 CG2 VAL B 61 67.738 63.437 49.218 1.00 15.00 B C +ATOM 1679 C VAL B 61 69.701 66.673 48.436 1.00 15.00 B C +ATOM 1680 O VAL B 61 70.190 67.293 49.381 1.00 15.00 B O +ATOM 1681 N GLU B 62 70.175 66.752 47.192 1.00 15.00 B N +ATOM 1682 HN GLU B 62 69.734 66.243 46.481 1.00 15.00 B H +ATOM 1683 CA GLU B 62 71.334 67.577 46.860 1.00 15.00 B C +ATOM 1684 CB GLU B 62 71.921 67.185 45.505 1.00 15.00 B C +ATOM 1685 CG GLU B 62 72.578 65.815 45.487 1.00 15.00 B C +ATOM 1686 CD GLU B 62 73.338 65.550 44.203 1.00 15.00 B C +ATOM 1687 OE1 GLU B 62 74.315 64.773 44.244 1.00 15.00 B O +ATOM 1688 OE2 GLU B 62 72.958 66.117 43.157 1.00 15.00 B O +ATOM 1689 C GLU B 62 70.993 69.062 46.876 1.00 15.00 B C +ATOM 1690 O GLU B 62 71.868 69.904 47.071 1.00 15.00 B O +ATOM 1691 N ALA B 63 69.713 69.376 46.666 1.00 15.00 B N +ATOM 1692 HN ALA B 63 69.065 68.660 46.507 1.00 15.00 B H +ATOM 1693 CA ALA B 63 69.258 70.763 46.677 1.00 15.00 B C +ATOM 1694 CB ALA B 63 67.870 70.877 46.067 1.00 15.00 B C +ATOM 1695 C ALA B 63 69.260 71.303 48.102 1.00 15.00 B C +ATOM 1696 O ALA B 63 69.276 72.513 48.323 1.00 15.00 B O +ATOM 1697 N ALA B 64 69.247 70.382 49.064 1.00 15.00 B N +ATOM 1698 HN ALA B 64 69.223 69.435 48.813 1.00 15.00 B H +ATOM 1699 CA ALA B 64 69.268 70.738 50.474 1.00 15.00 B C +ATOM 1700 CB ALA B 64 68.452 69.737 51.279 1.00 15.00 B C +ATOM 1701 C ALA B 64 70.704 70.791 50.992 1.00 15.00 B C +ATOM 1702 O ALA B 64 70.940 71.102 52.157 1.00 15.00 B O +ATOM 1703 N GLY B 65 71.659 70.485 50.115 1.00 15.00 B N +ATOM 1704 HN GLY B 65 71.409 70.248 49.197 1.00 15.00 B H +ATOM 1705 CA GLY B 65 73.060 70.510 50.499 1.00 15.00 B C +ATOM 1706 C GLY B 65 73.568 69.170 51.002 1.00 15.00 B C +ATOM 1707 O GLY B 65 74.621 69.101 51.635 1.00 15.00 B O +ATOM 1708 N LEU B 66 72.821 68.104 50.725 1.00 15.00 B N +ATOM 1709 HN LEU B 66 71.989 68.221 50.218 1.00 15.00 B H +ATOM 1710 CA LEU B 66 73.209 66.763 51.157 1.00 15.00 B C +ATOM 1711 CB LEU B 66 72.108 66.123 52.008 1.00 15.00 B C +ATOM 1712 CG LEU B 66 71.867 66.741 53.388 1.00 15.00 B C +ATOM 1713 CD1 LEU B 66 70.795 65.964 54.134 1.00 15.00 B C +ATOM 1714 CD2 LEU B 66 73.157 66.779 54.192 1.00 15.00 B C +ATOM 1715 C LEU B 66 73.539 65.867 49.966 1.00 15.00 B C +ATOM 1716 O LEU B 66 73.367 66.261 48.813 1.00 15.00 B O +ATOM 1717 N LYS B 67 74.019 64.661 50.255 1.00 15.00 B N +ATOM 1718 HN LYS B 67 74.138 64.408 51.196 1.00 15.00 B H +ATOM 1719 CA LYS B 67 74.376 63.702 49.213 1.00 15.00 B C +ATOM 1720 CB LYS B 67 75.838 63.267 49.373 1.00 15.00 B C +ATOM 1721 CG LYS B 67 76.841 64.405 49.464 1.00 15.00 B C +ATOM 1722 CD LYS B 67 78.244 63.869 49.706 1.00 15.00 B C +ATOM 1723 CE LYS B 67 79.274 64.986 49.742 1.00 15.00 B C +ATOM 1724 NZ LYS B 67 80.657 64.455 49.899 1.00 15.00 B N +ATOM 1725 HZ1 LYS B 67 80.873 63.787 49.132 1.00 15.00 B H +ATOM 1726 HZ2 LYS B 67 80.750 63.961 50.809 1.00 15.00 B H +ATOM 1727 HZ3 LYS B 67 81.344 65.235 49.869 1.00 15.00 B H +ATOM 1728 C LYS B 67 73.486 62.464 49.290 1.00 15.00 B C +ATOM 1729 O LYS B 67 72.663 62.335 50.196 1.00 15.00 B O +ATOM 1730 N VAL B 68 73.663 61.553 48.334 1.00 15.00 B N +ATOM 1731 HN VAL B 68 74.323 61.724 47.630 1.00 15.00 B H +ATOM 1732 CA VAL B 68 72.900 60.306 48.303 1.00 15.00 B C +ATOM 1733 CB VAL B 68 73.098 59.566 46.959 1.00 15.00 B C +ATOM 1734 CG1 VAL B 68 72.483 58.173 46.986 1.00 15.00 B C +ATOM 1735 CG2 VAL B 68 72.502 60.378 45.822 1.00 15.00 B C +ATOM 1736 C VAL B 68 73.321 59.410 49.470 1.00 15.00 B C +ATOM 1737 O VAL B 68 72.541 58.589 49.961 1.00 15.00 B O +ATOM 1738 N GLY B 69 74.560 59.601 49.928 1.00 15.00 B N +ATOM 1739 HN GLY B 69 75.126 60.276 49.500 1.00 15.00 B H +ATOM 1740 CA GLY B 69 75.081 58.829 51.041 1.00 15.00 B C +ATOM 1741 C GLY B 69 74.505 59.263 52.372 1.00 15.00 B C +ATOM 1742 O GLY B 69 74.688 58.587 53.385 1.00 15.00 B O +ATOM 1743 N ASP B 70 73.805 60.393 52.368 1.00 15.00 B N +ATOM 1744 HN ASP B 70 73.698 60.884 51.526 1.00 15.00 B H +ATOM 1745 CA ASP B 70 73.195 60.918 53.579 1.00 15.00 B C +ATOM 1746 CB ASP B 70 73.184 62.448 53.564 1.00 15.00 B C +ATOM 1747 CG ASP B 70 74.582 63.028 53.658 1.00 15.00 B C +ATOM 1748 OD1 ASP B 70 74.876 63.995 52.927 1.00 15.00 B O +ATOM 1749 OD2 ASP B 70 75.387 62.509 54.461 1.00 15.00 B O +ATOM 1750 C ASP B 70 71.792 60.356 53.790 1.00 15.00 B C +ATOM 1751 O ASP B 70 71.198 60.536 54.853 1.00 15.00 B O +ATOM 1752 N ILE B 71 71.264 59.676 52.768 1.00 15.00 B N +ATOM 1753 HN ILE B 71 71.780 59.587 51.939 1.00 15.00 B H +ATOM 1754 CA ILE B 71 69.940 59.062 52.854 1.00 15.00 B C +ATOM 1755 CB ILE B 71 69.444 58.588 51.471 1.00 15.00 B C +ATOM 1756 CG1 ILE B 71 69.409 59.764 50.486 1.00 15.00 B C +ATOM 1757 CG2 ILE B 71 68.066 57.953 51.585 1.00 15.00 B C +ATOM 1758 CD1 ILE B 71 69.080 59.369 49.063 1.00 15.00 B C +ATOM 1759 C ILE B 71 69.992 57.879 53.824 1.00 15.00 B C +ATOM 1760 O ILE B 71 70.793 56.961 53.648 1.00 15.00 B O +ATOM 1761 N VAL B 72 69.140 57.912 54.848 1.00 15.00 B N +ATOM 1762 HN VAL B 72 68.512 58.659 54.921 1.00 15.00 B H +ATOM 1763 CA VAL B 72 69.126 56.865 55.870 1.00 15.00 B C +ATOM 1764 CB VAL B 72 69.348 57.453 57.278 1.00 15.00 B C +ATOM 1765 CG1 VAL B 72 70.756 58.011 57.407 1.00 15.00 B C +ATOM 1766 CG2 VAL B 72 68.314 58.529 57.579 1.00 15.00 B C +ATOM 1767 C VAL B 72 67.857 56.004 55.888 1.00 15.00 B C +ATOM 1768 O VAL B 72 67.846 54.952 56.522 1.00 15.00 B O +ATOM 1769 N LYS B 73 66.793 56.437 55.215 1.00 15.00 B N +ATOM 1770 HN LYS B 73 66.846 57.280 54.719 1.00 15.00 B H +ATOM 1771 CA LYS B 73 65.545 55.664 55.201 1.00 15.00 B C +ATOM 1772 CB LYS B 73 64.718 55.936 56.468 1.00 15.00 B C +ATOM 1773 CG LYS B 73 63.336 55.282 56.488 1.00 15.00 B C +ATOM 1774 CD LYS B 73 63.429 53.763 56.423 1.00 15.00 B C +ATOM 1775 CE LYS B 73 62.082 53.102 56.697 1.00 15.00 B C +ATOM 1776 NZ LYS B 73 61.052 53.465 55.683 1.00 15.00 B N +ATOM 1777 HZ1 LYS B 73 60.157 52.974 55.895 1.00 15.00 B H +ATOM 1778 HZ2 LYS B 73 61.368 53.188 54.733 1.00 15.00 B H +ATOM 1779 HZ3 LYS B 73 60.882 54.491 55.695 1.00 15.00 B H +ATOM 1780 C LYS B 73 64.712 55.941 53.954 1.00 15.00 B C +ATOM 1781 O LYS B 73 64.476 57.089 53.599 1.00 15.00 B O +ATOM 1782 N THR B 74 64.269 54.872 53.293 1.00 15.00 B N +ATOM 1783 HN THR B 74 64.498 53.978 53.623 1.00 15.00 B H +ATOM 1784 CA THR B 74 63.459 54.995 52.086 1.00 15.00 B C +ATOM 1785 CB THR B 74 64.288 54.706 50.815 1.00 15.00 B C +ATOM 1786 OG1 THR B 74 64.694 53.335 50.811 1.00 15.00 B O +ATOM 1787 HG1 THR B 74 65.279 53.175 50.065 1.00 15.00 B H +ATOM 1788 CG2 THR B 74 65.524 55.592 50.748 1.00 15.00 B C +ATOM 1789 C THR B 74 62.277 54.026 52.107 1.00 15.00 B C +ATOM 1790 O THR B 74 62.335 52.971 52.739 1.00 15.00 B O +ATOM 1791 N THR B 75 61.202 54.400 51.421 1.00 15.00 B N +ATOM 1792 HN THR B 75 61.205 55.270 50.973 1.00 15.00 B H +ATOM 1793 CA THR B 75 60.013 53.557 51.317 1.00 15.00 B C +ATOM 1794 CB THR B 75 58.810 54.162 52.062 1.00 15.00 B C +ATOM 1795 OG1 THR B 75 59.182 54.420 53.420 1.00 15.00 B O +ATOM 1796 HG1 THR B 75 59.993 53.949 53.622 1.00 15.00 B H +ATOM 1797 CG2 THR B 75 57.631 53.201 52.054 1.00 15.00 B C +ATOM 1798 C THR B 75 59.673 53.353 49.842 1.00 15.00 B C +ATOM 1799 O THR B 75 59.220 54.276 49.162 1.00 15.00 B O +ATOM 1800 N VAL B 76 59.899 52.136 49.356 1.00 15.00 B N +ATOM 1801 HN VAL B 76 60.219 51.431 49.960 1.00 15.00 B H +ATOM 1802 CA VAL B 76 59.674 51.816 47.951 1.00 15.00 B C +ATOM 1803 CB VAL B 76 60.789 50.899 47.400 1.00 15.00 B C +ATOM 1804 CG1 VAL B 76 60.638 50.705 45.901 1.00 15.00 B C +ATOM 1805 CG2 VAL B 76 62.163 51.464 47.731 1.00 15.00 B C +ATOM 1806 C VAL B 76 58.313 51.181 47.675 1.00 15.00 B C +ATOM 1807 O VAL B 76 58.065 50.024 48.019 1.00 15.00 B O +ATOM 1808 N PHE B 77 57.436 51.957 47.043 1.00 15.00 B N +ATOM 1809 HN PHE B 77 57.687 52.880 46.832 1.00 15.00 B H +ATOM 1810 CA PHE B 77 56.112 51.483 46.664 1.00 15.00 B C +ATOM 1811 CB PHE B 77 55.088 52.616 46.775 1.00 15.00 B C +ATOM 1812 CG PHE B 77 55.004 53.267 48.124 1.00 15.00 B C +ATOM 1813 CD1 PHE B 77 55.577 54.509 48.343 1.00 15.00 B C +ATOM 1814 CD2 PHE B 77 54.335 52.648 49.167 1.00 15.00 B C +ATOM 1815 CE1 PHE B 77 55.486 55.123 49.577 1.00 15.00 B C +ATOM 1816 CE2 PHE B 77 54.241 53.255 50.405 1.00 15.00 B C +ATOM 1817 CZ PHE B 77 54.817 54.495 50.610 1.00 15.00 B C +ATOM 1818 C PHE B 77 56.157 51.012 45.215 1.00 15.00 B C +ATOM 1819 O PHE B 77 56.441 51.798 44.314 1.00 15.00 B O +ATOM 1820 N VAL B 78 55.891 49.734 44.987 1.00 15.00 B N +ATOM 1821 HN VAL B 78 55.669 49.144 45.738 1.00 15.00 B H +ATOM 1822 CA VAL B 78 55.919 49.193 43.631 1.00 15.00 B C +ATOM 1823 CB VAL B 78 56.968 48.071 43.470 1.00 15.00 B C +ATOM 1824 CG1 VAL B 78 58.374 48.621 43.660 1.00 15.00 B C +ATOM 1825 CG2 VAL B 78 56.699 46.927 44.439 1.00 15.00 B C +ATOM 1826 C VAL B 78 54.550 48.682 43.197 1.00 15.00 B C +ATOM 1827 O VAL B 78 53.706 48.356 44.027 1.00 15.00 B O +ATOM 1828 N LYS B 79 54.336 48.627 41.887 1.00 15.00 B N +ATOM 1829 HN LYS B 79 55.045 48.916 41.276 1.00 15.00 B H +ATOM 1830 CA LYS B 79 53.074 48.149 41.333 1.00 15.00 B C +ATOM 1831 CB LYS B 79 52.788 48.843 39.994 1.00 15.00 B C +ATOM 1832 CG LYS B 79 51.607 48.277 39.215 1.00 15.00 B C +ATOM 1833 CD LYS B 79 50.294 48.480 39.954 1.00 15.00 B C +ATOM 1834 CE LYS B 79 49.211 47.565 39.405 1.00 15.00 B C +ATOM 1835 NZ LYS B 79 49.493 46.132 39.696 1.00 15.00 B N +ATOM 1836 HZ1 LYS B 79 50.392 45.849 39.256 1.00 15.00 B H +ATOM 1837 HZ2 LYS B 79 48.732 45.533 39.320 1.00 15.00 B H +ATOM 1838 HZ3 LYS B 79 49.561 45.981 40.724 1.00 15.00 B H +ATOM 1839 C LYS B 79 53.112 46.631 41.163 1.00 15.00 B C +ATOM 1840 O LYS B 79 52.081 45.958 41.215 1.00 15.00 B O +ATOM 1841 N ASP B 80 54.315 46.098 40.971 1.00 15.00 B N +ATOM 1842 HN ASP B 80 55.098 46.687 40.947 1.00 15.00 B H +ATOM 1843 CA ASP B 80 54.503 44.664 40.802 1.00 15.00 B C +ATOM 1844 CB ASP B 80 54.502 44.294 39.313 1.00 15.00 B C +ATOM 1845 CG ASP B 80 54.205 42.825 39.061 1.00 15.00 B C +ATOM 1846 OD1 ASP B 80 54.032 42.451 37.882 1.00 15.00 B O +ATOM 1847 OD2 ASP B 80 54.141 42.048 40.038 1.00 15.00 B O +ATOM 1848 C ASP B 80 55.807 44.220 41.455 1.00 15.00 B C +ATOM 1849 O ASP B 80 56.888 44.673 41.076 1.00 15.00 B O +ATOM 1850 N LEU B 81 55.695 43.336 42.448 1.00 15.00 B N +ATOM 1851 HN LEU B 81 54.803 43.025 42.709 1.00 15.00 B H +ATOM 1852 CA LEU B 81 56.863 42.822 43.156 1.00 15.00 B C +ATOM 1853 CB LEU B 81 56.472 42.247 44.518 1.00 15.00 B C +ATOM 1854 CG LEU B 81 56.530 43.211 45.702 1.00 15.00 B C +ATOM 1855 CD1 LEU B 81 55.964 42.551 46.946 1.00 15.00 B C +ATOM 1856 CD2 LEU B 81 57.958 43.672 45.953 1.00 15.00 B C +ATOM 1857 C LEU B 81 57.608 41.776 42.335 1.00 15.00 B C +ATOM 1858 O LEU B 81 58.692 41.336 42.713 1.00 15.00 B O +ATOM 1859 N ASN B 82 57.014 41.373 41.211 1.00 15.00 B N +ATOM 1860 HN ASN B 82 56.139 41.746 40.973 1.00 15.00 B H +ATOM 1861 CA ASN B 82 57.639 40.396 40.327 1.00 15.00 B C +ATOM 1862 CB ASN B 82 56.613 39.811 39.350 1.00 15.00 B C +ATOM 1863 CG ASN B 82 55.788 38.693 39.957 1.00 15.00 B C +ATOM 1864 OD1 ASN B 82 56.259 37.954 40.824 1.00 15.00 B O +ATOM 1865 ND2 ASN B 82 54.548 38.559 39.501 1.00 15.00 B N +ATOM 1866 HD21 ASN B 82 54.240 39.182 38.811 1.00 15.00 B H +ATOM 1867 HD22 ASN B 82 53.992 37.841 39.872 1.00 15.00 B H +ATOM 1868 C ASN B 82 58.794 41.038 39.563 1.00 15.00 B C +ATOM 1869 O ASN B 82 59.650 40.349 39.011 1.00 15.00 B O +ATOM 1870 N ASP B 83 58.803 42.371 39.552 1.00 15.00 B N +ATOM 1871 HN ASP B 83 58.084 42.851 40.013 1.00 15.00 B H +ATOM 1872 CA ASP B 83 59.843 43.141 38.881 1.00 15.00 B C +ATOM 1873 CB ASP B 83 59.219 44.325 38.128 1.00 15.00 B C +ATOM 1874 CG ASP B 83 58.595 43.952 36.799 1.00 15.00 B C +ATOM 1875 OD1 ASP B 83 57.599 44.601 36.412 1.00 15.00 B O +ATOM 1876 OD2 ASP B 83 59.105 43.023 36.141 1.00 15.00 B O +ATOM 1877 C ASP B 83 60.831 43.701 39.899 1.00 15.00 B C +ATOM 1878 O ASP B 83 61.650 44.556 39.567 1.00 15.00 B O +ATOM 1879 N PHE B 84 60.766 43.208 41.137 1.00 15.00 B N +ATOM 1880 HN PHE B 84 60.126 42.493 41.337 1.00 15.00 B H +ATOM 1881 CA PHE B 84 61.637 43.709 42.194 1.00 15.00 B C +ATOM 1882 CB PHE B 84 61.104 43.400 43.591 1.00 15.00 B C +ATOM 1883 CG PHE B 84 61.402 44.493 44.578 1.00 15.00 B C +ATOM 1884 CD1 PHE B 84 62.320 44.300 45.596 1.00 15.00 B C +ATOM 1885 CD2 PHE B 84 60.772 45.722 44.475 1.00 15.00 B C +ATOM 1886 CE1 PHE B 84 62.601 45.312 46.495 1.00 15.00 B C +ATOM 1887 CE2 PHE B 84 61.047 46.737 45.371 1.00 15.00 B C +ATOM 1888 CZ PHE B 84 61.964 46.532 46.382 1.00 15.00 B C +ATOM 1889 C PHE B 84 63.097 43.295 42.047 1.00 15.00 B C +ATOM 1890 O PHE B 84 63.979 43.968 42.569 1.00 15.00 B O +ATOM 1891 N ALA B 85 63.356 42.189 41.353 1.00 15.00 B N +ATOM 1892 HN ALA B 85 62.615 41.663 40.986 1.00 15.00 B H +ATOM 1893 CA ALA B 85 64.731 41.744 41.139 1.00 15.00 B C +ATOM 1894 CB ALA B 85 64.755 40.384 40.459 1.00 15.00 B C +ATOM 1895 C ALA B 85 65.473 42.779 40.296 1.00 15.00 B C +ATOM 1896 O ALA B 85 66.654 43.052 40.515 1.00 15.00 B O +ATOM 1897 N THR B 86 64.748 43.361 39.343 1.00 15.00 B N +ATOM 1898 HN THR B 86 63.814 43.088 39.228 1.00 15.00 B H +ATOM 1899 CA THR B 86 65.291 44.385 38.463 1.00 15.00 B C +ATOM 1900 CB THR B 86 64.381 44.577 37.232 1.00 15.00 B C +ATOM 1901 OG1 THR B 86 64.184 43.315 36.585 1.00 15.00 B O +ATOM 1902 HG1 THR B 86 64.887 42.714 36.842 1.00 15.00 B H +ATOM 1903 CG2 THR B 86 65.003 45.550 36.243 1.00 15.00 B C +ATOM 1904 C THR B 86 65.417 45.713 39.211 1.00 15.00 B C +ATOM 1905 O THR B 86 66.400 46.438 39.049 1.00 15.00 B O +ATOM 1906 N VAL B 87 64.411 46.019 40.034 1.00 15.00 B N +ATOM 1907 HN VAL B 87 63.654 45.402 40.109 1.00 15.00 B H +ATOM 1908 CA VAL B 87 64.403 47.248 40.824 1.00 15.00 B C +ATOM 1909 CB VAL B 87 63.049 47.446 41.546 1.00 15.00 B C +ATOM 1910 CG1 VAL B 87 63.108 48.618 42.517 1.00 15.00 B C +ATOM 1911 CG2 VAL B 87 61.933 47.656 40.534 1.00 15.00 B C +ATOM 1912 C VAL B 87 65.535 47.236 41.850 1.00 15.00 B C +ATOM 1913 O VAL B 87 66.190 48.251 42.073 1.00 15.00 B O +ATOM 1914 N ASN B 88 65.763 46.072 42.462 1.00 15.00 B N +ATOM 1915 HN ASN B 88 65.202 45.301 42.236 1.00 15.00 B H +ATOM 1916 CA ASN B 88 66.818 45.909 43.459 1.00 15.00 B C +ATOM 1917 CB ASN B 88 66.746 44.521 44.104 1.00 15.00 B C +ATOM 1918 CG ASN B 88 66.155 44.551 45.498 1.00 15.00 B C +ATOM 1919 OD1 ASN B 88 66.214 45.567 46.185 1.00 15.00 B O +ATOM 1920 ND2 ASN B 88 65.590 43.428 45.926 1.00 15.00 B N +ATOM 1921 HD21 ASN B 88 65.586 42.654 45.326 1.00 15.00 B H +ATOM 1922 HD22 ASN B 88 65.201 43.420 46.826 1.00 15.00 B H +ATOM 1923 C ASN B 88 68.197 46.116 42.847 1.00 15.00 B C +ATOM 1924 O ASN B 88 69.075 46.707 43.472 1.00 15.00 B O +ATOM 1925 N ALA B 89 68.380 45.621 41.623 1.00 15.00 B N +ATOM 1926 HN ALA B 89 67.639 45.151 41.184 1.00 15.00 B H +ATOM 1927 CA ALA B 89 69.652 45.754 40.918 1.00 15.00 B C +ATOM 1928 CB ALA B 89 69.648 44.923 39.645 1.00 15.00 B C +ATOM 1929 C ALA B 89 69.958 47.217 40.607 1.00 15.00 B C +ATOM 1930 O ALA B 89 71.093 47.666 40.760 1.00 15.00 B O +ATOM 1931 N THR B 90 68.937 47.954 40.172 1.00 15.00 B N +ATOM 1932 HN THR B 90 68.059 47.531 40.062 1.00 15.00 B H +ATOM 1933 CA THR B 90 69.087 49.371 39.854 1.00 15.00 B C +ATOM 1934 CB THR B 90 67.856 49.903 39.087 1.00 15.00 B C +ATOM 1935 OG1 THR B 90 67.750 49.234 37.825 1.00 15.00 B O +ATOM 1936 HG1 THR B 90 67.944 48.300 37.940 1.00 15.00 B H +ATOM 1937 CG2 THR B 90 67.962 51.404 38.849 1.00 15.00 B C +ATOM 1938 C THR B 90 69.282 50.188 41.132 1.00 15.00 B C +ATOM 1939 O THR B 90 70.084 51.122 41.171 1.00 15.00 B O +ATOM 1940 N TYR B 91 68.545 49.810 42.174 1.00 15.00 B N +ATOM 1941 HN TYR B 91 67.931 49.053 42.065 1.00 15.00 B H +ATOM 1942 CA TYR B 91 68.611 50.477 43.470 1.00 15.00 B C +ATOM 1943 CB TYR B 91 67.562 49.862 44.404 1.00 15.00 B C +ATOM 1944 CG TYR B 91 67.393 50.562 45.733 1.00 15.00 B C +ATOM 1945 CD1 TYR B 91 66.341 51.442 45.945 1.00 15.00 B C +ATOM 1946 CD2 TYR B 91 68.280 50.338 46.777 1.00 15.00 B C +ATOM 1947 CE1 TYR B 91 66.170 52.069 47.164 1.00 15.00 B C +ATOM 1948 CE2 TYR B 91 68.118 50.959 47.997 1.00 15.00 B C +ATOM 1949 CZ TYR B 91 67.068 51.828 48.183 1.00 15.00 B C +ATOM 1950 OH TYR B 91 66.905 52.446 49.398 1.00 15.00 B O +ATOM 1951 HH TYR B 91 67.764 52.688 49.750 1.00 15.00 B H +ATOM 1952 C TYR B 91 70.002 50.329 44.083 1.00 15.00 B C +ATOM 1953 O TYR B 91 70.575 51.295 44.587 1.00 15.00 B O +ATOM 1954 N GLU B 92 70.534 49.109 44.031 1.00 15.00 B N +ATOM 1955 HN GLU B 92 70.022 48.385 43.613 1.00 15.00 B H +ATOM 1956 CA GLU B 92 71.854 48.817 44.576 1.00 15.00 B C +ATOM 1957 CB GLU B 92 72.112 47.308 44.565 1.00 15.00 B C +ATOM 1958 CG GLU B 92 73.489 46.905 45.066 1.00 15.00 B C +ATOM 1959 CD GLU B 92 73.544 45.463 45.529 1.00 15.00 B C +ATOM 1960 OE1 GLU B 92 74.430 45.140 46.347 1.00 15.00 B O +ATOM 1961 OE2 GLU B 92 72.699 44.659 45.081 1.00 15.00 B O +ATOM 1962 C GLU B 92 72.941 49.541 43.797 1.00 15.00 B C +ATOM 1963 O GLU B 92 73.859 50.111 44.386 1.00 15.00 B O +ATOM 1964 N ALA B 93 72.823 49.521 42.471 1.00 15.00 B N +ATOM 1965 HN ALA B 93 72.062 49.051 42.067 1.00 15.00 B H +ATOM 1966 CA ALA B 93 73.791 50.177 41.604 1.00 15.00 B C +ATOM 1967 CB ALA B 93 73.481 49.890 40.143 1.00 15.00 B C +ATOM 1968 C ALA B 93 73.822 51.678 41.858 1.00 15.00 B C +ATOM 1969 O ALA B 93 74.890 52.276 41.913 1.00 15.00 B O +ATOM 1970 N PHE B 94 72.642 52.270 42.032 1.00 15.00 B N +ATOM 1971 HN PHE B 94 71.828 51.724 41.991 1.00 15.00 B H +ATOM 1972 CA PHE B 94 72.515 53.703 42.281 1.00 15.00 B C +ATOM 1973 CB PHE B 94 71.038 54.086 42.431 1.00 15.00 B C +ATOM 1974 CG PHE B 94 70.791 55.562 42.573 1.00 15.00 B C +ATOM 1975 CD1 PHE B 94 70.761 56.384 41.458 1.00 15.00 B C +ATOM 1976 CD2 PHE B 94 70.590 56.128 43.823 1.00 15.00 B C +ATOM 1977 CE1 PHE B 94 70.532 57.741 41.585 1.00 15.00 B C +ATOM 1978 CE2 PHE B 94 70.361 57.484 43.956 1.00 15.00 B C +ATOM 1979 CZ PHE B 94 70.333 58.293 42.836 1.00 15.00 B C +ATOM 1980 C PHE B 94 73.302 54.139 43.517 1.00 15.00 B C +ATOM 1981 O PHE B 94 74.064 55.100 43.464 1.00 15.00 B O +ATOM 1982 N PHE B 95 73.123 53.421 44.625 1.00 15.00 B N +ATOM 1983 HN PHE B 95 72.512 52.654 44.606 1.00 15.00 B H +ATOM 1984 CA PHE B 95 73.816 53.752 45.869 1.00 15.00 B C +ATOM 1985 CB PHE B 95 73.134 53.109 47.079 1.00 15.00 B C +ATOM 1986 CG PHE B 95 71.876 53.820 47.495 1.00 15.00 B C +ATOM 1987 CD1 PHE B 95 70.649 53.447 46.977 1.00 15.00 B C +ATOM 1988 CD2 PHE B 95 71.926 54.873 48.393 1.00 15.00 B C +ATOM 1989 CE1 PHE B 95 69.493 54.106 47.349 1.00 15.00 B C +ATOM 1990 CE2 PHE B 95 70.774 55.536 48.771 1.00 15.00 B C +ATOM 1991 CZ PHE B 95 69.556 55.154 48.245 1.00 15.00 B C +ATOM 1992 C PHE B 95 75.309 53.417 45.821 1.00 15.00 B C +ATOM 1993 O PHE B 95 76.115 54.073 46.479 1.00 15.00 B O +ATOM 1994 N THR B 96 75.674 52.401 45.038 1.00 15.00 B N +ATOM 1995 HN THR B 96 74.987 51.902 44.548 1.00 15.00 B H +ATOM 1996 CA THR B 96 77.077 52.012 44.896 1.00 15.00 B C +ATOM 1997 CB THR B 96 77.218 50.631 44.213 1.00 15.00 B C +ATOM 1998 OG1 THR B 96 76.601 49.627 45.027 1.00 15.00 B O +ATOM 1999 HG1 THR B 96 75.902 50.025 45.550 1.00 15.00 B H +ATOM 2000 CG2 THR B 96 78.683 50.266 44.004 1.00 15.00 B C +ATOM 2001 C THR B 96 77.831 53.068 44.083 1.00 15.00 B C +ATOM 2002 O THR B 96 79.007 53.339 44.329 1.00 15.00 B O +ATOM 2003 N GLU B 97 77.122 53.671 43.127 1.00 15.00 B N +ATOM 2004 HN GLU B 97 76.187 53.407 42.997 1.00 15.00 B H +ATOM 2005 CA GLU B 97 77.687 54.709 42.266 1.00 15.00 B C +ATOM 2006 CB GLU B 97 76.681 55.086 41.174 1.00 15.00 B C +ATOM 2007 CG GLU B 97 76.529 54.060 40.063 1.00 15.00 B C +ATOM 2008 CD GLU B 97 75.169 54.125 39.393 1.00 15.00 B C +ATOM 2009 OE1 GLU B 97 74.475 55.153 39.549 1.00 15.00 B O +ATOM 2010 OE2 GLU B 97 74.795 53.146 38.716 1.00 15.00 B O +ATOM 2011 C GLU B 97 78.040 55.961 43.061 1.00 15.00 B C +ATOM 2012 O GLU B 97 78.922 56.726 42.673 1.00 15.00 B O +ATOM 2013 N HIS B 98 77.345 56.166 44.173 1.00 15.00 B N +ATOM 2014 HN HIS B 98 76.665 55.512 44.441 1.00 15.00 B H +ATOM 2015 CA HIS B 98 77.574 57.335 45.009 1.00 15.00 B C +ATOM 2016 CB HIS B 98 76.238 57.965 45.416 1.00 15.00 B C +ATOM 2017 CG HIS B 98 75.472 58.540 44.265 1.00 15.00 B C +ATOM 2018 ND1 HIS B 98 74.546 57.834 43.528 1.00 15.00 B N +ATOM 2019 HD1 HIS B 98 74.287 56.899 43.668 1.00 15.00 B H +ATOM 2020 CD2 HIS B 98 75.512 59.780 43.721 1.00 15.00 B C +ATOM 2021 CE1 HIS B 98 74.066 58.649 42.582 1.00 15.00 B C +ATOM 2022 NE2 HIS B 98 74.620 59.842 42.656 1.00 15.00 B N +ATOM 2023 C HIS B 98 78.399 57.006 46.248 1.00 15.00 B C +ATOM 2024 O HIS B 98 78.540 57.849 47.136 1.00 15.00 B O +ATOM 2025 N ASN B 99 78.953 55.782 46.293 1.00 15.00 B N +ATOM 2026 HN ASN B 99 78.814 55.170 45.540 1.00 15.00 B H +ATOM 2027 CA ASN B 99 79.763 55.332 47.433 1.00 15.00 B C +ATOM 2028 CB ASN B 99 81.108 56.071 47.443 1.00 15.00 B C +ATOM 2029 CG ASN B 99 82.107 55.492 48.427 1.00 15.00 B C +ATOM 2030 OD1 ASN B 99 82.155 54.282 48.648 1.00 15.00 B O +ATOM 2031 ND2 ASN B 99 82.909 56.364 49.030 1.00 15.00 B N +ATOM 2032 HD21 ASN B 99 82.810 57.313 48.807 1.00 15.00 B H +ATOM 2033 HD22 ASN B 99 83.563 56.023 49.674 1.00 15.00 B H +ATOM 2034 C ASN B 99 78.997 55.574 48.735 1.00 15.00 B C +ATOM 2035 O ASN B 99 79.538 56.085 49.717 1.00 15.00 B O +ATOM 2036 N ALA B 100 77.727 55.194 48.723 1.00 15.00 B N +ATOM 2037 HN ALA B 100 77.369 54.754 47.925 1.00 15.00 B H +ATOM 2038 CA ALA B 100 76.853 55.410 49.859 1.00 15.00 B C +ATOM 2039 CB ALA B 100 75.623 56.167 49.393 1.00 15.00 B C +ATOM 2040 C ALA B 100 76.418 54.118 50.527 1.00 15.00 B C +ATOM 2041 O ALA B 100 76.186 53.104 49.866 1.00 15.00 B O +ATOM 2042 N THR B 101 76.309 54.172 51.851 1.00 15.00 B N +ATOM 2043 HN THR B 101 76.542 55.002 52.314 1.00 15.00 B H +ATOM 2044 CA THR B 101 75.859 53.034 52.631 1.00 15.00 B C +ATOM 2045 CB THR B 101 76.125 53.256 54.136 1.00 15.00 B C +ATOM 2046 OG1 THR B 101 77.528 53.433 54.356 1.00 15.00 B O +ATOM 2047 HG1 THR B 101 77.663 53.991 55.126 1.00 15.00 B H +ATOM 2048 CG2 THR B 101 75.635 52.074 54.960 1.00 15.00 B C +ATOM 2049 C THR B 101 74.361 52.874 52.418 1.00 15.00 B C +ATOM 2050 O THR B 101 73.618 53.857 52.454 1.00 15.00 B O +ATOM 2051 N PHE B 102 73.927 51.645 52.169 1.00 15.00 B N +ATOM 2052 HN PHE B 102 74.571 50.909 52.129 1.00 15.00 B H +ATOM 2053 CA PHE B 102 72.515 51.367 51.951 1.00 15.00 B C +ATOM 2054 CB PHE B 102 72.299 49.872 51.728 1.00 15.00 B C +ATOM 2055 CG PHE B 102 73.095 49.319 50.582 1.00 15.00 B C +ATOM 2056 CD1 PHE B 102 73.868 48.182 50.742 1.00 15.00 B C +ATOM 2057 CD2 PHE B 102 73.075 49.942 49.344 1.00 15.00 B C +ATOM 2058 CE1 PHE B 102 74.605 47.674 49.689 1.00 15.00 B C +ATOM 2059 CE2 PHE B 102 73.808 49.440 48.287 1.00 15.00 B C +ATOM 2060 CZ PHE B 102 74.575 48.304 48.459 1.00 15.00 B C +ATOM 2061 C PHE B 102 71.679 51.859 53.126 1.00 15.00 B C +ATOM 2062 O PHE B 102 72.003 51.597 54.281 1.00 15.00 B O +ATOM 2063 N PRO B 103 70.608 52.608 52.846 1.00 15.00 B N +ATOM 2064 CA PRO B 103 69.728 53.147 53.872 1.00 15.00 B C +ATOM 2065 CB PRO B 103 69.046 54.334 53.166 1.00 15.00 B C +ATOM 2066 CG PRO B 103 69.516 54.318 51.744 1.00 15.00 B C +ATOM 2067 CD PRO B 103 70.164 52.987 51.504 1.00 15.00 B C +ATOM 2068 C PRO B 103 68.670 52.133 54.280 1.00 15.00 B C +ATOM 2069 O PRO B 103 68.461 51.137 53.585 1.00 15.00 B O +ATOM 2070 N ALA B 104 68.040 52.361 55.433 1.00 15.00 B N +ATOM 2071 HN ALA B 104 68.319 53.119 55.991 1.00 15.00 B H +ATOM 2072 CA ALA B 104 66.963 51.489 55.890 1.00 15.00 B C +ATOM 2073 CB ALA B 104 66.495 51.907 57.274 1.00 15.00 B C +ATOM 2074 C ALA B 104 65.819 51.597 54.886 1.00 15.00 B C +ATOM 2075 O ALA B 104 65.609 52.661 54.307 1.00 15.00 B O +ATOM 2076 N ARG B 105 65.089 50.517 54.646 1.00 15.00 B N +ATOM 2077 HN ARG B 105 65.274 49.675 55.119 1.00 15.00 B H +ATOM 2078 CA ARG B 105 64.028 50.589 53.659 1.00 15.00 B C +ATOM 2079 CB ARG B 105 64.638 50.455 52.251 1.00 15.00 B C +ATOM 2080 CG ARG B 105 63.955 49.450 51.351 1.00 15.00 B C +ATOM 2081 CD ARG B 105 64.896 48.315 50.990 1.00 15.00 B C +ATOM 2082 NE ARG B 105 65.710 48.580 49.799 1.00 15.00 B N +ATOM 2083 HE ARG B 105 66.241 49.407 49.786 1.00 15.00 B H +ATOM 2084 CZ ARG B 105 65.765 47.738 48.752 1.00 15.00 B C +ATOM 2085 NH1 ARG B 105 65.049 46.625 48.769 1.00 15.00 B N +ATOM 2086 HH11 ARG B 105 64.451 46.407 49.583 1.00 15.00 B H +ATOM 2087 HH12 ARG B 105 65.073 45.977 47.963 1.00 15.00 B H +ATOM 2088 NH2 ARG B 105 66.591 47.959 47.739 1.00 15.00 B N +ATOM 2089 HH21 ARG B 105 66.620 47.296 46.929 1.00 15.00 B H +ATOM 2090 HH22 ARG B 105 67.225 48.783 47.754 1.00 15.00 B H +ATOM 2091 C ARG B 105 62.847 49.622 53.880 1.00 15.00 B C +ATOM 2092 O ARG B 105 62.992 48.519 54.424 1.00 15.00 B O +ATOM 2093 N SER B 106 61.665 50.094 53.476 1.00 15.00 B N +ATOM 2094 HN SER B 106 61.621 51.005 53.124 1.00 15.00 B H +ATOM 2095 CA SER B 106 60.438 49.318 53.536 1.00 15.00 B C +ATOM 2096 CB SER B 106 59.365 50.039 54.355 1.00 15.00 B C +ATOM 2097 OG SER B 106 59.732 50.120 55.716 1.00 15.00 B O +ATOM 2098 HG SER B 106 60.684 50.092 55.784 1.00 15.00 B H +ATOM 2099 C SER B 106 59.971 49.112 52.101 1.00 15.00 B C +ATOM 2100 O SER B 106 60.042 50.037 51.289 1.00 15.00 B O +ATOM 2101 N CSP B 107 59.535 47.902 51.778 1.00 15.00 B N +ATOM 2102 HN CSP B 107 59.501 47.208 52.461 1.00 15.00 B H +ATOM 2103 CA CSP B 107 59.119 47.584 50.414 1.00 15.00 B C +ATOM 2104 CB CSP B 107 60.175 46.661 49.759 0.67 15.00 B C +ATOM 2105 SG CSP B 107 61.858 46.827 50.434 0.67 15.00 B S +ATOM 2106 P CSP B 107 62.011 44.991 51.448 0.67 15.00 B P +ATOM 2107 O1P CSP B 107 60.551 45.210 51.591 0.67 15.00 B O +ATOM 2108 O2P CSP B 107 62.020 43.588 50.965 0.67 15.00 B O +ATOM 2109 O3P CSP B 107 63.235 45.252 50.429 0.67 15.00 B O +ATOM 2110 C CSP B 107 57.743 46.913 50.379 1.00 15.00 B C +ATOM 2111 O CSP B 107 57.547 45.856 50.977 1.00 15.00 B O +ATOM 2112 N VAL B 108 56.792 47.528 49.674 1.00 15.00 B N +ATOM 2113 HN VAL B 108 57.004 48.367 49.223 1.00 15.00 B H +ATOM 2114 CA VAL B 108 55.435 46.968 49.560 1.00 15.00 B C +ATOM 2115 CB VAL B 108 54.439 47.580 50.582 1.00 15.00 B C +ATOM 2116 CG1 VAL B 108 54.872 47.332 52.012 1.00 15.00 B C +ATOM 2117 CG2 VAL B 108 54.219 49.065 50.321 1.00 15.00 B C +ATOM 2118 C VAL B 108 54.858 47.163 48.155 1.00 15.00 B C +ATOM 2119 O VAL B 108 55.219 48.108 47.455 1.00 15.00 B O +ATOM 2120 N GLU B 109 53.962 46.259 47.748 1.00 15.00 B N +ATOM 2121 HN GLU B 109 53.732 45.512 48.342 1.00 15.00 B H +ATOM 2122 CA GLU B 109 53.313 46.355 46.441 1.00 15.00 B C +ATOM 2123 CB GLU B 109 53.198 44.976 45.779 1.00 15.00 B C +ATOM 2124 CG GLU B 109 52.662 45.005 44.353 1.00 15.00 B C +ATOM 2125 CD GLU B 109 52.239 43.635 43.857 1.00 15.00 B C +ATOM 2126 OE1 GLU B 109 51.049 43.467 43.516 1.00 15.00 B O +ATOM 2127 OE2 GLU B 109 53.096 42.729 43.811 1.00 15.00 B O +ATOM 2128 C GLU B 109 51.928 46.962 46.624 1.00 15.00 B C +ATOM 2129 O GLU B 109 51.105 46.423 47.355 1.00 15.00 B O +ATOM 2130 N VAL B 110 51.680 48.090 45.974 1.00 15.00 B N +ATOM 2131 HN VAL B 110 52.375 48.475 45.400 1.00 15.00 B H +ATOM 2132 CA VAL B 110 50.395 48.769 46.093 1.00 15.00 B C +ATOM 2133 CB VAL B 110 50.572 50.297 46.194 1.00 15.00 B C +ATOM 2134 CG1 VAL B 110 51.328 50.653 47.467 1.00 15.00 B C +ATOM 2135 CG2 VAL B 110 51.302 50.827 44.969 1.00 15.00 B C +ATOM 2136 C VAL B 110 49.464 48.435 44.935 1.00 15.00 B C +ATOM 2137 O VAL B 110 49.862 47.776 43.969 1.00 15.00 B O +ATOM 2138 N ALA B 111 48.219 48.882 45.050 1.00 15.00 B N +ATOM 2139 HN ALA B 111 47.964 49.389 45.847 1.00 15.00 B H +ATOM 2140 CA ALA B 111 47.228 48.644 44.022 1.00 15.00 B C +ATOM 2141 CB ALA B 111 45.831 49.006 44.518 1.00 15.00 B C +ATOM 2142 C ALA B 111 47.566 49.450 42.788 1.00 15.00 B C +ATOM 2143 O ALA B 111 47.606 48.926 41.672 1.00 15.00 B O +ATOM 2144 N ARG B 112 47.789 50.736 42.989 1.00 15.00 B N +ATOM 2145 HN ARG B 112 47.704 51.112 43.892 1.00 15.00 B H +ATOM 2146 CA ARG B 112 48.118 51.604 41.892 1.00 15.00 B C +ATOM 2147 CB ARG B 112 46.832 52.014 41.182 1.00 15.00 B C +ATOM 2148 CG ARG B 112 47.063 52.379 39.738 1.00 15.00 B C +ATOM 2149 CD ARG B 112 46.384 53.678 39.401 1.00 15.00 B C +ATOM 2150 NE ARG B 112 44.960 53.505 39.191 1.00 15.00 B N +ATOM 2151 HE ARG B 112 44.495 52.788 39.701 1.00 15.00 B H +ATOM 2152 CZ ARG B 112 44.269 54.270 38.355 1.00 15.00 B C +ATOM 2153 NH1 ARG B 112 44.889 55.248 37.679 1.00 15.00 B N +ATOM 2154 HH11 ARG B 112 45.909 55.395 37.811 1.00 15.00 B H +ATOM 2155 HH12 ARG B 112 44.364 55.855 37.020 1.00 15.00 B H +ATOM 2156 NH2 ARG B 112 42.982 54.062 38.205 1.00 15.00 B N +ATOM 2157 HH21 ARG B 112 42.522 53.296 38.743 1.00 15.00 B H +ATOM 2158 HH22 ARG B 112 42.426 54.653 37.556 1.00 15.00 B H +ATOM 2159 C ARG B 112 48.891 52.838 42.372 1.00 15.00 B C +ATOM 2160 O ARG B 112 48.798 53.225 43.541 1.00 15.00 B O +ATOM 2161 N LEU B 113 49.644 53.463 41.461 1.00 15.00 B N +ATOM 2162 HN LEU B 113 49.674 53.118 40.547 1.00 15.00 B H +ATOM 2163 CA LEU B 113 50.428 54.651 41.784 1.00 15.00 B C +ATOM 2164 CB LEU B 113 51.919 54.337 41.627 1.00 15.00 B C +ATOM 2165 CG LEU B 113 52.511 53.379 42.663 1.00 15.00 B C +ATOM 2166 CD1 LEU B 113 53.843 52.817 42.196 1.00 15.00 B C +ATOM 2167 CD2 LEU B 113 52.664 54.074 44.002 1.00 15.00 B C +ATOM 2168 C LEU B 113 50.030 55.812 40.870 1.00 15.00 B C +ATOM 2169 O LEU B 113 49.444 55.588 39.811 1.00 15.00 B O +ATOM 2170 N PRO B 114 50.323 57.067 41.278 1.00 15.00 B N +ATOM 2171 CA PRO B 114 49.995 58.259 40.483 1.00 15.00 B C +ATOM 2172 CB PRO B 114 50.690 59.392 41.241 1.00 15.00 B C +ATOM 2173 CG PRO B 114 50.765 58.903 42.644 1.00 15.00 B C +ATOM 2174 CD PRO B 114 50.981 57.422 42.550 1.00 15.00 B C +ATOM 2175 C PRO B 114 50.538 58.167 39.060 1.00 15.00 B C +ATOM 2176 O PRO B 114 51.719 57.872 38.855 1.00 15.00 B O +ATOM 2177 N LYS B 115 49.651 58.406 38.088 1.00 15.00 B N +ATOM 2178 HN LYS B 115 48.730 58.628 38.340 1.00 15.00 B H +ATOM 2179 CA LYS B 115 49.996 58.353 36.664 1.00 15.00 B C +ATOM 2180 CB LYS B 115 51.188 59.257 36.328 1.00 15.00 B C +ATOM 2181 CG LYS B 115 50.937 60.738 36.563 1.00 15.00 B C +ATOM 2182 CD LYS B 115 52.153 61.564 36.184 1.00 15.00 B C +ATOM 2183 CE LYS B 115 51.831 63.048 36.175 1.00 15.00 B C +ATOM 2184 NZ LYS B 115 52.209 63.684 34.883 1.00 15.00 B N +ATOM 2185 HZ1 LYS B 115 52.002 64.703 34.911 1.00 15.00 B H +ATOM 2186 HZ2 LYS B 115 51.673 63.254 34.103 1.00 15.00 B H +ATOM 2187 HZ3 LYS B 115 53.225 63.551 34.703 1.00 15.00 B H +ATOM 2188 C LYS B 115 50.241 56.923 36.176 1.00 15.00 B C +ATOM 2189 O LYS B 115 50.822 56.719 35.110 1.00 15.00 B O +ATOM 2190 N ASP B 116 49.788 55.941 36.967 1.00 15.00 B N +ATOM 2191 HN ASP B 116 49.337 56.180 37.803 1.00 15.00 B H +ATOM 2192 CA ASP B 116 49.944 54.521 36.635 1.00 15.00 B C +ATOM 2193 CB ASP B 116 49.205 54.159 35.341 1.00 15.00 B C +ATOM 2194 CG ASP B 116 47.718 53.958 35.551 1.00 15.00 B C +ATOM 2195 OD1 ASP B 116 46.954 54.926 35.354 1.00 15.00 B O +ATOM 2196 OD2 ASP B 116 47.316 52.832 35.911 1.00 15.00 B O +ATOM 2197 C ASP B 116 51.407 54.092 36.557 1.00 15.00 B C +ATOM 2198 O ASP B 116 51.751 53.167 35.819 1.00 15.00 B O +ATOM 2199 N VAL B 117 52.266 54.754 37.331 1.00 15.00 B N +ATOM 2200 HN VAL B 117 51.937 55.475 37.906 1.00 15.00 B H +ATOM 2201 CA VAL B 117 53.688 54.423 37.337 1.00 15.00 B C +ATOM 2202 CB VAL B 117 54.560 55.533 37.961 1.00 15.00 B C +ATOM 2203 CG1 VAL B 117 54.438 56.821 37.159 1.00 15.00 B C +ATOM 2204 CG2 VAL B 117 54.193 55.769 39.418 1.00 15.00 B C +ATOM 2205 C VAL B 117 53.945 53.091 38.035 1.00 15.00 B C +ATOM 2206 O VAL B 117 53.078 52.565 38.734 1.00 15.00 B O +ATOM 2207 N LYS B 118 55.140 52.552 37.841 1.00 15.00 B N +ATOM 2208 HN LYS B 118 55.795 53.025 37.286 1.00 15.00 B H +ATOM 2209 CA LYS B 118 55.502 51.269 38.430 1.00 15.00 B C +ATOM 2210 CB LYS B 118 56.297 50.428 37.427 1.00 15.00 B C +ATOM 2211 CG LYS B 118 55.586 50.182 36.107 1.00 15.00 B C +ATOM 2212 CD LYS B 118 56.520 49.532 35.100 1.00 15.00 B C +ATOM 2213 CE LYS B 118 55.835 49.308 33.762 1.00 15.00 B C +ATOM 2214 NZ LYS B 118 56.764 48.710 32.765 1.00 15.00 B N +ATOM 2215 HZ1 LYS B 118 57.145 47.812 33.125 1.00 15.00 B H +ATOM 2216 HZ2 LYS B 118 57.556 49.359 32.580 1.00 15.00 B H +ATOM 2217 HZ3 LYS B 118 56.263 48.529 31.872 1.00 15.00 B H +ATOM 2218 C LYS B 118 56.292 51.407 39.731 1.00 15.00 B C +ATOM 2219 O LYS B 118 56.583 50.401 40.380 1.00 15.00 B O +ATOM 2220 N ILE B 119 56.640 52.636 40.123 1.00 15.00 B N +ATOM 2221 HN ILE B 119 56.380 53.413 39.585 1.00 15.00 B H +ATOM 2222 CA ILE B 119 57.407 52.826 41.354 1.00 15.00 B C +ATOM 2223 CB ILE B 119 58.881 52.382 41.177 1.00 15.00 B C +ATOM 2224 CG1 ILE B 119 59.600 52.301 42.527 1.00 15.00 B C +ATOM 2225 CG2 ILE B 119 59.622 53.306 40.218 1.00 15.00 B C +ATOM 2226 CD1 ILE B 119 60.977 51.684 42.452 1.00 15.00 B C +ATOM 2227 C ILE B 119 57.353 54.256 41.908 1.00 15.00 B C +ATOM 2228 O ILE B 119 57.290 55.234 41.164 1.00 15.00 B O +ATOM 2229 N GLU B 120 57.358 54.345 43.238 1.00 15.00 B N +ATOM 2230 HN GLU B 120 57.355 53.517 43.761 1.00 15.00 B H +ATOM 2231 CA GLU B 120 57.358 55.618 43.953 1.00 15.00 B C +ATOM 2232 CB GLU B 120 55.952 55.984 44.427 1.00 15.00 B C +ATOM 2233 CG GLU B 120 55.861 57.367 45.050 1.00 15.00 B C +ATOM 2234 CD GLU B 120 54.468 57.697 45.541 1.00 15.00 B C +ATOM 2235 OE1 GLU B 120 54.349 58.302 46.627 1.00 15.00 B O +ATOM 2236 OE2 GLU B 120 53.499 57.348 44.841 1.00 15.00 B O +ATOM 2237 C GLU B 120 58.296 55.494 45.148 1.00 15.00 B C +ATOM 2238 O GLU B 120 58.157 54.574 45.953 1.00 15.00 B O +ATOM 2239 N ILE B 121 59.254 56.408 45.268 1.00 15.00 B N +ATOM 2240 HN ILE B 121 59.309 57.141 44.619 1.00 15.00 B H +ATOM 2241 CA ILE B 121 60.221 56.332 46.357 1.00 15.00 B C +ATOM 2242 CB ILE B 121 61.627 55.949 45.832 1.00 15.00 B C +ATOM 2243 CG1 ILE B 121 61.560 54.688 44.963 1.00 15.00 B C +ATOM 2244 CG2 ILE B 121 62.599 55.748 46.987 1.00 15.00 B C +ATOM 2245 CD1 ILE B 121 62.828 54.409 44.187 1.00 15.00 B C +ATOM 2246 C ILE B 121 60.337 57.617 47.176 1.00 15.00 B C +ATOM 2247 O ILE B 121 60.662 58.680 46.647 1.00 15.00 B O +ATOM 2248 N GLU B 122 60.061 57.500 48.474 1.00 15.00 B N +ATOM 2249 HN GLU B 122 59.751 56.636 48.815 1.00 15.00 B H +ATOM 2250 CA GLU B 122 60.201 58.618 49.404 1.00 15.00 B C +ATOM 2251 CB GLU B 122 58.992 58.720 50.344 1.00 15.00 B C +ATOM 2252 CG GLU B 122 58.751 57.486 51.201 1.00 15.00 B C +ATOM 2253 CD GLU B 122 57.813 57.747 52.367 1.00 15.00 B C +ATOM 2254 OE1 GLU B 122 57.865 56.983 53.352 1.00 15.00 B O +ATOM 2255 OE2 GLU B 122 57.030 58.715 52.301 1.00 15.00 B O +ATOM 2256 C GLU B 122 61.484 58.387 50.201 1.00 15.00 B C +ATOM 2257 O GLU B 122 61.879 57.238 50.402 1.00 15.00 B O +ATOM 2258 N ALA B 123 62.143 59.449 50.654 1.00 15.00 B N +ATOM 2259 HN ALA B 123 61.786 60.348 50.502 1.00 15.00 B H +ATOM 2260 CA ALA B 123 63.395 59.271 51.384 1.00 15.00 B C +ATOM 2261 CB ALA B 123 64.574 59.275 50.424 1.00 15.00 B C +ATOM 2262 C ALA B 123 63.618 60.283 52.502 1.00 15.00 B C +ATOM 2263 O ALA B 123 63.102 61.400 52.477 1.00 15.00 B O +ATOM 2264 N ILE B 124 64.412 59.854 53.481 1.00 15.00 B N +ATOM 2265 HN ILE B 124 64.766 58.942 53.427 1.00 15.00 B H +ATOM 2266 CA ILE B 124 64.774 60.669 54.632 1.00 15.00 B C +ATOM 2267 CB ILE B 124 64.211 60.057 55.939 1.00 15.00 B C +ATOM 2268 CG1 ILE B 124 62.677 60.055 55.916 1.00 15.00 B C +ATOM 2269 CG2 ILE B 124 64.732 60.800 57.162 1.00 15.00 B C +ATOM 2270 CD1 ILE B 124 62.041 59.380 57.111 1.00 15.00 B C +ATOM 2271 C ILE B 124 66.299 60.743 54.726 1.00 15.00 B C +ATOM 2272 O ILE B 124 66.972 59.715 54.740 1.00 15.00 B O +ATOM 2273 N ALA B 125 66.838 61.957 54.777 1.00 15.00 B N +ATOM 2274 HN ALA B 125 66.250 62.742 54.765 1.00 15.00 B H +ATOM 2275 CA ALA B 125 68.284 62.151 54.855 1.00 15.00 B C +ATOM 2276 CB ALA B 125 68.796 62.795 53.575 1.00 15.00 B C +ATOM 2277 C ALA B 125 68.660 62.999 56.065 1.00 15.00 B C +ATOM 2278 O ALA B 125 67.851 63.777 56.558 1.00 15.00 B O +ATOM 2279 N VAL B 126 69.891 62.844 56.544 1.00 15.00 B N +ATOM 2280 HN VAL B 126 70.497 62.207 56.112 1.00 15.00 B H +ATOM 2281 CA VAL B 126 70.360 63.604 57.700 1.00 15.00 B C +ATOM 2282 CB VAL B 126 70.408 62.749 58.988 1.00 15.00 B C +ATOM 2283 CG1 VAL B 126 69.006 62.443 59.488 1.00 15.00 B C +ATOM 2284 CG2 VAL B 126 71.191 61.464 58.756 1.00 15.00 B C +ATOM 2285 C VAL B 126 71.733 64.219 57.451 1.00 15.00 B C +ATOM 2286 O VAL B 126 72.539 63.679 56.694 1.00 15.00 B O +ATOM 2287 N ARG B 127 71.989 65.358 58.089 1.00 15.00 B N +ATOM 2288 HN ARG B 127 71.300 65.746 58.668 1.00 15.00 B H +ATOM 2289 CA ARG B 127 73.267 66.046 57.947 1.00 15.00 B C +ATOM 2290 CB ARG B 127 73.118 67.537 58.261 1.00 15.00 B C +ATOM 2291 CG ARG B 127 72.010 68.222 57.473 1.00 15.00 B C +ATOM 2292 CD ARG B 127 72.140 69.734 57.526 1.00 15.00 B C +ATOM 2293 NE ARG B 127 71.070 70.407 56.786 1.00 15.00 B N +ATOM 2294 HE ARG B 127 70.254 70.637 57.281 1.00 15.00 B H +ATOM 2295 CZ ARG B 127 71.136 70.710 55.493 1.00 15.00 B C +ATOM 2296 NH1 ARG B 127 72.218 70.403 54.791 1.00 15.00 B N +ATOM 2297 HH11 ARG B 127 73.018 69.919 55.251 1.00 15.00 B H +ATOM 2298 HH12 ARG B 127 72.266 70.642 53.781 1.00 15.00 B H +ATOM 2299 NH2 ARG B 127 70.126 71.333 54.905 1.00 15.00 B N +ATOM 2300 HH21 ARG B 127 69.276 71.584 55.452 1.00 15.00 B H +ATOM 2301 HH22 ARG B 127 70.181 71.570 53.893 1.00 15.00 B H +ATOM 2302 C ARG B 127 74.328 65.398 58.835 1.00 15.00 B C +ATOM 2303 O ARG B 127 75.487 65.269 58.442 1.00 15.00 B O +ATOM 2304 N ARG B 128 73.922 64.993 60.037 1.00 15.00 B N +ATOM 2305 HN ARG B 128 72.990 65.148 60.303 1.00 15.00 B H +ATOM 2306 CA ARG B 128 74.827 64.329 60.971 1.00 15.00 B C +ATOM 2307 CB ARG B 128 74.733 64.942 62.371 1.00 15.00 B C +ATOM 2308 CG ARG B 128 75.730 66.059 62.636 1.00 15.00 B C +ATOM 2309 CD ARG B 128 76.084 66.140 64.114 1.00 15.00 B C +ATOM 2310 NE ARG B 128 77.327 65.430 64.428 1.00 15.00 B N +ATOM 2311 HE ARG B 128 77.983 65.328 63.708 1.00 15.00 B H +ATOM 2312 CZ ARG B 128 77.608 64.916 65.626 1.00 15.00 B C +ATOM 2313 NH1 ARG B 128 76.735 65.018 66.620 1.00 15.00 B N +ATOM 2314 HH11 ARG B 128 75.827 65.501 66.466 1.00 15.00 B H +ATOM 2315 HH12 ARG B 128 76.957 64.615 67.552 1.00 15.00 B H +ATOM 2316 NH2 ARG B 128 78.776 64.322 65.840 1.00 15.00 B N +ATOM 2317 HH21 ARG B 128 78.994 63.920 66.776 1.00 15.00 B H +ATOM 2318 HH22 ARG B 128 79.476 64.259 65.073 1.00 15.00 B H +ATOM 2319 C ARG B 128 74.525 62.837 61.040 1.00 15.00 B C +ATOM 2320 O ARG B 128 73.375 62.435 61.225 1.00 15.00 B O +ATOM 2321 N SER C 2 75.185 59.762 61.984 1.00 15.00 C N +ATOM 2322 HN SER C 2 75.885 59.873 61.307 1.00 15.00 C H +ATOM 2323 CA SER C 2 74.354 58.564 61.957 1.00 15.00 C C +ATOM 2324 CB SER C 2 73.286 58.677 60.865 1.00 15.00 C C +ATOM 2325 OG SER C 2 73.873 58.733 59.576 1.00 15.00 C O +ATOM 2326 HG SER C 2 73.884 59.642 59.268 1.00 15.00 C H +ATOM 2327 C SER C 2 75.203 57.314 61.738 1.00 15.00 C C +ATOM 2328 O SER C 2 76.324 57.396 61.238 1.00 15.00 C O +ATOM 2329 N LYS C 3 74.664 56.158 62.121 1.00 15.00 C N +ATOM 2330 HN LYS C 3 73.769 56.158 62.520 1.00 15.00 C H +ATOM 2331 CA LYS C 3 75.374 54.892 61.963 1.00 15.00 C C +ATOM 2332 CB LYS C 3 76.161 54.545 63.234 1.00 15.00 C C +ATOM 2333 CG LYS C 3 75.299 54.123 64.414 1.00 15.00 C C +ATOM 2334 CD LYS C 3 76.114 53.999 65.693 1.00 15.00 C C +ATOM 2335 CE LYS C 3 76.492 55.365 66.244 1.00 15.00 C C +ATOM 2336 NZ LYS C 3 76.989 55.282 67.646 1.00 15.00 C N +ATOM 2337 HZ1 LYS C 3 77.814 54.651 67.698 1.00 15.00 C H +ATOM 2338 HZ2 LYS C 3 76.243 54.910 68.268 1.00 15.00 C H +ATOM 2339 HZ3 LYS C 3 77.266 56.226 67.984 1.00 15.00 C H +ATOM 2340 C LYS C 3 74.419 53.756 61.592 1.00 15.00 C C +ATOM 2341 O LYS C 3 73.207 53.868 61.767 1.00 15.00 C O +ATOM 2342 N THR C 4 74.978 52.668 61.075 1.00 15.00 C N +ATOM 2343 HN THR C 4 75.950 52.646 60.951 1.00 15.00 C H +ATOM 2344 CA THR C 4 74.189 51.504 60.676 1.00 15.00 C C +ATOM 2345 CB THR C 4 74.897 50.728 59.539 1.00 15.00 C C +ATOM 2346 OG1 THR C 4 74.866 51.498 58.332 1.00 15.00 C O +ATOM 2347 HG1 THR C 4 75.114 50.941 57.590 1.00 15.00 C H +ATOM 2348 CG2 THR C 4 74.243 49.375 59.289 1.00 15.00 C C +ATOM 2349 C THR C 4 73.953 50.558 61.857 1.00 15.00 C C +ATOM 2350 O THR C 4 74.860 50.301 62.650 1.00 15.00 C O +ATOM 2351 N ILE C 5 72.726 50.054 61.971 1.00 15.00 C N +ATOM 2352 HN ILE C 5 72.039 50.321 61.326 1.00 15.00 C H +ATOM 2353 CA ILE C 5 72.377 49.114 63.031 1.00 15.00 C C +ATOM 2354 CB ILE C 5 70.962 49.373 63.597 1.00 15.00 C C +ATOM 2355 CG1 ILE C 5 70.855 50.798 64.149 1.00 15.00 C C +ATOM 2356 CG2 ILE C 5 70.630 48.356 64.681 1.00 15.00 C C +ATOM 2357 CD1 ILE C 5 69.486 51.145 64.693 1.00 15.00 C C +ATOM 2358 C ILE C 5 72.456 47.685 62.497 1.00 15.00 C C +ATOM 2359 O ILE C 5 71.644 47.277 61.665 1.00 15.00 C O +ATOM 2360 N ALA C 6 73.447 46.935 62.970 1.00 15.00 C N +ATOM 2361 HN ALA C 6 74.062 47.316 63.631 1.00 15.00 C H +ATOM 2362 CA ALA C 6 73.637 45.557 62.532 1.00 15.00 C C +ATOM 2363 CB ALA C 6 74.943 45.422 61.763 1.00 15.00 C C +ATOM 2364 C ALA C 6 73.602 44.582 63.704 1.00 15.00 C C +ATOM 2365 O ALA C 6 74.448 44.636 64.598 1.00 15.00 C O +ATOM 2366 N THR C 7 72.616 43.690 63.689 1.00 15.00 C N +ATOM 2367 HN THR C 7 71.971 43.706 62.951 1.00 15.00 C H +ATOM 2368 CA THR C 7 72.464 42.692 64.738 1.00 15.00 C C +ATOM 2369 CB THR C 7 71.385 43.089 65.771 1.00 15.00 C C +ATOM 2370 OG1 THR C 7 71.247 42.057 66.755 1.00 15.00 C O +ATOM 2371 HG1 THR C 7 71.893 41.365 66.586 1.00 15.00 C H +ATOM 2372 CG2 THR C 7 70.040 43.335 65.100 1.00 15.00 C C +ATOM 2373 C THR C 7 72.154 41.310 64.158 1.00 15.00 C C +ATOM 2374 O THR C 7 71.469 41.183 63.142 1.00 15.00 C O +ATOM 2375 N GLU C 8 72.674 40.281 64.819 1.00 15.00 C N +ATOM 2376 HN GLU C 8 73.215 40.458 65.618 1.00 15.00 C H +ATOM 2377 CA GLU C 8 72.472 38.897 64.400 1.00 15.00 C C +ATOM 2378 CB GLU C 8 73.602 38.015 64.955 1.00 15.00 C C +ATOM 2379 CG GLU C 8 73.479 37.683 66.442 1.00 15.00 C C +ATOM 2380 CD GLU C 8 74.089 38.728 67.365 1.00 15.00 C C +ATOM 2381 OE1 GLU C 8 74.370 39.854 66.903 1.00 15.00 C O +ATOM 2382 OE2 GLU C 8 74.282 38.417 68.558 1.00 15.00 C O +ATOM 2383 C GLU C 8 71.125 38.368 64.889 1.00 15.00 C C +ATOM 2384 O GLU C 8 70.694 37.279 64.508 1.00 15.00 C O +ATOM 2385 N ASN C 9 70.465 39.160 65.729 1.00 15.00 C N +ATOM 2386 HN ASN C 9 70.858 40.023 65.974 1.00 15.00 C H +ATOM 2387 CA ASN C 9 69.174 38.786 66.292 1.00 15.00 C C +ATOM 2388 CB ASN C 9 68.962 39.493 67.632 1.00 15.00 C C +ATOM 2389 CG ASN C 9 69.964 39.037 68.676 1.00 15.00 C C +ATOM 2390 OD1 ASN C 9 70.297 37.854 68.756 1.00 15.00 C O +ATOM 2391 ND2 ASN C 9 70.466 39.975 69.473 1.00 15.00 C N +ATOM 2392 HD21 ASN C 9 70.167 40.898 69.346 1.00 15.00 C H +ATOM 2393 HD22 ASN C 9 71.117 39.703 70.153 1.00 15.00 C H +ATOM 2394 C ASN C 9 68.032 39.071 65.319 1.00 15.00 C C +ATOM 2395 O ASN C 9 66.877 38.743 65.585 1.00 15.00 C O +ATOM 2396 N ALA C 10 68.373 39.688 64.193 1.00 15.00 C N +ATOM 2397 HN ALA C 10 69.309 39.945 64.058 1.00 15.00 C H +ATOM 2398 CA ALA C 10 67.402 40.001 63.155 1.00 15.00 C C +ATOM 2399 CB ALA C 10 67.189 41.507 63.074 1.00 15.00 C C +ATOM 2400 C ALA C 10 67.900 39.457 61.818 1.00 15.00 C C +ATOM 2401 O ALA C 10 69.107 39.286 61.637 1.00 15.00 C O +ATOM 2402 N PRO C 11 66.983 39.151 60.872 1.00 15.00 C N +ATOM 2403 CA PRO C 11 67.345 38.631 59.545 1.00 15.00 C C +ATOM 2404 CB PRO C 11 66.035 38.714 58.764 1.00 15.00 C C +ATOM 2405 CG PRO C 11 64.979 38.598 59.805 1.00 15.00 C C +ATOM 2406 CD PRO C 11 65.524 39.277 61.031 1.00 15.00 C C +ATOM 2407 C PRO C 11 68.412 39.491 58.876 1.00 15.00 C C +ATOM 2408 O PRO C 11 68.253 40.707 58.753 1.00 15.00 C O +ATOM 2409 N ALA C 12 69.499 38.846 58.455 1.00 15.00 C N +ATOM 2410 HN ALA C 12 69.547 37.874 58.578 1.00 15.00 C H +ATOM 2411 CA ALA C 12 70.619 39.532 57.818 1.00 15.00 C C +ATOM 2412 CB ALA C 12 71.707 38.536 57.447 1.00 15.00 C C +ATOM 2413 C ALA C 12 70.195 40.340 56.595 1.00 15.00 C C +ATOM 2414 O ALA C 12 69.400 39.879 55.773 1.00 15.00 C O +ATOM 2415 N ALA C 13 70.732 41.553 56.494 1.00 15.00 C N +ATOM 2416 HN ALA C 13 71.346 41.862 57.193 1.00 15.00 C H +ATOM 2417 CA ALA C 13 70.436 42.438 55.375 1.00 15.00 C C +ATOM 2418 CB ALA C 13 70.720 43.881 55.766 1.00 15.00 C C +ATOM 2419 C ALA C 13 71.258 42.037 54.151 1.00 15.00 C C +ATOM 2420 O ALA C 13 72.388 42.489 53.971 1.00 15.00 C O +ATOM 2421 N ILE C 14 70.677 41.177 53.319 1.00 15.00 C N +ATOM 2422 HN ILE C 14 69.770 40.866 53.518 1.00 15.00 C H +ATOM 2423 CA ILE C 14 71.348 40.680 52.121 1.00 15.00 C C +ATOM 2424 CB ILE C 14 70.805 39.292 51.711 1.00 15.00 C C +ATOM 2425 CG1 ILE C 14 70.907 38.313 52.886 1.00 15.00 C C +ATOM 2426 CG2 ILE C 14 71.560 38.755 50.503 1.00 15.00 C C +ATOM 2427 CD1 ILE C 14 70.222 36.987 52.648 1.00 15.00 C C +ATOM 2428 C ILE C 14 71.220 41.644 50.944 1.00 15.00 C C +ATOM 2429 O ILE C 14 72.188 41.882 50.220 1.00 15.00 C O +ATOM 2430 N GLY C 15 70.025 42.198 50.753 1.00 15.00 C N +ATOM 2431 HN GLY C 15 69.290 41.982 51.365 1.00 15.00 C H +ATOM 2432 CA GLY C 15 69.804 43.122 49.654 1.00 15.00 C C +ATOM 2433 C GLY C 15 70.449 44.475 49.887 1.00 15.00 C C +ATOM 2434 O GLY C 15 71.193 44.650 50.854 1.00 15.00 C O +ATOM 2435 N PRO C 16 70.190 45.456 49.006 1.00 15.00 C N +ATOM 2436 CA PRO C 16 70.750 46.799 49.139 1.00 15.00 C C +ATOM 2437 CB PRO C 16 70.554 47.410 47.751 1.00 15.00 C C +ATOM 2438 CG PRO C 16 69.404 46.670 47.151 1.00 15.00 C C +ATOM 2439 CD PRO C 16 69.345 45.316 47.806 1.00 15.00 C C +ATOM 2440 C PRO C 16 70.027 47.624 50.206 1.00 15.00 C C +ATOM 2441 O PRO C 16 69.318 48.583 49.897 1.00 15.00 C O +ATOM 2442 N TYR C 17 70.223 47.237 51.466 1.00 15.00 C N +ATOM 2443 HN TYR C 17 70.804 46.465 51.638 1.00 15.00 C H +ATOM 2444 CA TYR C 17 69.602 47.919 52.595 1.00 15.00 C C +ATOM 2445 CB TYR C 17 68.097 47.614 52.639 1.00 15.00 C C +ATOM 2446 CG TYR C 17 67.774 46.170 52.974 1.00 15.00 C C +ATOM 2447 CD1 TYR C 17 67.511 45.780 54.282 1.00 15.00 C C +ATOM 2448 CD2 TYR C 17 67.740 45.198 51.983 1.00 15.00 C C +ATOM 2449 CE1 TYR C 17 67.238 44.462 54.594 1.00 15.00 C C +ATOM 2450 CE2 TYR C 17 67.461 43.880 52.285 1.00 15.00 C C +ATOM 2451 CZ TYR C 17 67.210 43.517 53.590 1.00 15.00 C C +ATOM 2452 OH TYR C 17 66.942 42.202 53.896 1.00 15.00 C O +ATOM 2453 HH TYR C 17 66.245 42.162 54.554 1.00 15.00 C H +ATOM 2454 C TYR C 17 70.236 47.468 53.908 1.00 15.00 C C +ATOM 2455 O TYR C 17 70.915 46.444 53.962 1.00 15.00 C O +ATOM 2456 N VAL C 18 70.019 48.252 54.956 1.00 15.00 C N +ATOM 2457 HN VAL C 18 69.515 49.083 54.833 1.00 15.00 C H +ATOM 2458 CA VAL C 18 70.515 47.917 56.285 1.00 15.00 C C +ATOM 2459 CB VAL C 18 71.390 49.035 56.891 1.00 15.00 C C +ATOM 2460 CG1 VAL C 18 72.686 49.181 56.109 1.00 15.00 C C +ATOM 2461 CG2 VAL C 18 70.634 50.356 56.942 1.00 15.00 C C +ATOM 2462 C VAL C 18 69.326 47.644 57.199 1.00 15.00 C C +ATOM 2463 O VAL C 18 68.220 48.099 56.919 1.00 15.00 C O +ATOM 2464 N GLN C 19 69.545 46.896 58.277 1.00 15.00 C N +ATOM 2465 HN GLN C 19 70.448 46.555 58.447 1.00 15.00 C H +ATOM 2466 CA GLN C 19 68.467 46.563 59.213 1.00 15.00 C C +ATOM 2467 CB GLN C 19 68.971 45.625 60.305 1.00 15.00 C C +ATOM 2468 CG GLN C 19 69.299 44.223 59.818 1.00 15.00 C C +ATOM 2469 CD GLN C 19 70.060 43.425 60.854 1.00 15.00 C C +ATOM 2470 OE1 GLN C 19 70.800 43.987 61.653 1.00 15.00 C O +ATOM 2471 NE2 GLN C 19 69.882 42.112 60.846 1.00 15.00 C N +ATOM 2472 HE21 GLN C 19 69.275 41.730 60.179 1.00 15.00 C H +ATOM 2473 HE22 GLN C 19 70.366 41.575 61.511 1.00 15.00 C H +ATOM 2474 C GLN C 19 67.825 47.805 59.834 1.00 15.00 C C +ATOM 2475 O GLN C 19 66.610 47.857 60.015 1.00 15.00 C O +ATOM 2476 N GLY C 20 68.646 48.798 60.157 1.00 15.00 C N +ATOM 2477 HN GLY C 20 69.605 48.701 59.986 1.00 15.00 C H +ATOM 2478 CA GLY C 20 68.141 50.021 60.753 1.00 15.00 C C +ATOM 2479 C GLY C 20 69.199 51.104 60.808 1.00 15.00 C C +ATOM 2480 O GLY C 20 70.358 50.857 60.479 1.00 15.00 C O +ATOM 2481 N VAL C 21 68.807 52.306 61.224 1.00 15.00 C N +ATOM 2482 HN VAL C 21 67.868 52.447 61.471 1.00 15.00 C H +ATOM 2483 CA VAL C 21 69.744 53.421 61.312 1.00 15.00 C C +ATOM 2484 CB VAL C 21 69.589 54.423 60.145 1.00 15.00 C C +ATOM 2485 CG1 VAL C 21 70.168 53.849 58.860 1.00 15.00 C C +ATOM 2486 CG2 VAL C 21 68.131 54.817 59.952 1.00 15.00 C C +ATOM 2487 C VAL C 21 69.644 54.171 62.639 1.00 15.00 C C +ATOM 2488 O VAL C 21 68.552 54.458 63.131 1.00 15.00 C O +ATOM 2489 N ASP C 22 70.804 54.471 63.209 1.00 15.00 C N +ATOM 2490 HN ASP C 22 71.632 54.184 62.772 1.00 15.00 C H +ATOM 2491 CA ASP C 22 70.893 55.207 64.462 1.00 15.00 C C +ATOM 2492 CB ASP C 22 71.941 54.546 65.368 1.00 15.00 C C +ATOM 2493 CG ASP C 22 71.980 55.097 66.783 1.00 15.00 C C +ATOM 2494 OD1 ASP C 22 72.694 54.507 67.621 1.00 15.00 C O +ATOM 2495 OD2 ASP C 22 71.306 56.113 67.057 1.00 15.00 C O +ATOM 2496 C ASP C 22 71.293 56.648 64.153 1.00 15.00 C C +ATOM 2497 O ASP C 22 72.461 56.935 63.897 1.00 15.00 C O +ATOM 2498 N LEU C 23 70.314 57.546 64.169 1.00 15.00 C N +ATOM 2499 HN LEU C 23 69.406 57.256 64.397 1.00 15.00 C H +ATOM 2500 CA LEU C 23 70.556 58.957 63.864 1.00 15.00 C C +ATOM 2501 CB LEU C 23 69.374 59.529 63.076 1.00 15.00 C C +ATOM 2502 CG LEU C 23 68.719 58.592 62.059 1.00 15.00 C C +ATOM 2503 CD1 LEU C 23 67.440 59.206 61.516 1.00 15.00 C C +ATOM 2504 CD2 LEU C 23 69.681 58.266 60.930 1.00 15.00 C C +ATOM 2505 C LEU C 23 70.764 59.780 65.131 1.00 15.00 C C +ATOM 2506 O LEU C 23 70.658 61.007 65.109 1.00 15.00 C O +ATOM 2507 N GLY C 24 71.071 59.103 66.228 1.00 15.00 C N +ATOM 2508 HN GLY C 24 71.157 58.127 66.185 1.00 15.00 C H +ATOM 2509 CA GLY C 24 71.274 59.789 67.485 1.00 15.00 C C +ATOM 2510 C GLY C 24 70.098 59.585 68.410 1.00 15.00 C C +ATOM 2511 O GLY C 24 70.002 58.560 69.073 1.00 15.00 C O +ATOM 2512 N ASN C 25 69.189 60.552 68.442 1.00 15.00 C N +ATOM 2513 HN ASN C 25 69.314 61.347 67.882 1.00 15.00 C H +ATOM 2514 CA ASN C 25 68.008 60.455 69.289 1.00 15.00 C C +ATOM 2515 CB ASN C 25 67.436 61.847 69.580 1.00 15.00 C C +ATOM 2516 CG ASN C 25 66.179 61.801 70.430 1.00 15.00 C C +ATOM 2517 OD1 ASN C 25 66.215 61.383 71.587 1.00 15.00 C O +ATOM 2518 ND2 ASN C 25 65.060 62.235 69.861 1.00 15.00 C N +ATOM 2519 HD21 ASN C 25 65.105 62.557 68.936 1.00 15.00 C H +ATOM 2520 HD22 ASN C 25 64.233 62.216 70.388 1.00 15.00 C H +ATOM 2521 C ASN C 25 66.947 59.569 68.645 1.00 15.00 C C +ATOM 2522 O ASN C 25 66.244 58.832 69.330 1.00 15.00 C O +ATOM 2523 N MET C 26 66.853 59.633 67.320 1.00 15.00 C N +ATOM 2524 HN MET C 26 67.462 60.219 66.824 1.00 15.00 C H +ATOM 2525 CA MET C 26 65.871 58.846 66.589 1.00 15.00 C C +ATOM 2526 CB MET C 26 65.143 59.714 65.559 1.00 15.00 C C +ATOM 2527 CG MET C 26 64.128 58.960 64.714 1.00 15.00 C C +ATOM 2528 SD MET C 26 63.155 60.045 63.655 1.00 15.00 C S +ATOM 2529 CE MET C 26 62.204 60.944 64.874 1.00 15.00 C C +ATOM 2530 C MET C 26 66.487 57.624 65.913 1.00 15.00 C C +ATOM 2531 O MET C 26 67.556 57.700 65.310 1.00 15.00 C O +ATOM 2532 N ILE C 27 65.792 56.499 66.033 1.00 15.00 C N +ATOM 2533 HN ILE C 27 64.958 56.516 66.548 1.00 15.00 C H +ATOM 2534 CA ILE C 27 66.213 55.240 65.434 1.00 15.00 C C +ATOM 2535 CB ILE C 27 66.489 54.162 66.518 1.00 15.00 C C +ATOM 2536 CG1 ILE C 27 67.929 54.263 67.031 1.00 15.00 C C +ATOM 2537 CG2 ILE C 27 66.202 52.753 66.011 1.00 15.00 C C +ATOM 2538 CD1 ILE C 27 68.131 55.306 68.109 1.00 15.00 C C +ATOM 2539 C ILE C 27 65.124 54.762 64.471 1.00 15.00 C C +ATOM 2540 O ILE C 27 63.953 54.687 64.838 1.00 15.00 C O +ATOM 2541 N ILE C 28 65.506 54.465 63.236 1.00 15.00 C N +ATOM 2542 HN ILE C 28 66.452 54.546 62.992 1.00 15.00 C H +ATOM 2543 CA ILE C 28 64.546 54.013 62.235 1.00 15.00 C C +ATOM 2544 CB ILE C 28 64.436 55.004 61.057 1.00 15.00 C C +ATOM 2545 CG1 ILE C 28 64.199 56.426 61.582 1.00 15.00 C C +ATOM 2546 CG2 ILE C 28 63.309 54.592 60.120 1.00 15.00 C C +ATOM 2547 CD1 ILE C 28 64.219 57.493 60.511 1.00 15.00 C C +ATOM 2548 C ILE C 28 64.904 52.625 61.713 1.00 15.00 C C +ATOM 2549 O ILE C 28 66.014 52.395 61.244 1.00 15.00 C O +ATOM 2550 N THR C 29 63.950 51.706 61.796 1.00 15.00 C N +ATOM 2551 HN THR C 29 63.078 51.956 62.168 1.00 15.00 C H +ATOM 2552 CA THR C 29 64.163 50.335 61.346 1.00 15.00 C C +ATOM 2553 CB THR C 29 63.543 49.320 62.335 1.00 15.00 C C +ATOM 2554 OG1 THR C 29 62.127 49.238 62.120 1.00 15.00 C O +ATOM 2555 HG1 THR C 29 61.934 49.387 61.191 1.00 15.00 C H +ATOM 2556 CG2 THR C 29 63.802 49.741 63.775 1.00 15.00 C C +ATOM 2557 C THR C 29 63.550 50.104 59.967 1.00 15.00 C C +ATOM 2558 O THR C 29 62.666 50.847 59.537 1.00 15.00 C O +ATOM 2559 N SER C 30 64.031 49.074 59.278 1.00 15.00 C N +ATOM 2560 HN SER C 30 64.756 48.538 59.665 1.00 15.00 C H +ATOM 2561 CA SER C 30 63.515 48.724 57.961 1.00 15.00 C C +ATOM 2562 CB SER C 30 64.530 47.861 57.208 1.00 15.00 C C +ATOM 2563 OG SER C 30 65.629 48.628 56.768 1.00 15.00 C O +ATOM 2564 HG SER C 30 66.137 48.120 56.129 1.00 15.00 C H +ATOM 2565 C SER C 30 62.225 47.933 58.108 1.00 15.00 C C +ATOM 2566 O SER C 30 61.890 47.490 59.209 1.00 15.00 C O +ATOM 2567 N GLY C 31 61.496 47.774 57.004 1.00 15.00 C N +ATOM 2568 HN GLY C 31 61.788 48.193 56.167 1.00 15.00 C H +ATOM 2569 CA GLY C 31 60.273 46.995 57.037 1.00 15.00 C C +ATOM 2570 C GLY C 31 60.588 45.558 57.392 1.00 15.00 C C +ATOM 2571 O GLY C 31 61.129 44.815 56.572 1.00 15.00 C O +ATOM 2572 N GLN C 32 60.267 45.171 58.621 1.00 15.00 C N +ATOM 2573 HN GLN C 32 59.815 45.801 59.220 1.00 15.00 C H +ATOM 2574 CA GLN C 32 60.563 43.829 59.097 1.00 15.00 C C +ATOM 2575 CB GLN C 32 60.756 43.814 60.616 1.00 15.00 C C +ATOM 2576 CG GLN C 32 62.002 44.532 61.113 1.00 15.00 C C +ATOM 2577 CD GLN C 32 63.251 44.168 60.336 1.00 15.00 C C +ATOM 2578 OE1 GLN C 32 63.761 43.052 60.439 1.00 15.00 C O +ATOM 2579 NE2 GLN C 32 63.769 45.124 59.575 1.00 15.00 C N +ATOM 2580 HE21 GLN C 32 63.321 45.997 59.561 1.00 15.00 C H +ATOM 2581 HE22 GLN C 32 64.580 44.923 59.064 1.00 15.00 C H +ATOM 2582 C GLN C 32 59.503 42.812 58.712 1.00 15.00 C C +ATOM 2583 O GLN C 32 58.326 42.965 59.037 1.00 15.00 C O +ATOM 2584 N ILE C 33 59.938 41.772 58.014 1.00 15.00 C N +ATOM 2585 HN ILE C 33 60.883 41.731 57.759 1.00 15.00 C H +ATOM 2586 CA ILE C 33 59.050 40.693 57.616 1.00 15.00 C C +ATOM 2587 CB ILE C 33 59.302 40.232 56.162 1.00 15.00 C C +ATOM 2588 CG1 ILE C 33 60.780 39.904 55.934 1.00 15.00 C C +ATOM 2589 CG2 ILE C 33 58.829 41.299 55.184 1.00 15.00 C C +ATOM 2590 CD1 ILE C 33 61.088 39.412 54.534 1.00 15.00 C C +ATOM 2591 C ILE C 33 59.208 39.534 58.604 1.00 15.00 C C +ATOM 2592 O ILE C 33 60.205 39.475 59.325 1.00 15.00 C O +ATOM 2593 N PRO C 34 58.225 38.616 58.670 1.00 15.00 C N +ATOM 2594 CA PRO C 34 58.249 37.475 59.605 1.00 15.00 C C +ATOM 2595 CB PRO C 34 56.833 36.908 59.495 1.00 15.00 C C +ATOM 2596 CG PRO C 34 56.388 37.289 58.128 1.00 15.00 C C +ATOM 2597 CD PRO C 34 56.998 38.630 57.857 1.00 15.00 C C +ATOM 2598 C PRO C 34 59.277 36.382 59.287 1.00 15.00 C C +ATOM 2599 O PRO C 34 58.937 35.201 59.234 1.00 15.00 C O +ATOM 2600 N VAL C 35 60.534 36.767 59.106 1.00 15.00 C N +ATOM 2601 HN VAL C 35 60.756 37.721 59.158 1.00 15.00 C H +ATOM 2602 CA VAL C 35 61.591 35.802 58.826 1.00 15.00 C C +ATOM 2603 CB VAL C 35 62.552 36.303 57.725 1.00 15.00 C C +ATOM 2604 CG1 VAL C 35 63.752 35.375 57.581 1.00 15.00 C C +ATOM 2605 CG2 VAL C 35 61.820 36.420 56.399 1.00 15.00 C C +ATOM 2606 C VAL C 35 62.380 35.496 60.097 1.00 15.00 C C +ATOM 2607 O VAL C 35 62.883 36.406 60.757 1.00 15.00 C O +ATOM 2608 N ASN C 36 62.461 34.215 60.444 1.00 15.00 C N +ATOM 2609 HN ASN C 36 62.012 33.542 59.891 1.00 15.00 C H +ATOM 2610 CA ASN C 36 63.198 33.784 61.626 1.00 15.00 C C +ATOM 2611 CB ASN C 36 62.896 32.308 61.923 1.00 15.00 C C +ATOM 2612 CG ASN C 36 63.341 31.859 63.305 1.00 15.00 C C +ATOM 2613 OD1 ASN C 36 64.466 32.113 63.725 1.00 15.00 C O +ATOM 2614 ND2 ASN C 36 62.450 31.190 64.025 1.00 15.00 C N +ATOM 2615 HD21 ASN C 36 61.568 31.025 63.633 1.00 15.00 C H +ATOM 2616 HD22 ASN C 36 62.711 30.888 64.920 1.00 15.00 C H +ATOM 2617 C ASN C 36 64.696 33.991 61.397 1.00 15.00 C C +ATOM 2618 O ASN C 36 65.254 33.475 60.439 1.00 15.00 C O +ATOM 2619 N PRO C 37 65.358 34.771 62.263 1.00 15.00 C N +ATOM 2620 CA PRO C 37 66.799 35.047 62.137 1.00 15.00 C C +ATOM 2621 CB PRO C 37 67.048 36.104 63.218 1.00 15.00 C C +ATOM 2622 CG PRO C 37 65.956 35.894 64.211 1.00 15.00 C C +ATOM 2623 CD PRO C 37 64.759 35.461 63.420 1.00 15.00 C C +ATOM 2624 C PRO C 37 67.679 33.819 62.394 1.00 15.00 C C +ATOM 2625 O PRO C 37 68.847 33.794 62.006 1.00 15.00 C O +ATOM 2626 N LYS C 38 67.109 32.800 63.032 1.00 15.00 C N +ATOM 2627 HN LYS C 38 66.166 32.868 63.289 1.00 15.00 C H +ATOM 2628 CA LYS C 38 67.847 31.583 63.363 1.00 15.00 C C +ATOM 2629 CB LYS C 38 67.368 31.033 64.709 1.00 15.00 C C +ATOM 2630 CG LYS C 38 68.063 29.757 65.158 1.00 15.00 C C +ATOM 2631 CD LYS C 38 67.425 29.194 66.416 1.00 15.00 C C +ATOM 2632 CE LYS C 38 67.570 30.151 67.591 1.00 15.00 C C +ATOM 2633 NZ LYS C 38 68.998 30.411 67.922 1.00 15.00 C N +ATOM 2634 HZ1 LYS C 38 69.491 30.801 67.093 1.00 15.00 C H +ATOM 2635 HZ2 LYS C 38 69.465 29.527 68.204 1.00 15.00 C H +ATOM 2636 HZ3 LYS C 38 69.067 31.093 68.705 1.00 15.00 C H +ATOM 2637 C LYS C 38 67.744 30.502 62.283 1.00 15.00 C C +ATOM 2638 O LYS C 38 68.719 29.802 62.009 1.00 15.00 C O +ATOM 2639 N THR C 39 66.571 30.360 61.671 1.00 15.00 C N +ATOM 2640 HN THR C 39 65.828 30.954 61.907 1.00 15.00 C H +ATOM 2641 CA THR C 39 66.376 29.334 60.645 1.00 15.00 C C +ATOM 2642 CB THR C 39 65.175 28.419 60.966 1.00 15.00 C C +ATOM 2643 OG1 THR C 39 63.972 29.196 61.028 1.00 15.00 C O +ATOM 2644 HG1 THR C 39 64.100 30.022 60.558 1.00 15.00 C H +ATOM 2645 CG2 THR C 39 65.381 27.705 62.294 1.00 15.00 C C +ATOM 2646 C THR C 39 66.190 29.932 59.254 1.00 15.00 C C +ATOM 2647 O THR C 39 66.537 29.310 58.251 1.00 15.00 C O +ATOM 2648 N GLY C 40 65.643 31.138 59.201 1.00 15.00 C N +ATOM 2649 HN GLY C 40 65.402 31.594 60.036 1.00 15.00 C H +ATOM 2650 CA GLY C 40 65.403 31.794 57.928 1.00 15.00 C C +ATOM 2651 C GLY C 40 64.042 31.436 57.364 1.00 15.00 C C +ATOM 2652 O GLY C 40 63.703 31.821 56.245 1.00 15.00 C O +ATOM 2653 N GLU C 41 63.261 30.700 58.155 1.00 15.00 C N +ATOM 2654 HN GLU C 41 63.590 30.444 59.041 1.00 15.00 C H +ATOM 2655 CA GLU C 41 61.931 30.263 57.745 1.00 15.00 C C +ATOM 2656 CB GLU C 41 61.625 28.881 58.326 1.00 15.00 C C +ATOM 2657 CG GLU C 41 62.622 27.797 57.949 1.00 15.00 C C +ATOM 2658 CD GLU C 41 62.263 26.454 58.553 1.00 15.00 C C +ATOM 2659 OE1 GLU C 41 61.746 26.435 59.691 1.00 15.00 C O +ATOM 2660 OE2 GLU C 41 62.500 25.421 57.893 1.00 15.00 C O +ATOM 2661 C GLU C 41 60.856 31.241 58.195 1.00 15.00 C C +ATOM 2662 O GLU C 41 61.071 32.055 59.092 1.00 15.00 C O +ATOM 2663 N VAL C 42 59.690 31.141 57.566 1.00 15.00 C N +ATOM 2664 HN VAL C 42 59.586 30.467 56.862 1.00 15.00 C H +ATOM 2665 CA VAL C 42 58.561 32.004 57.891 1.00 15.00 C C +ATOM 2666 CB VAL C 42 58.121 32.838 56.665 1.00 15.00 C C +ATOM 2667 CG1 VAL C 42 56.914 33.704 56.995 1.00 15.00 C C +ATOM 2668 CG2 VAL C 42 59.269 33.695 56.156 1.00 15.00 C C +ATOM 2669 C VAL C 42 57.376 31.174 58.383 1.00 15.00 C C +ATOM 2670 O VAL C 42 56.926 30.258 57.693 1.00 15.00 C O +ATOM 2671 N PRO C 43 56.866 31.475 59.593 1.00 15.00 C N +ATOM 2672 CA PRO C 43 55.716 30.763 60.171 1.00 15.00 C C +ATOM 2673 CB PRO C 43 55.527 31.434 61.538 1.00 15.00 C C +ATOM 2674 CG PRO C 43 56.217 32.750 61.420 1.00 15.00 C C +ATOM 2675 CD PRO C 43 57.372 32.526 60.491 1.00 15.00 C C +ATOM 2676 C PRO C 43 54.460 30.947 59.320 1.00 15.00 C C +ATOM 2677 O PRO C 43 54.246 32.009 58.744 1.00 15.00 C O +ATOM 2678 N ALA C 44 53.640 29.905 59.234 1.00 15.00 C N +ATOM 2679 HN ALA C 44 53.864 29.079 59.710 1.00 15.00 C H +ATOM 2680 CA ALA C 44 52.413 29.962 58.445 1.00 15.00 C C +ATOM 2681 CB ALA C 44 51.891 28.563 58.160 1.00 15.00 C C +ATOM 2682 C ALA C 44 51.343 30.802 59.133 1.00 15.00 C C +ATOM 2683 O ALA C 44 50.681 31.617 58.492 1.00 15.00 C O +ATOM 2684 N ASP C 45 51.183 30.596 60.441 1.00 15.00 C N +ATOM 2685 HN ASP C 45 51.742 29.927 60.889 1.00 15.00 C H +ATOM 2686 CA ASP C 45 50.194 31.331 61.225 1.00 15.00 C C +ATOM 2687 CB ASP C 45 50.234 30.874 62.686 1.00 15.00 C C +ATOM 2688 CG ASP C 45 49.095 31.436 63.511 1.00 15.00 C C +ATOM 2689 OD1 ASP C 45 49.359 32.290 64.377 1.00 15.00 C O +ATOM 2690 OD2 ASP C 45 47.938 31.022 63.288 1.00 15.00 C O +ATOM 2691 C ASP C 45 50.424 32.837 61.129 1.00 15.00 C C +ATOM 2692 O ASP C 45 51.558 33.308 61.225 1.00 15.00 C O +ATOM 2693 N VAL C 46 49.339 33.585 60.935 1.00 15.00 C N +ATOM 2694 HN VAL C 46 48.465 33.149 60.886 1.00 15.00 C H +ATOM 2695 CA VAL C 46 49.414 35.038 60.803 1.00 15.00 C C +ATOM 2696 CB VAL C 46 48.110 35.632 60.219 1.00 15.00 C C +ATOM 2697 CG1 VAL C 46 46.936 35.455 61.173 1.00 15.00 C C +ATOM 2698 CG2 VAL C 46 48.292 37.094 59.836 1.00 15.00 C C +ATOM 2699 C VAL C 46 49.776 35.720 62.125 1.00 15.00 C C +ATOM 2700 O VAL C 46 50.467 36.739 62.133 1.00 15.00 C O +ATOM 2701 N ALA C 47 49.320 35.147 63.240 1.00 15.00 C N +ATOM 2702 HN ALA C 47 48.774 34.336 63.173 1.00 15.00 C H +ATOM 2703 CA ALA C 47 49.618 35.699 64.558 1.00 15.00 C C +ATOM 2704 CB ALA C 47 48.745 35.057 65.624 1.00 15.00 C C +ATOM 2705 C ALA C 47 51.091 35.493 64.882 1.00 15.00 C C +ATOM 2706 O ALA C 47 51.724 36.338 65.515 1.00 15.00 C O +ATOM 2707 N ALA C 48 51.628 34.360 64.433 1.00 15.00 C N +ATOM 2708 HN ALA C 48 51.059 33.723 63.950 1.00 15.00 C H +ATOM 2709 CA ALA C 48 53.032 34.039 64.642 1.00 15.00 C C +ATOM 2710 CB ALA C 48 53.290 32.565 64.364 1.00 15.00 C C +ATOM 2711 C ALA C 48 53.903 34.915 63.748 1.00 15.00 C C +ATOM 2712 O ALA C 48 55.030 35.256 64.105 1.00 15.00 C O +ATOM 2713 N GLN C 49 53.363 35.278 62.581 1.00 15.00 C N +ATOM 2714 HN GLN C 49 52.466 34.955 62.352 1.00 15.00 C H +ATOM 2715 CA GLN C 49 54.068 36.136 61.638 1.00 15.00 C C +ATOM 2716 CB GLN C 49 53.365 36.142 60.278 1.00 15.00 C C +ATOM 2717 CG GLN C 49 53.717 34.964 59.387 1.00 15.00 C C +ATOM 2718 CD GLN C 49 53.385 35.216 57.928 1.00 15.00 C C +ATOM 2719 OE1 GLN C 49 53.371 36.358 57.474 1.00 15.00 C O +ATOM 2720 NE2 GLN C 49 53.129 34.149 57.184 1.00 15.00 C N +ATOM 2721 HE21 GLN C 49 53.167 33.267 57.610 1.00 15.00 C H +ATOM 2722 HE22 GLN C 49 52.917 34.285 56.237 1.00 15.00 C H +ATOM 2723 C GLN C 49 54.156 37.557 62.176 1.00 15.00 C C +ATOM 2724 O GLN C 49 55.167 38.237 62.002 1.00 15.00 C O +ATOM 2725 N ALA C 50 53.085 37.997 62.835 1.00 15.00 C N +ATOM 2726 HN ALA C 50 52.310 37.404 62.932 1.00 15.00 C H +ATOM 2727 CA ALA C 50 53.032 39.332 63.414 1.00 15.00 C C +ATOM 2728 CB ALA C 50 51.619 39.655 63.876 1.00 15.00 C C +ATOM 2729 C ALA C 50 54.014 39.455 64.573 1.00 15.00 C C +ATOM 2730 O ALA C 50 54.645 40.494 64.753 1.00 15.00 C O +ATOM 2731 N ARG C 51 54.147 38.376 65.344 1.00 15.00 C N +ATOM 2732 HN ARG C 51 53.619 37.576 65.140 1.00 15.00 C H +ATOM 2733 CA ARG C 51 55.056 38.356 66.484 1.00 15.00 C C +ATOM 2734 CB ARG C 51 54.726 37.197 67.430 1.00 15.00 C C +ATOM 2735 CG ARG C 51 55.623 37.128 68.657 1.00 15.00 C C +ATOM 2736 CD ARG C 51 55.066 36.183 69.711 1.00 15.00 C C +ATOM 2737 NE ARG C 51 53.870 36.720 70.360 1.00 15.00 C N +ATOM 2738 HE ARG C 51 53.001 36.422 70.021 1.00 15.00 C H +ATOM 2739 CZ ARG C 51 53.900 37.578 71.380 1.00 15.00 C C +ATOM 2740 NH1 ARG C 51 55.060 38.003 71.867 1.00 15.00 C N +ATOM 2741 HH11 ARG C 51 55.954 37.667 71.453 1.00 15.00 C H +ATOM 2742 HH12 ARG C 51 55.077 38.672 72.665 1.00 15.00 C H +ATOM 2743 NH2 ARG C 51 52.767 38.013 71.914 1.00 15.00 C N +ATOM 2744 HH21 ARG C 51 51.855 37.685 71.538 1.00 15.00 C H +ATOM 2745 HH22 ARG C 51 52.791 38.681 72.712 1.00 15.00 C H +ATOM 2746 C ARG C 51 56.513 38.284 66.033 1.00 15.00 C C +ATOM 2747 O ARG C 51 57.385 38.882 66.654 1.00 15.00 C O +ATOM 2748 N GLN C 52 56.768 37.552 64.946 1.00 15.00 C N +ATOM 2749 HN GLN C 52 56.030 37.090 64.497 1.00 15.00 C H +ATOM 2750 CA GLN C 52 58.120 37.421 64.413 1.00 15.00 C C +ATOM 2751 CB GLN C 52 58.184 36.325 63.344 1.00 15.00 C C +ATOM 2752 CG GLN C 52 59.578 36.059 62.787 1.00 15.00 C C +ATOM 2753 CD GLN C 52 60.567 35.599 63.844 1.00 15.00 C C +ATOM 2754 OE1 GLN C 52 60.678 34.408 64.130 1.00 15.00 C O +ATOM 2755 NE2 GLN C 52 61.302 36.545 64.419 1.00 15.00 C N +ATOM 2756 HE21 GLN C 52 61.167 37.473 64.134 1.00 15.00 C H +ATOM 2757 HE22 GLN C 52 61.948 36.275 65.103 1.00 15.00 C H +ATOM 2758 C GLN C 52 58.604 38.757 63.854 1.00 15.00 C C +ATOM 2759 O GLN C 52 59.768 39.120 64.013 1.00 15.00 C O +ATOM 2760 N SER C 53 57.697 39.484 63.200 1.00 15.00 C N +ATOM 2761 HN SER C 53 56.792 39.126 63.085 1.00 15.00 C H +ATOM 2762 CA SER C 53 58.020 40.793 62.645 1.00 15.00 C C +ATOM 2763 CB SER C 53 56.867 41.315 61.785 1.00 15.00 C C +ATOM 2764 OG SER C 53 56.873 40.714 60.506 1.00 15.00 C O +ATOM 2765 HG SER C 53 57.624 41.043 60.003 1.00 15.00 C H +ATOM 2766 C SER C 53 58.311 41.781 63.767 1.00 15.00 C C +ATOM 2767 O SER C 53 59.213 42.609 63.659 1.00 15.00 C O +ATOM 2768 N LEU C 54 57.537 41.675 64.847 1.00 15.00 C N +ATOM 2769 HN LEU C 54 56.833 40.994 64.861 1.00 15.00 C H +ATOM 2770 CA LEU C 54 57.705 42.541 66.009 1.00 15.00 C C +ATOM 2771 CB LEU C 54 56.495 42.432 66.939 1.00 15.00 C C +ATOM 2772 CG LEU C 54 55.228 43.159 66.483 1.00 15.00 C C +ATOM 2773 CD1 LEU C 54 54.034 42.732 67.320 1.00 15.00 C C +ATOM 2774 CD2 LEU C 54 55.423 44.666 66.556 1.00 15.00 C C +ATOM 2775 C LEU C 54 58.985 42.197 66.763 1.00 15.00 C C +ATOM 2776 O LEU C 54 59.639 43.077 67.321 1.00 15.00 C O +ATOM 2777 N ASP C 55 59.336 40.909 66.773 1.00 15.00 C N +ATOM 2778 HN ASP C 55 58.760 40.256 66.321 1.00 15.00 C H +ATOM 2779 CA ASP C 55 60.548 40.443 67.440 1.00 15.00 C C +ATOM 2780 CB ASP C 55 60.562 38.916 67.558 1.00 15.00 C C +ATOM 2781 CG ASP C 55 59.858 38.411 68.804 1.00 15.00 C C +ATOM 2782 OD1 ASP C 55 59.314 37.286 68.764 1.00 15.00 C O +ATOM 2783 OD2 ASP C 55 59.854 39.136 69.821 1.00 15.00 C O +ATOM 2784 C ASP C 55 61.785 40.917 66.689 1.00 15.00 C C +ATOM 2785 O ASP C 55 62.823 41.184 67.292 1.00 15.00 C O +ATOM 2786 N ASN C 56 61.661 41.018 65.365 1.00 15.00 C N +ATOM 2787 HN ASN C 56 60.809 40.772 64.946 1.00 15.00 C H +ATOM 2788 CA ASN C 56 62.758 41.483 64.524 1.00 15.00 C C +ATOM 2789 CB ASN C 56 62.493 41.165 63.052 1.00 15.00 C C +ATOM 2790 CG ASN C 56 62.622 39.687 62.737 1.00 15.00 C C +ATOM 2791 OD1 ASN C 56 63.266 38.936 63.469 1.00 15.00 C O +ATOM 2792 ND2 ASN C 56 62.021 39.265 61.633 1.00 15.00 C N +ATOM 2793 HD21 ASN C 56 61.533 39.920 61.091 1.00 15.00 C H +ATOM 2794 HD22 ASN C 56 62.093 38.315 61.400 1.00 15.00 C H +ATOM 2795 C ASN C 56 62.962 42.980 64.712 1.00 15.00 C C +ATOM 2796 O ASN C 56 64.090 43.471 64.683 1.00 15.00 C O +ATOM 2797 N VAL C 57 61.854 43.697 64.905 1.00 15.00 C N +ATOM 2798 HN VAL C 57 60.985 43.243 64.890 1.00 15.00 C H +ATOM 2799 CA VAL C 57 61.896 45.136 65.138 1.00 15.00 C C +ATOM 2800 CB VAL C 57 60.471 45.744 65.137 1.00 15.00 C C +ATOM 2801 CG1 VAL C 57 60.478 47.165 65.682 1.00 15.00 C C +ATOM 2802 CG2 VAL C 57 59.878 45.722 63.739 1.00 15.00 C C +ATOM 2803 C VAL C 57 62.549 45.397 66.489 1.00 15.00 C C +ATOM 2804 O VAL C 57 63.376 46.295 66.632 1.00 15.00 C O +ATOM 2805 N LYS C 58 62.175 44.573 67.467 1.00 15.00 C N +ATOM 2806 HN LYS C 58 61.516 43.875 67.267 1.00 15.00 C H +ATOM 2807 CA LYS C 58 62.704 44.666 68.819 1.00 15.00 C C +ATOM 2808 CB LYS C 58 61.984 43.656 69.721 1.00 15.00 C C +ATOM 2809 CG LYS C 58 62.688 43.354 71.034 1.00 15.00 C C +ATOM 2810 CD LYS C 58 61.952 42.281 71.817 1.00 15.00 C C +ATOM 2811 CE LYS C 58 62.797 41.763 72.969 1.00 15.00 C C +ATOM 2812 NZ LYS C 58 62.019 40.867 73.868 1.00 15.00 C N +ATOM 2813 HZ1 LYS C 58 62.587 40.035 74.123 1.00 15.00 C H +ATOM 2814 HZ2 LYS C 58 61.150 40.549 73.393 1.00 15.00 C H +ATOM 2815 HZ3 LYS C 58 61.757 41.375 74.738 1.00 15.00 C H +ATOM 2816 C LYS C 58 64.210 44.415 68.837 1.00 15.00 C C +ATOM 2817 O LYS C 58 64.947 45.092 69.546 1.00 15.00 C O +ATOM 2818 N ALA C 59 64.656 43.444 68.040 1.00 15.00 C N +ATOM 2819 HN ALA C 59 64.012 42.944 67.496 1.00 15.00 C H +ATOM 2820 CA ALA C 59 66.073 43.096 67.958 1.00 15.00 C C +ATOM 2821 CB ALA C 59 66.266 41.875 67.074 1.00 15.00 C C +ATOM 2822 C ALA C 59 66.916 44.265 67.451 1.00 15.00 C C +ATOM 2823 O ALA C 59 68.023 44.494 67.935 1.00 15.00 C O +ATOM 2824 N ILE C 60 66.383 44.999 66.476 1.00 15.00 C N +ATOM 2825 HN ILE C 60 65.498 44.760 66.131 1.00 15.00 C H +ATOM 2826 CA ILE C 60 67.081 46.149 65.902 1.00 15.00 C C +ATOM 2827 CB ILE C 60 66.452 46.566 64.555 1.00 15.00 C C +ATOM 2828 CG1 ILE C 60 66.548 45.417 63.552 1.00 15.00 C C +ATOM 2829 CG2 ILE C 60 67.119 47.816 64.000 1.00 15.00 C C +ATOM 2830 CD1 ILE C 60 65.712 45.620 62.311 1.00 15.00 C C +ATOM 2831 C ILE C 60 67.067 47.337 66.866 1.00 15.00 C C +ATOM 2832 O ILE C 60 68.066 48.043 67.012 1.00 15.00 C O +ATOM 2833 N VAL C 61 65.929 47.544 67.524 1.00 15.00 C N +ATOM 2834 HN VAL C 61 65.170 46.943 67.365 1.00 15.00 C H +ATOM 2835 CA VAL C 61 65.775 48.640 68.477 1.00 15.00 C C +ATOM 2836 CB VAL C 61 64.300 48.800 68.917 1.00 15.00 C C +ATOM 2837 CG1 VAL C 61 64.169 49.812 70.044 1.00 15.00 C C +ATOM 2838 CG2 VAL C 61 63.437 49.218 67.738 1.00 15.00 C C +ATOM 2839 C VAL C 61 66.672 48.436 69.701 1.00 15.00 C C +ATOM 2840 O VAL C 61 67.292 49.381 70.190 1.00 15.00 C O +ATOM 2841 N GLU C 62 66.753 47.192 70.175 1.00 15.00 C N +ATOM 2842 HN GLU C 62 66.244 46.480 69.733 1.00 15.00 C H +ATOM 2843 CA GLU C 62 67.577 46.860 71.334 1.00 15.00 C C +ATOM 2844 CB GLU C 62 67.185 45.504 71.921 1.00 15.00 C C +ATOM 2845 CG GLU C 62 65.815 45.487 72.577 1.00 15.00 C C +ATOM 2846 CD GLU C 62 65.549 44.204 73.339 1.00 15.00 C C +ATOM 2847 OE1 GLU C 62 64.772 44.247 74.316 1.00 15.00 C O +ATOM 2848 OE2 GLU C 62 66.116 43.157 72.961 1.00 15.00 C O +ATOM 2849 C GLU C 62 69.062 46.876 70.993 1.00 15.00 C C +ATOM 2850 O GLU C 62 69.904 47.073 71.868 1.00 15.00 C O +ATOM 2851 N ALA C 63 69.377 46.666 69.713 1.00 15.00 C N +ATOM 2852 HN ALA C 63 68.661 46.505 69.065 1.00 15.00 C H +ATOM 2853 CA ALA C 63 70.763 46.677 69.259 1.00 15.00 C C +ATOM 2854 CB ALA C 63 70.878 46.067 67.870 1.00 15.00 C C +ATOM 2855 C ALA C 63 71.303 48.102 69.261 1.00 15.00 C C +ATOM 2856 O ALA C 63 72.513 48.323 69.277 1.00 15.00 C O +ATOM 2857 N ALA C 64 70.382 49.063 69.247 1.00 15.00 C N +ATOM 2858 HN ALA C 64 69.435 48.813 69.222 1.00 15.00 C H +ATOM 2859 CA ALA C 64 70.737 50.474 69.268 1.00 15.00 C C +ATOM 2860 CB ALA C 64 69.737 51.278 68.452 1.00 15.00 C C +ATOM 2861 C ALA C 64 70.791 50.992 70.704 1.00 15.00 C C +ATOM 2862 O ALA C 64 71.102 52.157 70.940 1.00 15.00 C O +ATOM 2863 N GLY C 65 70.485 50.115 71.659 1.00 15.00 C N +ATOM 2864 HN GLY C 65 70.248 49.197 71.409 1.00 15.00 C H +ATOM 2865 CA GLY C 65 70.510 50.498 73.060 1.00 15.00 C C +ATOM 2866 C GLY C 65 69.170 51.002 73.568 1.00 15.00 C C +ATOM 2867 O GLY C 65 69.101 51.635 74.621 1.00 15.00 C O +ATOM 2868 N LEU C 66 68.104 50.725 72.821 1.00 15.00 C N +ATOM 2869 HN LEU C 66 68.221 50.218 71.989 1.00 15.00 C H +ATOM 2870 CA LEU C 66 66.763 51.156 73.209 1.00 15.00 C C +ATOM 2871 CB LEU C 66 66.123 52.008 72.108 1.00 15.00 C C +ATOM 2872 CG LEU C 66 66.740 53.387 71.867 1.00 15.00 C C +ATOM 2873 CD1 LEU C 66 65.964 54.134 70.795 1.00 15.00 C C +ATOM 2874 CD2 LEU C 66 66.778 54.192 73.157 1.00 15.00 C C +ATOM 2875 C LEU C 66 65.867 49.965 73.539 1.00 15.00 C C +ATOM 2876 O LEU C 66 66.261 48.813 73.367 1.00 15.00 C O +ATOM 2877 N LYS C 67 64.661 50.255 74.019 1.00 15.00 C N +ATOM 2878 HN LYS C 67 64.408 51.196 74.138 1.00 15.00 C H +ATOM 2879 CA LYS C 67 63.702 49.213 74.376 1.00 15.00 C C +ATOM 2880 CB LYS C 67 63.268 49.373 75.838 1.00 15.00 C C +ATOM 2881 CG LYS C 67 64.405 49.465 76.841 1.00 15.00 C C +ATOM 2882 CD LYS C 67 63.868 49.703 78.244 1.00 15.00 C C +ATOM 2883 CE LYS C 67 64.986 49.744 79.273 1.00 15.00 C C +ATOM 2884 NZ LYS C 67 64.455 49.899 80.657 1.00 15.00 C N +ATOM 2885 HZ1 LYS C 67 63.955 50.807 80.748 1.00 15.00 C H +ATOM 2886 HZ2 LYS C 67 65.235 49.876 81.344 1.00 15.00 C H +ATOM 2887 HZ3 LYS C 67 63.794 49.127 80.874 1.00 15.00 C H +ATOM 2888 C LYS C 67 62.464 49.290 73.486 1.00 15.00 C C +ATOM 2889 O LYS C 67 62.335 50.196 72.663 1.00 15.00 C O +ATOM 2890 N VAL C 68 61.553 48.334 73.663 1.00 15.00 C N +ATOM 2891 HN VAL C 68 61.724 47.630 74.323 1.00 15.00 C H +ATOM 2892 CA VAL C 68 60.306 48.303 72.900 1.00 15.00 C C +ATOM 2893 CB VAL C 68 59.566 46.959 73.098 1.00 15.00 C C +ATOM 2894 CG1 VAL C 68 58.173 46.986 72.483 1.00 15.00 C C +ATOM 2895 CG2 VAL C 68 60.378 45.822 72.502 1.00 15.00 C C +ATOM 2896 C VAL C 68 59.410 49.471 73.321 1.00 15.00 C C +ATOM 2897 O VAL C 68 58.589 49.961 72.542 1.00 15.00 C O +ATOM 2898 N GLY C 69 59.601 49.928 74.560 1.00 15.00 C N +ATOM 2899 HN GLY C 69 60.277 49.500 75.126 1.00 15.00 C H +ATOM 2900 CA GLY C 69 58.829 51.041 75.081 1.00 15.00 C C +ATOM 2901 C GLY C 69 59.263 52.372 74.506 1.00 15.00 C C +ATOM 2902 O GLY C 69 58.587 53.384 74.688 1.00 15.00 C O +ATOM 2903 N ASP C 70 60.393 52.368 73.806 1.00 15.00 C N +ATOM 2904 HN ASP C 70 60.885 51.527 73.699 1.00 15.00 C H +ATOM 2905 CA ASP C 70 60.919 53.579 73.196 1.00 15.00 C C +ATOM 2906 CB ASP C 70 62.448 53.564 73.185 1.00 15.00 C C +ATOM 2907 CG ASP C 70 63.028 53.656 74.583 1.00 15.00 C C +ATOM 2908 OD1 ASP C 70 63.997 52.926 74.875 1.00 15.00 C O +ATOM 2909 OD2 ASP C 70 62.509 54.456 75.390 1.00 15.00 C O +ATOM 2910 C ASP C 70 60.356 53.790 71.792 1.00 15.00 C C +ATOM 2911 O ASP C 70 60.536 54.853 71.199 1.00 15.00 C O +ATOM 2912 N ILE C 71 59.676 52.768 71.266 1.00 15.00 C N +ATOM 2913 HN ILE C 71 59.588 51.939 71.781 1.00 15.00 C H +ATOM 2914 CA ILE C 71 59.062 52.854 69.942 1.00 15.00 C C +ATOM 2915 CB ILE C 71 58.588 51.471 69.445 1.00 15.00 C C +ATOM 2916 CG1 ILE C 71 59.764 50.486 69.410 1.00 15.00 C C +ATOM 2917 CG2 ILE C 71 57.953 51.586 68.068 1.00 15.00 C C +ATOM 2918 CD1 ILE C 71 59.369 49.063 69.080 1.00 15.00 C C +ATOM 2919 C ILE C 71 57.880 53.824 69.994 1.00 15.00 C C +ATOM 2920 O ILE C 71 56.962 53.649 70.794 1.00 15.00 C O +ATOM 2921 N VAL C 72 57.913 54.848 69.142 1.00 15.00 C N +ATOM 2922 HN VAL C 72 58.660 54.922 68.514 1.00 15.00 C H +ATOM 2923 CA VAL C 72 56.866 55.871 69.128 1.00 15.00 C C +ATOM 2924 CB VAL C 72 57.455 57.278 69.351 1.00 15.00 C C +ATOM 2925 CG1 VAL C 72 58.013 57.407 70.758 1.00 15.00 C C +ATOM 2926 CG2 VAL C 72 58.530 57.580 68.316 1.00 15.00 C C +ATOM 2927 C VAL C 72 56.005 55.890 67.860 1.00 15.00 C C +ATOM 2928 O VAL C 72 54.952 56.523 67.850 1.00 15.00 C O +ATOM 2929 N LYS C 73 56.437 55.217 66.796 1.00 15.00 C N +ATOM 2930 HN LYS C 73 57.280 54.720 66.848 1.00 15.00 C H +ATOM 2931 CA LYS C 73 55.664 55.205 65.547 1.00 15.00 C C +ATOM 2932 CB LYS C 73 55.932 56.475 64.724 1.00 15.00 C C +ATOM 2933 CG LYS C 73 55.281 56.496 63.342 1.00 15.00 C C +ATOM 2934 CD LYS C 73 53.762 56.422 63.433 1.00 15.00 C C +ATOM 2935 CE LYS C 73 53.101 56.691 62.086 1.00 15.00 C C +ATOM 2936 NZ LYS C 73 53.472 55.681 61.056 1.00 15.00 C N +ATOM 2937 HZ1 LYS C 73 53.193 54.728 61.368 1.00 15.00 C H +ATOM 2938 HZ2 LYS C 73 54.499 55.693 60.895 1.00 15.00 C H +ATOM 2939 HZ3 LYS C 73 52.990 55.895 60.158 1.00 15.00 C H +ATOM 2940 C LYS C 73 55.946 53.961 64.712 1.00 15.00 C C +ATOM 2941 O LYS C 73 57.095 53.611 64.475 1.00 15.00 C O +ATOM 2942 N THR C 74 54.881 53.297 64.264 1.00 15.00 C N +ATOM 2943 HN THR C 74 53.984 53.622 64.493 1.00 15.00 C H +ATOM 2944 CA THR C 74 55.009 52.092 63.450 1.00 15.00 C C +ATOM 2945 CB THR C 74 54.740 50.816 64.280 1.00 15.00 C C +ATOM 2946 OG1 THR C 74 53.371 50.799 64.695 1.00 15.00 C O +ATOM 2947 HG1 THR C 74 52.869 51.425 64.168 1.00 15.00 C H +ATOM 2948 CG2 THR C 74 55.635 50.755 65.508 1.00 15.00 C C +ATOM 2949 C THR C 74 54.026 52.105 62.279 1.00 15.00 C C +ATOM 2950 O THR C 74 52.959 52.713 62.357 1.00 15.00 C O +ATOM 2951 N THR C 75 54.400 51.436 61.194 1.00 15.00 C N +ATOM 2952 HN THR C 75 55.278 51.006 61.182 1.00 15.00 C H +ATOM 2953 CA THR C 75 53.543 51.327 60.016 1.00 15.00 C C +ATOM 2954 CB THR C 75 54.113 52.089 58.804 1.00 15.00 C C +ATOM 2955 OG1 THR C 75 54.230 53.478 59.133 1.00 15.00 C O +ATOM 2956 HG1 THR C 75 53.575 53.979 58.640 1.00 15.00 C H +ATOM 2957 CG2 THR C 75 53.193 51.951 57.603 1.00 15.00 C C +ATOM 2958 C THR C 75 53.347 49.850 59.675 1.00 15.00 C C +ATOM 2959 O THR C 75 54.275 49.177 59.221 1.00 15.00 C O +ATOM 2960 N VAL C 76 52.133 49.357 59.901 1.00 15.00 C N +ATOM 2961 HN VAL C 76 51.427 49.957 60.224 1.00 15.00 C H +ATOM 2962 CA VAL C 76 51.820 47.952 59.674 1.00 15.00 C C +ATOM 2963 CB VAL C 76 50.903 47.399 60.787 1.00 15.00 C C +ATOM 2964 CG1 VAL C 76 50.710 45.900 60.635 1.00 15.00 C C +ATOM 2965 CG2 VAL C 76 51.466 47.731 62.162 1.00 15.00 C C +ATOM 2966 C VAL C 76 51.184 47.678 58.313 1.00 15.00 C C +ATOM 2967 O VAL C 76 50.028 48.027 58.066 1.00 15.00 C O +ATOM 2968 N PHE C 77 51.957 47.043 57.437 1.00 15.00 C N +ATOM 2969 HN PHE C 77 52.880 46.829 57.688 1.00 15.00 C H +ATOM 2970 CA PHE C 77 51.482 46.665 56.113 1.00 15.00 C C +ATOM 2971 CB PHE C 77 52.615 46.775 55.088 1.00 15.00 C C +ATOM 2972 CG PHE C 77 53.267 48.123 55.001 1.00 15.00 C C +ATOM 2973 CD1 PHE C 77 54.511 48.341 55.572 1.00 15.00 C C +ATOM 2974 CD2 PHE C 77 52.650 49.165 54.330 1.00 15.00 C C +ATOM 2975 CE1 PHE C 77 55.127 49.574 55.477 1.00 15.00 C C +ATOM 2976 CE2 PHE C 77 53.259 50.402 54.233 1.00 15.00 C C +ATOM 2977 CZ PHE C 77 54.500 50.606 54.806 1.00 15.00 C C +ATOM 2978 C PHE C 77 51.011 45.216 56.158 1.00 15.00 C C +ATOM 2979 O PHE C 77 51.797 44.315 56.443 1.00 15.00 C O +ATOM 2980 N VAL C 78 49.734 44.987 55.891 1.00 15.00 C N +ATOM 2981 HN VAL C 78 49.144 45.739 55.667 1.00 15.00 C H +ATOM 2982 CA VAL C 78 49.193 43.632 55.919 1.00 15.00 C C +ATOM 2983 CB VAL C 78 48.071 43.470 56.968 1.00 15.00 C C +ATOM 2984 CG1 VAL C 78 48.622 43.661 58.374 1.00 15.00 C C +ATOM 2985 CG2 VAL C 78 46.927 44.439 56.700 1.00 15.00 C C +ATOM 2986 C VAL C 78 48.683 43.197 54.550 1.00 15.00 C C +ATOM 2987 O VAL C 78 48.357 44.027 53.706 1.00 15.00 C O +ATOM 2988 N LYS C 79 48.627 41.887 54.336 1.00 15.00 C N +ATOM 2989 HN LYS C 79 48.916 41.276 55.046 1.00 15.00 C H +ATOM 2990 CA LYS C 79 48.149 41.334 53.075 1.00 15.00 C C +ATOM 2991 CB LYS C 79 48.844 39.994 52.788 1.00 15.00 C C +ATOM 2992 CG LYS C 79 48.277 39.216 51.608 1.00 15.00 C C +ATOM 2993 CD LYS C 79 48.481 39.954 50.295 1.00 15.00 C C +ATOM 2994 CE LYS C 79 47.565 39.406 49.211 1.00 15.00 C C +ATOM 2995 NZ LYS C 79 46.132 39.697 49.493 1.00 15.00 C N +ATOM 2996 HZ1 LYS C 79 45.983 40.724 49.568 1.00 15.00 C H +ATOM 2997 HZ2 LYS C 79 45.847 39.251 50.389 1.00 15.00 C H +ATOM 2998 HZ3 LYS C 79 45.534 39.324 48.728 1.00 15.00 C H +ATOM 2999 C LYS C 79 46.631 41.163 53.112 1.00 15.00 C C +ATOM 3000 O LYS C 79 45.958 41.216 52.081 1.00 15.00 C O +ATOM 3001 N ASP C 80 46.098 40.971 54.315 1.00 15.00 C N +ATOM 3002 HN ASP C 80 46.687 40.947 55.098 1.00 15.00 C H +ATOM 3003 CA ASP C 80 44.664 40.802 54.503 1.00 15.00 C C +ATOM 3004 CB ASP C 80 44.294 39.313 54.502 1.00 15.00 C C +ATOM 3005 CG ASP C 80 42.825 39.061 54.205 1.00 15.00 C C +ATOM 3006 OD1 ASP C 80 42.452 37.882 54.033 1.00 15.00 C O +ATOM 3007 OD2 ASP C 80 42.048 40.038 54.141 1.00 15.00 C O +ATOM 3008 C ASP C 80 44.220 41.455 55.807 1.00 15.00 C C +ATOM 3009 O ASP C 80 44.673 41.076 56.888 1.00 15.00 C O +ATOM 3010 N LEU C 81 43.336 42.448 55.695 1.00 15.00 C N +ATOM 3011 HN LEU C 81 43.025 42.709 54.803 1.00 15.00 C H +ATOM 3012 CA LEU C 81 42.822 43.156 56.863 1.00 15.00 C C +ATOM 3013 CB LEU C 81 42.247 44.518 56.472 1.00 15.00 C C +ATOM 3014 CG LEU C 81 43.211 45.702 56.530 1.00 15.00 C C +ATOM 3015 CD1 LEU C 81 42.551 46.946 55.964 1.00 15.00 C C +ATOM 3016 CD2 LEU C 81 43.672 45.953 57.958 1.00 15.00 C C +ATOM 3017 C LEU C 81 41.776 42.335 57.608 1.00 15.00 C C +ATOM 3018 O LEU C 81 41.336 42.713 58.692 1.00 15.00 C O +ATOM 3019 N ASN C 82 41.373 41.211 57.014 1.00 15.00 C N +ATOM 3020 HN ASN C 82 41.746 40.973 56.139 1.00 15.00 C H +ATOM 3021 CA ASN C 82 40.396 40.327 57.638 1.00 15.00 C C +ATOM 3022 CB ASN C 82 39.811 39.350 56.613 1.00 15.00 C C +ATOM 3023 CG ASN C 82 38.692 39.957 55.788 1.00 15.00 C C +ATOM 3024 OD1 ASN C 82 37.954 40.824 56.258 1.00 15.00 C O +ATOM 3025 ND2 ASN C 82 38.559 39.501 54.548 1.00 15.00 C N +ATOM 3026 HD21 ASN C 82 39.182 38.810 54.240 1.00 15.00 C H +ATOM 3027 HD22 ASN C 82 37.841 39.872 53.992 1.00 15.00 C H +ATOM 3028 C ASN C 82 41.037 39.563 58.793 1.00 15.00 C C +ATOM 3029 O ASN C 82 40.349 39.010 59.649 1.00 15.00 C O +ATOM 3030 N ASP C 83 42.371 39.552 58.802 1.00 15.00 C N +ATOM 3031 HN ASP C 83 42.851 40.014 58.084 1.00 15.00 C H +ATOM 3032 CA ASP C 83 43.141 38.881 59.843 1.00 15.00 C C +ATOM 3033 CB ASP C 83 44.325 38.129 59.218 1.00 15.00 C C +ATOM 3034 CG ASP C 83 43.953 36.798 58.600 1.00 15.00 C C +ATOM 3035 OD1 ASP C 83 44.599 36.409 57.603 1.00 15.00 C O +ATOM 3036 OD2 ASP C 83 43.027 36.139 59.115 1.00 15.00 C O +ATOM 3037 C ASP C 83 43.701 39.900 60.830 1.00 15.00 C C +ATOM 3038 O ASP C 83 44.558 39.568 61.648 1.00 15.00 C O +ATOM 3039 N PHE C 84 43.207 41.137 60.766 1.00 15.00 C N +ATOM 3040 HN PHE C 84 42.490 41.337 60.127 1.00 15.00 C H +ATOM 3041 CA PHE C 84 43.708 42.195 61.637 1.00 15.00 C C +ATOM 3042 CB PHE C 84 43.400 43.592 61.102 1.00 15.00 C C +ATOM 3043 CG PHE C 84 44.494 44.578 61.401 1.00 15.00 C C +ATOM 3044 CD1 PHE C 84 44.300 45.597 62.319 1.00 15.00 C C +ATOM 3045 CD2 PHE C 84 45.723 44.475 60.771 1.00 15.00 C C +ATOM 3046 CE1 PHE C 84 45.312 46.495 62.601 1.00 15.00 C C +ATOM 3047 CE2 PHE C 84 46.738 45.371 61.047 1.00 15.00 C C +ATOM 3048 CZ PHE C 84 46.532 46.382 61.965 1.00 15.00 C C +ATOM 3049 C PHE C 84 43.294 42.049 63.096 1.00 15.00 C C +ATOM 3050 O PHE C 84 43.967 42.571 63.978 1.00 15.00 C O +ATOM 3051 N ALA C 85 42.188 41.355 63.356 1.00 15.00 C N +ATOM 3052 HN ALA C 85 41.661 40.988 62.615 1.00 15.00 C H +ATOM 3053 CA ALA C 85 41.744 41.141 64.730 1.00 15.00 C C +ATOM 3054 CB ALA C 85 40.382 40.465 64.756 1.00 15.00 C C +ATOM 3055 C ALA C 85 42.778 40.296 65.471 1.00 15.00 C C +ATOM 3056 O ALA C 85 43.055 40.517 66.651 1.00 15.00 C O +ATOM 3057 N THR C 86 43.356 39.341 64.745 1.00 15.00 C N +ATOM 3058 HN THR C 86 43.078 39.224 63.813 1.00 15.00 C H +ATOM 3059 CA THR C 86 44.380 38.458 65.287 1.00 15.00 C C +ATOM 3060 CB THR C 86 44.578 37.231 64.374 1.00 15.00 C C +ATOM 3061 OG1 THR C 86 43.316 36.594 64.145 1.00 15.00 C O +ATOM 3062 HG1 THR C 86 43.462 35.687 63.867 1.00 15.00 C H +ATOM 3063 CG2 THR C 86 45.529 36.230 65.008 1.00 15.00 C C +ATOM 3064 C THR C 86 45.707 39.206 65.415 1.00 15.00 C C +ATOM 3065 O THR C 86 46.431 39.044 66.399 1.00 15.00 C O +ATOM 3066 N VAL C 87 46.013 40.031 64.411 1.00 15.00 C N +ATOM 3067 HN VAL C 87 45.395 40.109 63.655 1.00 15.00 C H +ATOM 3068 CA VAL C 87 47.243 40.820 64.404 1.00 15.00 C C +ATOM 3069 CB VAL C 87 47.443 41.540 63.050 1.00 15.00 C C +ATOM 3070 CG1 VAL C 87 48.614 42.512 63.109 1.00 15.00 C C +ATOM 3071 CG2 VAL C 87 47.655 40.526 61.935 1.00 15.00 C C +ATOM 3072 C VAL C 87 47.233 41.846 65.536 1.00 15.00 C C +ATOM 3073 O VAL C 87 48.248 42.067 66.190 1.00 15.00 C O +ATOM 3074 N ASN C 88 46.070 42.459 65.763 1.00 15.00 C N +ATOM 3075 HN ASN C 88 45.298 42.234 65.202 1.00 15.00 C H +ATOM 3076 CA ASN C 88 45.908 43.457 66.818 1.00 15.00 C C +ATOM 3077 CB ASN C 88 44.521 44.103 66.746 1.00 15.00 C C +ATOM 3078 CG ASN C 88 44.552 45.497 66.156 1.00 15.00 C C +ATOM 3079 OD1 ASN C 88 45.568 46.184 66.214 1.00 15.00 C O +ATOM 3080 ND2 ASN C 88 43.429 45.926 65.590 1.00 15.00 C N +ATOM 3081 HD21 ASN C 88 42.654 45.326 65.585 1.00 15.00 C H +ATOM 3082 HD22 ASN C 88 43.421 46.826 65.201 1.00 15.00 C H +ATOM 3083 C ASN C 88 46.115 42.846 68.197 1.00 15.00 C C +ATOM 3084 O ASN C 88 46.705 43.473 69.075 1.00 15.00 C O +ATOM 3085 N ALA C 89 45.622 41.621 68.380 1.00 15.00 C N +ATOM 3086 HN ALA C 89 45.153 41.182 67.640 1.00 15.00 C H +ATOM 3087 CA ALA C 89 45.754 40.918 69.653 1.00 15.00 C C +ATOM 3088 CB ALA C 89 44.926 39.642 69.648 1.00 15.00 C C +ATOM 3089 C ALA C 89 47.216 40.611 69.963 1.00 15.00 C C +ATOM 3090 O ALA C 89 47.663 40.765 71.099 1.00 15.00 C O +ATOM 3091 N THR C 90 47.956 40.175 68.945 1.00 15.00 C N +ATOM 3092 HN THR C 90 47.535 40.062 68.066 1.00 15.00 C H +ATOM 3093 CA THR C 90 49.373 39.858 69.098 1.00 15.00 C C +ATOM 3094 CB THR C 90 49.904 39.085 67.871 1.00 15.00 C C +ATOM 3095 OG1 THR C 90 49.230 37.825 67.774 1.00 15.00 C O +ATOM 3096 HG1 THR C 90 49.080 37.475 68.655 1.00 15.00 C H +ATOM 3097 CG2 THR C 90 51.404 38.843 67.980 1.00 15.00 C C +ATOM 3098 C THR C 90 50.189 41.136 69.287 1.00 15.00 C C +ATOM 3099 O THR C 90 51.126 41.177 70.085 1.00 15.00 C O +ATOM 3100 N TYR C 91 49.811 42.176 68.547 1.00 15.00 C N +ATOM 3101 HN TYR C 91 49.053 42.066 67.935 1.00 15.00 C H +ATOM 3102 CA TYR C 91 50.478 43.471 68.611 1.00 15.00 C C +ATOM 3103 CB TYR C 91 49.864 44.403 67.559 1.00 15.00 C C +ATOM 3104 CG TYR C 91 50.560 45.734 67.393 1.00 15.00 C C +ATOM 3105 CD1 TYR C 91 51.441 45.951 66.343 1.00 15.00 C C +ATOM 3106 CD2 TYR C 91 50.329 46.777 68.281 1.00 15.00 C C +ATOM 3107 CE1 TYR C 91 52.064 47.173 66.176 1.00 15.00 C C +ATOM 3108 CE2 TYR C 91 50.946 47.999 68.123 1.00 15.00 C C +ATOM 3109 CZ TYR C 91 51.817 48.190 67.074 1.00 15.00 C C +ATOM 3110 OH TYR C 91 52.430 49.407 66.914 1.00 15.00 C O +ATOM 3111 HH TYR C 91 52.661 49.764 67.775 1.00 15.00 C H +ATOM 3112 C TYR C 91 50.330 44.086 70.000 1.00 15.00 C C +ATOM 3113 O TYR C 91 51.296 44.593 70.572 1.00 15.00 C O +ATOM 3114 N GLU C 92 49.111 44.032 70.533 1.00 15.00 C N +ATOM 3115 HN GLU C 92 48.387 43.612 70.022 1.00 15.00 C H +ATOM 3116 CA GLU C 92 48.818 44.577 71.852 1.00 15.00 C C +ATOM 3117 CB GLU C 92 47.309 44.567 72.110 1.00 15.00 C C +ATOM 3118 CG GLU C 92 46.907 45.065 73.488 1.00 15.00 C C +ATOM 3119 CD GLU C 92 45.464 45.528 73.544 1.00 15.00 C C +ATOM 3120 OE1 GLU C 92 45.141 46.343 74.433 1.00 15.00 C O +ATOM 3121 OE2 GLU C 92 44.660 45.081 72.699 1.00 15.00 C O +ATOM 3122 C GLU C 92 49.542 43.796 72.940 1.00 15.00 C C +ATOM 3123 O GLU C 92 50.112 44.384 73.857 1.00 15.00 C O +ATOM 3124 N ALA C 93 49.520 42.470 72.821 1.00 15.00 C N +ATOM 3125 HN ALA C 93 49.050 42.067 72.060 1.00 15.00 C H +ATOM 3126 CA ALA C 93 50.175 41.603 73.789 1.00 15.00 C C +ATOM 3127 CB ALA C 93 49.889 40.142 73.479 1.00 15.00 C C +ATOM 3128 C ALA C 93 51.677 41.857 73.821 1.00 15.00 C C +ATOM 3129 O ALA C 93 52.275 41.910 74.890 1.00 15.00 C O +ATOM 3130 N PHE C 94 52.269 42.033 72.641 1.00 15.00 C N +ATOM 3131 HN PHE C 94 51.723 41.992 71.828 1.00 15.00 C H +ATOM 3132 CA PHE C 94 53.702 42.283 72.515 1.00 15.00 C C +ATOM 3133 CB PHE C 94 54.085 42.432 71.038 1.00 15.00 C C +ATOM 3134 CG PHE C 94 55.562 42.574 70.792 1.00 15.00 C C +ATOM 3135 CD1 PHE C 94 56.384 41.458 70.761 1.00 15.00 C C +ATOM 3136 CD2 PHE C 94 56.128 43.823 70.590 1.00 15.00 C C +ATOM 3137 CE1 PHE C 94 57.741 41.585 70.533 1.00 15.00 C C +ATOM 3138 CE2 PHE C 94 57.484 43.956 70.362 1.00 15.00 C C +ATOM 3139 CZ PHE C 94 58.293 42.836 70.334 1.00 15.00 C C +ATOM 3140 C PHE C 94 54.138 43.519 73.302 1.00 15.00 C C +ATOM 3141 O PHE C 94 55.101 43.466 74.062 1.00 15.00 C O +ATOM 3142 N PHE C 95 53.418 44.626 73.125 1.00 15.00 C N +ATOM 3143 HN PHE C 95 52.649 44.606 72.517 1.00 15.00 C H +ATOM 3144 CA PHE C 95 53.750 45.870 73.818 1.00 15.00 C C +ATOM 3145 CB PHE C 95 53.105 47.079 73.136 1.00 15.00 C C +ATOM 3146 CG PHE C 95 53.817 47.495 71.879 1.00 15.00 C C +ATOM 3147 CD1 PHE C 95 53.444 46.976 70.650 1.00 15.00 C C +ATOM 3148 CD2 PHE C 95 54.871 48.391 71.929 1.00 15.00 C C +ATOM 3149 CE1 PHE C 95 54.104 47.348 69.496 1.00 15.00 C C +ATOM 3150 CE2 PHE C 95 55.534 48.769 70.778 1.00 15.00 C C +ATOM 3151 CZ PHE C 95 55.153 48.243 69.559 1.00 15.00 C C +ATOM 3152 C PHE C 95 53.419 45.822 75.311 1.00 15.00 C C +ATOM 3153 O PHE C 95 54.079 46.478 76.116 1.00 15.00 C O +ATOM 3154 N THR C 96 52.402 45.042 75.677 1.00 15.00 C N +ATOM 3155 HN THR C 96 51.901 44.555 74.990 1.00 15.00 C H +ATOM 3156 CA THR C 96 52.014 44.898 77.079 1.00 15.00 C C +ATOM 3157 CB THR C 96 50.633 44.216 77.216 1.00 15.00 C C +ATOM 3158 OG1 THR C 96 49.630 45.041 76.612 1.00 15.00 C O +ATOM 3159 HG1 THR C 96 49.193 45.563 77.289 1.00 15.00 C H +ATOM 3160 CG2 THR C 96 50.271 43.990 78.679 1.00 15.00 C C +ATOM 3161 C THR C 96 53.068 44.084 77.832 1.00 15.00 C C +ATOM 3162 O THR C 96 53.340 44.329 79.009 1.00 15.00 C O +ATOM 3163 N GLU C 97 53.670 43.127 77.122 1.00 15.00 C N +ATOM 3164 HN GLU C 97 53.405 42.997 76.188 1.00 15.00 C H +ATOM 3165 CA GLU C 97 54.708 42.266 77.686 1.00 15.00 C C +ATOM 3166 CB GLU C 97 55.085 41.175 76.678 1.00 15.00 C C +ATOM 3167 CG GLU C 97 54.059 40.063 76.527 1.00 15.00 C C +ATOM 3168 CD GLU C 97 54.125 39.392 75.168 1.00 15.00 C C +ATOM 3169 OE1 GLU C 97 55.154 39.546 74.474 1.00 15.00 C O +ATOM 3170 OE2 GLU C 97 53.145 38.715 74.794 1.00 15.00 C O +ATOM 3171 C GLU C 97 55.960 43.061 78.040 1.00 15.00 C C +ATOM 3172 O GLU C 97 56.723 42.675 78.924 1.00 15.00 C O +ATOM 3173 N HIS C 98 56.164 44.173 77.343 1.00 15.00 C N +ATOM 3174 HN HIS C 98 55.511 44.438 76.662 1.00 15.00 C H +ATOM 3175 CA HIS C 98 57.333 45.010 77.572 1.00 15.00 C C +ATOM 3176 CB HIS C 98 57.963 45.416 76.237 1.00 15.00 C C +ATOM 3177 CG HIS C 98 58.538 44.266 75.471 1.00 15.00 C C +ATOM 3178 ND1 HIS C 98 57.833 43.528 74.546 1.00 15.00 C N +ATOM 3179 HD1 HIS C 98 56.897 43.668 74.288 1.00 15.00 C H +ATOM 3180 CD2 HIS C 98 59.778 43.722 75.512 1.00 15.00 C C +ATOM 3181 CE1 HIS C 98 58.648 42.582 74.067 1.00 15.00 C C +ATOM 3182 NE2 HIS C 98 59.841 42.657 74.621 1.00 15.00 C N +ATOM 3183 C HIS C 98 57.003 46.249 78.398 1.00 15.00 C C +ATOM 3184 O HIS C 98 57.846 47.137 78.538 1.00 15.00 C O +ATOM 3185 N ASN C 99 55.780 46.294 78.952 1.00 15.00 C N +ATOM 3186 HN ASN C 99 55.167 45.542 78.813 1.00 15.00 C H +ATOM 3187 CA ASN C 99 55.331 47.434 79.763 1.00 15.00 C C +ATOM 3188 CB ASN C 99 56.069 47.444 81.108 1.00 15.00 C C +ATOM 3189 CG ASN C 99 55.491 48.427 82.107 1.00 15.00 C C +ATOM 3190 OD1 ASN C 99 54.281 48.650 82.155 1.00 15.00 C O +ATOM 3191 ND2 ASN C 99 56.363 49.030 82.909 1.00 15.00 C N +ATOM 3192 HD21 ASN C 99 57.312 48.807 82.810 1.00 15.00 C H +ATOM 3193 HD22 ASN C 99 56.023 49.674 83.564 1.00 15.00 C H +ATOM 3194 C ASN C 99 55.574 48.735 78.997 1.00 15.00 C C +ATOM 3195 O ASN C 99 56.085 49.717 79.538 1.00 15.00 C O +ATOM 3196 N ALA C 100 55.195 48.723 77.727 1.00 15.00 C N +ATOM 3197 HN ALA C 100 54.754 47.925 77.369 1.00 15.00 C H +ATOM 3198 CA ALA C 100 55.411 49.859 76.853 1.00 15.00 C C +ATOM 3199 CB ALA C 100 56.167 49.392 75.623 1.00 15.00 C C +ATOM 3200 C ALA C 100 54.118 50.527 76.420 1.00 15.00 C C +ATOM 3201 O ALA C 100 53.103 49.866 76.192 1.00 15.00 C O +ATOM 3202 N THR C 101 54.174 51.850 76.307 1.00 15.00 C N +ATOM 3203 HN THR C 101 55.005 52.313 76.535 1.00 15.00 C H +ATOM 3204 CA THR C 101 53.035 52.628 75.858 1.00 15.00 C C +ATOM 3205 CB THR C 101 53.253 54.133 76.132 1.00 15.00 C C +ATOM 3206 OG1 THR C 101 53.406 54.348 77.539 1.00 15.00 C O +ATOM 3207 HG1 THR C 101 54.339 54.356 77.762 1.00 15.00 C H +ATOM 3208 CG2 THR C 101 52.078 54.960 75.622 1.00 15.00 C C +ATOM 3209 C THR C 101 52.874 52.419 74.360 1.00 15.00 C C +ATOM 3210 O THR C 101 53.857 52.455 73.616 1.00 15.00 C O +ATOM 3211 N PHE C 102 51.646 52.170 73.926 1.00 15.00 C N +ATOM 3212 HN PHE C 102 50.910 52.131 74.570 1.00 15.00 C H +ATOM 3213 CA PHE C 102 51.367 51.952 72.514 1.00 15.00 C C +ATOM 3214 CB PHE C 102 49.872 51.728 72.298 1.00 15.00 C C +ATOM 3215 CG PHE C 102 49.319 50.582 73.095 1.00 15.00 C C +ATOM 3216 CD1 PHE C 102 48.181 50.742 73.868 1.00 15.00 C C +ATOM 3217 CD2 PHE C 102 49.942 49.344 73.075 1.00 15.00 C C +ATOM 3218 CE1 PHE C 102 47.673 49.689 74.605 1.00 15.00 C C +ATOM 3219 CE2 PHE C 102 49.440 48.287 73.808 1.00 15.00 C C +ATOM 3220 CZ PHE C 102 48.303 48.459 74.576 1.00 15.00 C C +ATOM 3221 C PHE C 102 51.859 53.125 71.677 1.00 15.00 C C +ATOM 3222 O PHE C 102 51.595 54.281 71.998 1.00 15.00 C O +ATOM 3223 N PRO C 103 52.608 52.844 70.606 1.00 15.00 C N +ATOM 3224 CA PRO C 103 53.147 53.870 69.725 1.00 15.00 C C +ATOM 3225 CB PRO C 103 54.333 53.162 69.042 1.00 15.00 C C +ATOM 3226 CG PRO C 103 54.318 51.741 69.514 1.00 15.00 C C +ATOM 3227 CD PRO C 103 52.988 51.502 70.163 1.00 15.00 C C +ATOM 3228 C PRO C 103 52.133 54.278 68.667 1.00 15.00 C C +ATOM 3229 O PRO C 103 51.136 53.585 68.459 1.00 15.00 C O +ATOM 3230 N ALA C 104 52.363 55.430 68.037 1.00 15.00 C N +ATOM 3231 HN ALA C 104 53.122 55.987 68.316 1.00 15.00 C H +ATOM 3232 CA ALA C 104 51.492 55.890 66.961 1.00 15.00 C C +ATOM 3233 CB ALA C 104 51.918 57.273 66.492 1.00 15.00 C C +ATOM 3234 C ALA C 104 51.595 54.886 65.817 1.00 15.00 C C +ATOM 3235 O ALA C 104 52.660 54.308 65.603 1.00 15.00 C O +ATOM 3236 N ARG C 105 50.513 54.644 65.092 1.00 15.00 C N +ATOM 3237 HN ARG C 105 49.671 55.115 65.276 1.00 15.00 C H +ATOM 3238 CA ARG C 105 50.586 53.658 64.032 1.00 15.00 C C +ATOM 3239 CB ARG C 105 50.456 52.247 64.639 1.00 15.00 C C +ATOM 3240 CG ARG C 105 49.451 51.347 63.956 1.00 15.00 C C +ATOM 3241 CD ARG C 105 48.317 50.991 64.897 1.00 15.00 C C +ATOM 3242 NE ARG C 105 48.581 49.799 65.711 1.00 15.00 C N +ATOM 3243 HE ARG C 105 49.407 49.785 66.243 1.00 15.00 C H +ATOM 3244 CZ ARG C 105 47.739 48.753 65.765 1.00 15.00 C C +ATOM 3245 NH1 ARG C 105 46.627 48.770 65.049 1.00 15.00 C N +ATOM 3246 HH11 ARG C 105 46.409 49.585 64.451 1.00 15.00 C H +ATOM 3247 HH12 ARG C 105 45.977 47.965 65.073 1.00 15.00 C H +ATOM 3248 NH2 ARG C 105 47.959 47.739 66.590 1.00 15.00 C N +ATOM 3249 HH21 ARG C 105 47.297 46.930 66.619 1.00 15.00 C H +ATOM 3250 HH22 ARG C 105 48.784 47.754 67.224 1.00 15.00 C H +ATOM 3251 C ARG C 105 49.621 53.881 62.849 1.00 15.00 C C +ATOM 3252 O ARG C 105 48.513 54.413 62.993 1.00 15.00 C O +ATOM 3253 N SER C 106 50.096 53.477 61.668 1.00 15.00 C N +ATOM 3254 HN SER C 106 51.008 53.124 61.627 1.00 15.00 C H +ATOM 3255 CA SER C 106 49.322 53.536 60.436 1.00 15.00 C C +ATOM 3256 CB SER C 106 50.049 54.354 59.366 1.00 15.00 C C +ATOM 3257 OG SER C 106 50.037 55.736 59.684 1.00 15.00 C O +ATOM 3258 HG SER C 106 50.779 55.950 60.255 1.00 15.00 C H +ATOM 3259 C SER C 106 49.115 52.102 59.969 1.00 15.00 C C +ATOM 3260 O SER C 106 50.040 51.291 60.041 1.00 15.00 C O +ATOM 3261 N CSP C 107 47.904 51.778 59.534 1.00 15.00 C N +ATOM 3262 HN CSP C 107 47.209 52.463 59.501 1.00 15.00 C H +ATOM 3263 CA CSP C 107 47.584 50.413 59.118 1.00 15.00 C C +ATOM 3264 CB CSP C 107 46.660 49.759 60.174 0.67 15.00 C C +ATOM 3265 SG CSP C 107 46.825 50.433 61.859 0.67 15.00 C S +ATOM 3266 P CSP C 107 44.988 51.446 62.012 0.67 15.00 C P +ATOM 3267 O1P CSP C 107 45.207 51.590 60.552 0.67 15.00 C O +ATOM 3268 O2P CSP C 107 43.586 50.963 62.021 0.67 15.00 C O +ATOM 3269 O3P CSP C 107 45.250 50.425 63.235 0.67 15.00 C O +ATOM 3270 C CSP C 107 46.912 50.378 57.743 1.00 15.00 C C +ATOM 3271 O CSP C 107 45.855 50.975 57.548 1.00 15.00 C O +ATOM 3272 N VAL C 108 47.527 49.674 56.791 1.00 15.00 C N +ATOM 3273 HN VAL C 108 48.367 49.223 57.003 1.00 15.00 C H +ATOM 3274 CA VAL C 108 46.968 49.560 55.435 1.00 15.00 C C +ATOM 3275 CB VAL C 108 47.580 50.581 54.439 1.00 15.00 C C +ATOM 3276 CG1 VAL C 108 47.333 52.012 54.871 1.00 15.00 C C +ATOM 3277 CG2 VAL C 108 49.066 50.320 54.219 1.00 15.00 C C +ATOM 3278 C VAL C 108 47.162 48.155 54.858 1.00 15.00 C C +ATOM 3279 O VAL C 108 48.108 47.455 55.218 1.00 15.00 C O +ATOM 3280 N GLU C 109 46.259 47.747 53.962 1.00 15.00 C N +ATOM 3281 HN GLU C 109 45.512 48.341 53.732 1.00 15.00 C H +ATOM 3282 CA GLU C 109 46.355 46.440 53.313 1.00 15.00 C C +ATOM 3283 CB GLU C 109 44.976 45.779 53.198 1.00 15.00 C C +ATOM 3284 CG GLU C 109 45.005 44.352 52.662 1.00 15.00 C C +ATOM 3285 CD GLU C 109 43.635 43.857 52.238 1.00 15.00 C C +ATOM 3286 OE1 GLU C 109 43.467 43.515 51.049 1.00 15.00 C O +ATOM 3287 OE2 GLU C 109 42.728 43.811 53.096 1.00 15.00 C O +ATOM 3288 C GLU C 109 46.962 46.623 51.928 1.00 15.00 C C +ATOM 3289 O GLU C 109 46.423 47.354 51.105 1.00 15.00 C O +ATOM 3290 N VAL C 110 48.090 45.974 51.680 1.00 15.00 C N +ATOM 3291 HN VAL C 110 48.475 45.399 52.375 1.00 15.00 C H +ATOM 3292 CA VAL C 110 48.769 46.093 50.395 1.00 15.00 C C +ATOM 3293 CB VAL C 110 50.297 46.194 50.572 1.00 15.00 C C +ATOM 3294 CG1 VAL C 110 50.653 47.467 51.328 1.00 15.00 C C +ATOM 3295 CG2 VAL C 110 50.827 44.969 51.302 1.00 15.00 C C +ATOM 3296 C VAL C 110 48.435 44.935 49.464 1.00 15.00 C C +ATOM 3297 O VAL C 110 47.776 43.969 49.862 1.00 15.00 C O +ATOM 3298 N ALA C 111 48.882 45.050 48.218 1.00 15.00 C N +ATOM 3299 HN ALA C 111 49.389 45.847 47.964 1.00 15.00 C H +ATOM 3300 CA ALA C 111 48.644 44.022 47.228 1.00 15.00 C C +ATOM 3301 CB ALA C 111 49.006 44.518 45.831 1.00 15.00 C C +ATOM 3302 C ALA C 111 49.450 42.788 47.566 1.00 15.00 C C +ATOM 3303 O ALA C 111 48.926 41.672 47.606 1.00 15.00 C O +ATOM 3304 N ARG C 112 50.736 42.989 47.789 1.00 15.00 C N +ATOM 3305 HN ARG C 112 51.112 43.892 47.704 1.00 15.00 C H +ATOM 3306 CA ARG C 112 51.604 41.892 48.118 1.00 15.00 C C +ATOM 3307 CB ARG C 112 52.014 41.182 46.832 1.00 15.00 C C +ATOM 3308 CG ARG C 112 52.379 39.738 47.063 1.00 15.00 C C +ATOM 3309 CD ARG C 112 53.678 39.401 46.384 1.00 15.00 C C +ATOM 3310 NE ARG C 112 53.505 39.191 44.960 1.00 15.00 C N +ATOM 3311 HE ARG C 112 52.788 39.701 44.495 1.00 15.00 C H +ATOM 3312 CZ ARG C 112 54.270 38.355 44.269 1.00 15.00 C C +ATOM 3313 NH1 ARG C 112 55.248 37.679 44.889 1.00 15.00 C N +ATOM 3314 HH11 ARG C 112 55.395 37.811 45.909 1.00 15.00 C H +ATOM 3315 HH12 ARG C 112 55.855 37.020 44.364 1.00 15.00 C H +ATOM 3316 NH2 ARG C 112 54.062 38.205 42.982 1.00 15.00 C N +ATOM 3317 HH21 ARG C 112 53.296 38.743 42.522 1.00 15.00 C H +ATOM 3318 HH22 ARG C 112 54.653 37.556 42.426 1.00 15.00 C H +ATOM 3319 C ARG C 112 52.838 42.372 48.891 1.00 15.00 C C +ATOM 3320 O ARG C 112 53.225 43.541 48.798 1.00 15.00 C O +ATOM 3321 N LEU C 113 53.463 41.462 49.644 1.00 15.00 C N +ATOM 3322 HN LEU C 113 53.118 40.547 49.674 1.00 15.00 C H +ATOM 3323 CA LEU C 113 54.651 41.784 50.428 1.00 15.00 C C +ATOM 3324 CB LEU C 113 54.337 41.627 51.919 1.00 15.00 C C +ATOM 3325 CG LEU C 113 53.379 42.663 52.511 1.00 15.00 C C +ATOM 3326 CD1 LEU C 113 52.817 42.196 53.843 1.00 15.00 C C +ATOM 3327 CD2 LEU C 113 54.074 44.002 52.665 1.00 15.00 C C +ATOM 3328 C LEU C 113 55.812 40.871 50.030 1.00 15.00 C C +ATOM 3329 O LEU C 113 55.588 39.812 49.444 1.00 15.00 C O +ATOM 3330 N PRO C 114 57.067 41.278 50.323 1.00 15.00 C N +ATOM 3331 CA PRO C 114 58.259 40.483 49.996 1.00 15.00 C C +ATOM 3332 CB PRO C 114 59.392 41.241 50.690 1.00 15.00 C C +ATOM 3333 CG PRO C 114 58.903 42.645 50.765 1.00 15.00 C C +ATOM 3334 CD PRO C 114 57.423 42.550 50.981 1.00 15.00 C C +ATOM 3335 C PRO C 114 58.167 39.060 50.538 1.00 15.00 C C +ATOM 3336 O PRO C 114 57.872 38.855 51.719 1.00 15.00 C O +ATOM 3337 N LYS C 115 58.406 38.088 49.651 1.00 15.00 C N +ATOM 3338 HN LYS C 115 58.628 38.340 48.730 1.00 15.00 C H +ATOM 3339 CA LYS C 115 58.353 36.664 49.996 1.00 15.00 C C +ATOM 3340 CB LYS C 115 59.257 36.329 51.188 1.00 15.00 C C +ATOM 3341 CG LYS C 115 60.738 36.564 50.937 1.00 15.00 C C +ATOM 3342 CD LYS C 115 61.565 36.185 52.152 1.00 15.00 C C +ATOM 3343 CE LYS C 115 63.048 36.174 51.829 1.00 15.00 C C +ATOM 3344 NZ LYS C 115 63.684 34.883 52.209 1.00 15.00 C N +ATOM 3345 HZ1 LYS C 115 63.242 34.100 51.686 1.00 15.00 C H +ATOM 3346 HZ2 LYS C 115 63.566 34.713 53.228 1.00 15.00 C H +ATOM 3347 HZ3 LYS C 115 64.700 34.905 51.988 1.00 15.00 C H +ATOM 3348 C LYS C 115 56.923 36.177 50.242 1.00 15.00 C C +ATOM 3349 O LYS C 115 56.719 35.110 50.822 1.00 15.00 C O +ATOM 3350 N ASP C 116 55.941 36.967 49.789 1.00 15.00 C N +ATOM 3351 HN ASP C 116 56.180 37.803 49.338 1.00 15.00 C H +ATOM 3352 CA ASP C 116 54.521 36.635 49.944 1.00 15.00 C C +ATOM 3353 CB ASP C 116 54.159 35.341 49.205 1.00 15.00 C C +ATOM 3354 CG ASP C 116 53.959 35.551 47.718 1.00 15.00 C C +ATOM 3355 OD1 ASP C 116 54.926 35.354 46.954 1.00 15.00 C O +ATOM 3356 OD2 ASP C 116 52.832 35.911 47.316 1.00 15.00 C O +ATOM 3357 C ASP C 116 54.092 36.557 51.407 1.00 15.00 C C +ATOM 3358 O ASP C 116 53.166 35.819 51.751 1.00 15.00 C O +ATOM 3359 N VAL C 117 54.754 37.331 52.266 1.00 15.00 C N +ATOM 3360 HN VAL C 117 55.476 37.906 51.937 1.00 15.00 C H +ATOM 3361 CA VAL C 117 54.423 37.337 53.688 1.00 15.00 C C +ATOM 3362 CB VAL C 117 55.533 37.960 54.560 1.00 15.00 C C +ATOM 3363 CG1 VAL C 117 56.821 37.159 54.438 1.00 15.00 C C +ATOM 3364 CG2 VAL C 117 55.769 39.417 54.193 1.00 15.00 C C +ATOM 3365 C VAL C 117 53.091 38.035 53.945 1.00 15.00 C C +ATOM 3366 O VAL C 117 52.565 38.734 53.078 1.00 15.00 C O +ATOM 3367 N LYS C 118 52.551 37.841 55.140 1.00 15.00 C N +ATOM 3368 HN LYS C 118 53.025 37.286 55.795 1.00 15.00 C H +ATOM 3369 CA LYS C 118 51.269 38.430 55.502 1.00 15.00 C C +ATOM 3370 CB LYS C 118 50.427 37.427 56.297 1.00 15.00 C C +ATOM 3371 CG LYS C 118 50.182 36.107 55.586 1.00 15.00 C C +ATOM 3372 CD LYS C 118 49.528 35.102 56.519 1.00 15.00 C C +ATOM 3373 CE LYS C 118 49.313 33.760 55.837 1.00 15.00 C C +ATOM 3374 NZ LYS C 118 48.711 32.765 56.764 1.00 15.00 C N +ATOM 3375 HZ1 LYS C 118 49.349 32.594 57.569 1.00 15.00 C H +ATOM 3376 HZ2 LYS C 118 48.549 31.865 56.269 1.00 15.00 C H +ATOM 3377 HZ3 LYS C 118 47.802 33.117 57.127 1.00 15.00 C H +ATOM 3378 C LYS C 118 51.407 39.731 56.292 1.00 15.00 C C +ATOM 3379 O LYS C 118 50.401 40.381 56.583 1.00 15.00 C O +ATOM 3380 N ILE C 119 52.636 40.123 56.639 1.00 15.00 C N +ATOM 3381 HN ILE C 119 53.413 39.585 56.380 1.00 15.00 C H +ATOM 3382 CA ILE C 119 52.827 41.354 57.406 1.00 15.00 C C +ATOM 3383 CB ILE C 119 52.383 41.177 58.881 1.00 15.00 C C +ATOM 3384 CG1 ILE C 119 52.301 42.528 59.600 1.00 15.00 C C +ATOM 3385 CG2 ILE C 119 53.306 40.218 59.622 1.00 15.00 C C +ATOM 3386 CD1 ILE C 119 51.683 42.453 60.977 1.00 15.00 C C +ATOM 3387 C ILE C 119 54.256 41.909 57.352 1.00 15.00 C C +ATOM 3388 O ILE C 119 55.234 41.165 57.289 1.00 15.00 C O +ATOM 3389 N GLU C 120 54.346 43.238 57.359 1.00 15.00 C N +ATOM 3390 HN GLU C 120 53.517 43.762 57.356 1.00 15.00 C H +ATOM 3391 CA GLU C 120 55.619 43.953 57.359 1.00 15.00 C C +ATOM 3392 CB GLU C 120 55.985 44.427 55.952 1.00 15.00 C C +ATOM 3393 CG GLU C 120 57.368 45.051 55.862 1.00 15.00 C C +ATOM 3394 CD GLU C 120 57.699 45.543 54.470 1.00 15.00 C C +ATOM 3395 OE1 GLU C 120 58.306 46.628 54.352 1.00 15.00 C O +ATOM 3396 OE2 GLU C 120 57.348 44.844 53.500 1.00 15.00 C O +ATOM 3397 C GLU C 120 55.495 45.149 58.297 1.00 15.00 C C +ATOM 3398 O GLU C 120 54.576 45.955 58.157 1.00 15.00 C O +ATOM 3399 N ILE C 121 56.409 45.268 59.254 1.00 15.00 C N +ATOM 3400 HN ILE C 121 57.141 44.619 59.310 1.00 15.00 C H +ATOM 3401 CA ILE C 121 56.333 46.358 60.222 1.00 15.00 C C +ATOM 3402 CB ILE C 121 55.950 45.834 61.627 1.00 15.00 C C +ATOM 3403 CG1 ILE C 121 54.690 44.964 61.560 1.00 15.00 C C +ATOM 3404 CG2 ILE C 121 55.748 46.989 62.599 1.00 15.00 C C +ATOM 3405 CD1 ILE C 121 54.411 44.187 62.827 1.00 15.00 C C +ATOM 3406 C ILE C 121 57.620 47.176 60.338 1.00 15.00 C C +ATOM 3407 O ILE C 121 58.683 46.646 60.660 1.00 15.00 C O +ATOM 3408 N GLU C 122 57.502 48.475 60.065 1.00 15.00 C N +ATOM 3409 HN GLU C 122 56.638 48.817 59.758 1.00 15.00 C H +ATOM 3410 CA GLU C 122 58.620 49.406 60.205 1.00 15.00 C C +ATOM 3411 CB GLU C 122 58.720 50.344 58.994 1.00 15.00 C C +ATOM 3412 CG GLU C 122 57.482 51.195 58.750 1.00 15.00 C C +ATOM 3413 CD GLU C 122 57.739 52.364 57.815 1.00 15.00 C C +ATOM 3414 OE1 GLU C 122 56.967 53.343 57.865 1.00 15.00 C O +ATOM 3415 OE2 GLU C 122 58.711 52.305 57.036 1.00 15.00 C O +ATOM 3416 C GLU C 122 58.388 50.206 61.485 1.00 15.00 C C +ATOM 3417 O GLU C 122 57.239 50.419 61.872 1.00 15.00 C O +ATOM 3418 N ALA C 123 59.450 50.649 62.151 1.00 15.00 C N +ATOM 3419 HN ALA C 123 60.351 50.485 61.803 1.00 15.00 C H +ATOM 3420 CA ALA C 123 59.272 51.383 63.401 1.00 15.00 C C +ATOM 3421 CB ALA C 123 59.278 50.425 64.583 1.00 15.00 C C +ATOM 3422 C ALA C 123 60.282 52.503 63.621 1.00 15.00 C C +ATOM 3423 O ALA C 123 61.398 52.479 63.100 1.00 15.00 C O +ATOM 3424 N ILE C 124 59.854 53.481 64.415 1.00 15.00 C N +ATOM 3425 HN ILE C 124 58.943 53.426 64.771 1.00 15.00 C H +ATOM 3426 CA ILE C 124 60.669 54.633 64.774 1.00 15.00 C C +ATOM 3427 CB ILE C 124 60.056 55.939 64.211 1.00 15.00 C C +ATOM 3428 CG1 ILE C 124 60.054 55.915 62.677 1.00 15.00 C C +ATOM 3429 CG2 ILE C 124 60.798 57.163 64.732 1.00 15.00 C C +ATOM 3430 CD1 ILE C 124 59.380 57.110 62.040 1.00 15.00 C C +ATOM 3431 C ILE C 124 60.743 54.729 66.299 1.00 15.00 C C +ATOM 3432 O ILE C 124 59.716 54.745 66.973 1.00 15.00 C O +ATOM 3433 N ALA C 125 61.957 54.777 66.838 1.00 15.00 C N +ATOM 3434 HN ALA C 125 62.742 54.764 66.251 1.00 15.00 C H +ATOM 3435 CA ALA C 125 62.152 54.856 68.284 1.00 15.00 C C +ATOM 3436 CB ALA C 125 62.795 53.576 68.797 1.00 15.00 C C +ATOM 3437 C ALA C 125 62.999 56.066 68.662 1.00 15.00 C C +ATOM 3438 O ALA C 125 63.778 56.559 67.854 1.00 15.00 C O +ATOM 3439 N VAL C 126 62.842 56.544 69.892 1.00 15.00 C N +ATOM 3440 HN VAL C 126 62.205 56.113 70.498 1.00 15.00 C H +ATOM 3441 CA VAL C 126 63.602 57.701 70.363 1.00 15.00 C C +ATOM 3442 CB VAL C 126 62.748 58.989 70.410 1.00 15.00 C C +ATOM 3443 CG1 VAL C 126 62.443 59.488 69.007 1.00 15.00 C C +ATOM 3444 CG2 VAL C 126 61.463 58.759 71.193 1.00 15.00 C C +ATOM 3445 C VAL C 126 64.215 57.451 71.738 1.00 15.00 C C +ATOM 3446 O VAL C 126 63.678 56.690 72.541 1.00 15.00 C O +ATOM 3447 N ARG C 127 65.350 58.096 71.998 1.00 15.00 C N +ATOM 3448 HN ARG C 127 65.736 58.679 71.311 1.00 15.00 C H +ATOM 3449 CA ARG C 127 66.039 57.953 73.277 1.00 15.00 C C +ATOM 3450 CB ARG C 127 67.532 58.254 73.123 1.00 15.00 C C +ATOM 3451 CG ARG C 127 68.212 57.460 72.016 1.00 15.00 C C +ATOM 3452 CD ARG C 127 69.727 57.522 72.138 1.00 15.00 C C +ATOM 3453 NE ARG C 127 70.399 56.783 71.067 1.00 15.00 C N +ATOM 3454 HE ARG C 127 70.629 57.278 70.252 1.00 15.00 C H +ATOM 3455 CZ ARG C 127 70.709 55.492 71.136 1.00 15.00 C C +ATOM 3456 NH1 ARG C 127 70.401 54.789 72.217 1.00 15.00 C N +ATOM 3457 HH11 ARG C 127 69.918 55.249 73.016 1.00 15.00 C H +ATOM 3458 HH12 ARG C 127 70.643 53.780 72.266 1.00 15.00 C H +ATOM 3459 NH2 ARG C 127 71.333 54.905 70.126 1.00 15.00 C N +ATOM 3460 HH21 ARG C 127 71.573 53.894 70.181 1.00 15.00 C H +ATOM 3461 HH22 ARG C 127 71.584 55.452 69.276 1.00 15.00 C H +ATOM 3462 C ARG C 127 65.407 58.853 74.339 1.00 15.00 C C +ATOM 3463 O ARG C 127 65.282 58.464 75.500 1.00 15.00 C O +ATOM 3464 N ARG C 128 65.012 60.058 73.932 1.00 15.00 C N +ATOM 3465 HN ARG C 128 65.157 60.316 72.997 1.00 15.00 C H +ATOM 3466 CA ARG C 128 64.374 61.008 74.841 1.00 15.00 C C +ATOM 3467 CB ARG C 128 65.060 62.376 74.775 1.00 15.00 C C +ATOM 3468 CG ARG C 128 66.352 62.464 75.574 1.00 15.00 C C +ATOM 3469 CD ARG C 128 67.134 63.721 75.223 1.00 15.00 C C +ATOM 3470 NE ARG C 128 66.824 64.847 76.105 1.00 15.00 C N +ATOM 3471 HE ARG C 128 66.302 64.661 76.915 1.00 15.00 C H +ATOM 3472 CZ ARG C 128 67.208 66.100 75.863 1.00 15.00 C C +ATOM 3473 NH1 ARG C 128 67.903 66.382 74.768 1.00 15.00 C N +ATOM 3474 HH11 ARG C 128 68.202 67.360 74.580 1.00 15.00 C H +ATOM 3475 HH12 ARG C 128 68.147 65.625 74.098 1.00 15.00 C H +ATOM 3476 NH2 ARG C 128 66.919 67.066 76.725 1.00 15.00 C N +ATOM 3477 HH21 ARG C 128 66.392 66.848 77.594 1.00 15.00 C H +ATOM 3478 HH22 ARG C 128 67.222 68.044 76.533 1.00 15.00 C H +ATOM 3479 C ARG C 128 62.891 61.153 74.518 1.00 15.00 C C +ATOM 3480 O ARG C 128 62.505 61.235 73.351 1.00 15.00 C O +END diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.psf b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.psf new file mode 100644 index 000000000..46b78afa2 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.psf @@ -0,0 +1,26846 @@ +data_cns_mtf + +_cns_mtf.title +; FILENAME="homotrimer_haddock.psf" + Patching histidine 98 to HISD + Patching histidine 98 to HISD + Patching histidine 98 to HISD + DATE:01-Oct-2024 16:32:31 created by user: unknown + VERSION:1.3U +; + +loop_ +_cns_mtf_atom.id +_cns_mtf_atom.segment_id +_cns_mtf_atom.residue_id +_cns_mtf_atom.residue_name +_cns_mtf_atom.atom_name +_cns_mtf_atom.chemical_type +_cns_mtf_atom.charge +_cns_mtf_atom.atom_mass +1 'A' '2' 'SER' 'N' 'NH1' -0.570000 14.0070 +2 'A' '2' 'SER' 'HN' 'H' 0.370000 1.00800 +3 'A' '2' 'SER' 'CA' 'CH1E' 0.200000 12.0110 +4 'A' '2' 'SER' 'CB' 'CH2E' 0.265000 12.0110 +5 'A' '2' 'SER' 'OG' 'OH1' -0.700000 15.9990 +6 'A' '2' 'SER' 'HG' 'H' 0.435000 1.00800 +7 'A' '2' 'SER' 'C' 'C' 0.500000 12.0110 +8 'A' '2' 'SER' 'O' 'O' -0.500000 15.9990 +9 'A' '3' 'LYS' 'N' 'NH1' -0.570000 14.0070 +10 'A' '3' 'LYS' 'HN' 'H' 0.370000 1.00800 +11 'A' '3' 'LYS' 'CA' 'CH1E' 0.200000 12.0110 +12 'A' '3' 'LYS' 'CB' 'CH2E' 0.00000 12.0110 +13 'A' '3' 'LYS' 'CG' 'CH2E' 0.00000 12.0110 +14 'A' '3' 'LYS' 'CD' 'CH2E' 0.00000 12.0110 +15 'A' '3' 'LYS' 'CE' 'CH2E' 0.310000 12.0110 +16 'A' '3' 'LYS' 'NZ' 'NH3' -0.300000 14.0070 +17 'A' '3' 'LYS' 'HZ1' 'HC' 0.330000 1.00800 +18 'A' '3' 'LYS' 'HZ2' 'HC' 0.330000 1.00800 +19 'A' '3' 'LYS' 'HZ3' 'HC' 0.330000 1.00800 +20 'A' '3' 'LYS' 'C' 'C' 0.500000 12.0110 +21 'A' '3' 'LYS' 'O' 'O' -0.500000 15.9990 +22 'A' '4' 'THR' 'N' 'NH1' -0.570000 14.0070 +23 'A' '4' 'THR' 'HN' 'H' 0.370000 1.00800 +24 'A' '4' 'THR' 'CA' 'CH1E' 0.200000 12.0110 +25 'A' '4' 'THR' 'CB' 'CH1E' 0.265000 12.0110 +26 'A' '4' 'THR' 'OG1' 'OH1' -0.700000 15.9990 +27 'A' '4' 'THR' 'HG1' 'H' 0.435000 1.00800 +28 'A' '4' 'THR' 'CG2' 'CH3E' -0.00000 12.0110 +29 'A' '4' 'THR' 'C' 'C' 0.500000 12.0110 +30 'A' '4' 'THR' 'O' 'O' -0.500000 15.9990 +31 'A' '5' 'ILE' 'N' 'NH1' -0.570000 14.0070 +32 'A' '5' 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'7' 'THR' 'O' 'O' -0.500000 15.9990 +55 'A' '8' 'GLU' 'N' 'NH1' -0.570000 14.0070 +56 'A' '8' 'GLU' 'HN' 'H' 0.370000 1.00800 +57 'A' '8' 'GLU' 'CA' 'CH1E' 0.200000 12.0110 +58 'A' '8' 'GLU' 'CB' 'CH2E' 0.00000 12.0110 +59 'A' '8' 'GLU' 'CG' 'CH2E' -0.100000 12.0110 +60 'A' '8' 'GLU' 'CD' 'C' 0.700000 12.0110 +61 'A' '8' 'GLU' 'OE1' 'OC' -0.800000 15.9990 +62 'A' '8' 'GLU' 'OE2' 'OC' -0.800000 15.9990 +63 'A' '8' 'GLU' 'C' 'C' 0.500000 12.0110 +64 'A' '8' 'GLU' 'O' 'O' -0.500000 15.9990 +65 'A' '9' 'ASN' 'N' 'NH1' -0.570000 14.0070 +66 'A' '9' 'ASN' 'HN' 'H' 0.370000 1.00800 +67 'A' '9' 'ASN' 'CA' 'CH1E' 0.200000 12.0110 +68 'A' '9' 'ASN' 'CB' 'CH2E' -0.00000 12.0110 +69 'A' '9' 'ASN' 'CG' 'C' 0.500000 12.0110 +70 'A' '9' 'ASN' 'OD1' 'O' -0.500000 15.9990 +71 'A' '9' 'ASN' 'ND2' 'NH2' -0.850000 14.0070 +72 'A' '9' 'ASN' 'HD21' 'H' 0.425000 1.00800 +73 'A' '9' 'ASN' 'HD22' 'H' 0.425000 1.00800 +74 'A' '9' 'ASN' 'C' 'C' 0.500000 12.0110 +75 'A' '9' 'ASN' 'O' 'O' -0.500000 15.9990 +76 'A' 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"homotrimer_haddock.psf", + "md5": null, + "path": "/Users/vreys/Desktop/HADDOCK3/haddock3-dev/examples/thirdparty/prodigy/run-prodigy-prot-prot/0_topoaa", + "py/object": "haddock.libs.libontology.TopologyFile", + "rel_path": { + "py/reduce": [ + { + "py/type": "pathlib.PosixPath" + }, + { + "py/tuple": [ + "..", + "0_topoaa", + "homotrimer_haddock.psf" + ] + } + ] + }, + "restr_fname": null + }, + "unw_energies": null + } + } + ] +} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/params.cfg b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/params.cfg new file mode 100644 index 000000000..637d447e6 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/params.cfg @@ -0,0 +1,34 @@ +[topoaa] +cns_exec = "" +ncores = 4 +max_cpus = true +mode = "local" +batch_type = "slurm" +queue = "" +clean = false +offline = false +autohis = true +delenph = true +log_level = "quiet" +iniseed = 917 +ligand_param_fname = "" +ligand_top_fname = "" +limit = true +set_bfactor = true +tolerance = 0 +cyclicpept_dist = 2.0 +disulphide_dist = 2.2 + +[topoaa.mol1] +cyclicpept = false +nhisd = 0 +hisd_1 = nan +nhise = 0 +hise_1 = nan + +[topoaa.mol2] +cyclicpept = false +nhisd = 0 +hisd_1 = nan +nhise = 0 +hise_1 = nan diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.pdb b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.pdb new file mode 100644 index 000000000..a17029739 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.pdb @@ -0,0 +1,2154 @@ +REMARK FILENAME="prot-prot_haddock.pdb" +REMARK Patching histidine 75 to HISD +REMARK Patching histidine 90 to HISD +REMARK Patching histidine 76 to HISD +REMARK Patching histidine 15 to HISE +REMARK DATE:01-Oct-2024 16:32:30 created by user: unknown +REMARK VERSION:1.3U +ATOM 1 N THR A 19 51.382 49.015 12.266 1.00 15.00 A N +ATOM 2 HN THR A 19 50.503 49.282 11.924 1.00 15.00 A H +ATOM 3 CA THR A 19 51.464 47.969 13.285 1.00 15.00 A C +ATOM 4 CB THR A 19 52.915 47.521 13.637 1.00 15.00 A C +ATOM 5 OG1 THR A 19 52.992 46.104 13.665 1.00 15.00 A O +ATOM 6 HG1 THR A 19 52.277 45.755 14.202 1.00 15.00 A H +ATOM 7 CG2 THR A 19 53.358 48.069 15.002 1.00 15.00 A C +ATOM 8 C THR A 19 50.687 48.310 14.540 1.00 15.00 A C +ATOM 9 O THR A 19 50.904 49.317 15.188 1.00 15.00 A O +ATOM 10 N ILE A 20 49.771 47.410 14.891 1.00 15.00 A N +ATOM 11 HN ILE A 20 49.621 46.623 14.326 1.00 15.00 A H +ATOM 12 CA ILE A 20 49.010 47.580 16.076 1.00 15.00 A C +ATOM 13 CB ILE A 20 47.541 47.355 15.789 1.00 15.00 A C +ATOM 14 CG1 ILE A 20 47.124 48.242 14.572 1.00 15.00 A C +ATOM 15 CG2 ILE A 20 46.684 47.697 17.013 1.00 15.00 A C +ATOM 16 CD1 ILE A 20 46.614 47.391 13.409 1.00 15.00 A C +ATOM 17 C ILE A 20 49.479 46.624 17.158 1.00 15.00 A C +ATOM 18 O ILE A 20 49.608 45.428 16.967 1.00 15.00 A O +ATOM 19 N GLU A 21 49.697 47.189 18.314 1.00 15.00 A N +ATOM 20 HN GLU A 21 49.599 48.161 18.388 1.00 15.00 A H +ATOM 21 CA GLU A 21 50.078 46.438 19.494 1.00 15.00 A C +ATOM 22 CB GLU A 21 51.156 47.156 20.303 1.00 15.00 A C +ATOM 23 CG GLU A 21 52.561 46.600 20.010 1.00 15.00 A C +ATOM 24 CD GLU A 21 53.641 47.575 20.497 1.00 15.00 A C +ATOM 25 OE1 GLU A 21 53.427 48.234 21.507 1.00 15.00 A O +ATOM 26 OE2 GLU A 21 54.669 47.650 19.836 1.00 15.00 A O +ATOM 27 C GLU A 21 48.864 46.222 20.401 1.00 15.00 A C +ATOM 28 O GLU A 21 48.211 47.155 20.833 1.00 15.00 A O +ATOM 29 N ILE A 22 48.608 44.981 20.708 1.00 15.00 A N +ATOM 30 HN ILE A 22 49.157 44.273 20.310 1.00 15.00 A H +ATOM 31 CA ILE A 22 47.531 44.605 21.626 1.00 15.00 A C +ATOM 32 CB ILE A 22 46.798 43.298 21.232 1.00 15.00 A C +ATOM 33 CG1 ILE A 22 46.411 43.262 19.744 1.00 15.00 A C +ATOM 34 CG2 ILE A 22 45.569 43.084 22.117 1.00 15.00 A C +ATOM 35 CD1 ILE A 22 45.253 44.213 19.451 1.00 15.00 A C +ATOM 36 C ILE A 22 48.175 44.467 22.989 1.00 15.00 A C +ATOM 37 O ILE A 22 49.129 43.730 23.172 1.00 15.00 A O +ATOM 38 N ILE A 23 47.674 45.200 23.936 1.00 15.00 A N +ATOM 39 HN ILE A 23 46.906 45.776 23.739 1.00 15.00 A H +ATOM 40 CA ILE A 23 48.214 45.187 25.257 1.00 15.00 A C +ATOM 41 CB ILE A 23 48.244 46.597 25.858 1.00 15.00 A C +ATOM 42 CG1 ILE A 23 48.863 47.564 24.839 1.00 15.00 A C +ATOM 43 CG2 ILE A 23 49.061 46.606 27.152 1.00 15.00 A C +ATOM 44 CD1 ILE A 23 50.332 47.223 24.576 1.00 15.00 A C +ATOM 45 C ILE A 23 47.524 44.180 26.133 1.00 15.00 A C +ATOM 46 O ILE A 23 46.365 43.887 25.994 1.00 15.00 A O +ATOM 47 N ALA A 24 48.283 43.611 27.034 1.00 15.00 A N +ATOM 48 HN ALA A 24 49.225 43.865 27.128 1.00 15.00 A H +ATOM 49 CA ALA A 24 47.709 42.611 27.878 1.00 15.00 A C +ATOM 50 CB ALA A 24 48.786 42.193 28.879 1.00 15.00 A C +ATOM 51 C ALA A 24 46.519 43.065 28.708 1.00 15.00 A C +ATOM 52 O ALA A 24 46.580 44.043 29.435 1.00 15.00 A O +ATOM 53 N PRO A 25 45.399 42.414 28.524 1.00 15.00 A N +ATOM 54 CA PRO A 25 44.171 42.792 29.225 1.00 15.00 A C +ATOM 55 CB PRO A 25 43.034 42.136 28.433 1.00 15.00 A C +ATOM 56 CG PRO A 25 43.668 41.077 27.566 1.00 15.00 A C +ATOM 57 CD PRO A 25 45.127 41.454 27.409 1.00 15.00 A C +ATOM 58 C PRO A 25 44.198 42.324 30.711 1.00 15.00 A C +ATOM 59 O PRO A 25 43.497 42.859 31.546 1.00 15.00 A O +ATOM 60 N LEU A 26 45.039 41.362 31.023 1.00 15.00 A N +ATOM 61 HN LEU A 26 45.550 40.943 30.299 1.00 15.00 A H +ATOM 62 CA LEU A 26 45.258 40.877 32.399 1.00 15.00 A C +ATOM 63 CB LEU A 26 44.284 39.798 33.045 1.00 15.00 A C +ATOM 64 CG LEU A 26 43.438 38.919 32.089 1.00 15.00 A C +ATOM 65 CD1 LEU A 26 44.229 38.417 30.898 1.00 15.00 A C +ATOM 66 CD2 LEU A 26 42.899 37.696 32.874 1.00 15.00 A C +ATOM 67 C LEU A 26 46.724 40.422 32.577 1.00 15.00 A C +ATOM 68 O LEU A 26 47.431 40.153 31.624 1.00 15.00 A O +ATOM 69 N SER A 27 47.172 40.328 33.834 1.00 15.00 A N +ATOM 70 HN SER A 27 46.582 40.577 34.576 1.00 15.00 A H +ATOM 71 CA SER A 27 48.525 39.860 34.118 1.00 15.00 A C +ATOM 72 CB SER A 27 49.037 40.332 35.469 1.00 15.00 A C +ATOM 73 OG SER A 27 49.037 41.751 35.525 1.00 15.00 A O +ATOM 74 HG SER A 27 49.281 42.037 36.408 1.00 15.00 A H +ATOM 75 C SER A 27 48.590 38.363 34.115 1.00 15.00 A C +ATOM 76 O SER A 27 47.653 37.682 34.484 1.00 15.00 A O +ATOM 77 N GLY A 28 49.717 37.836 33.717 1.00 15.00 A N +ATOM 78 HN GLY A 28 50.455 38.411 33.425 1.00 15.00 A H +ATOM 79 CA GLY A 28 49.856 36.412 33.714 1.00 15.00 A C +ATOM 80 C GLY A 28 50.928 35.974 32.741 1.00 15.00 A C +ATOM 81 O GLY A 28 51.862 36.691 32.426 1.00 15.00 A O +ATOM 82 N GLU A 29 50.783 34.763 32.308 1.00 15.00 A N +ATOM 83 HN GLU A 29 49.995 34.259 32.599 1.00 15.00 A H +ATOM 84 CA GLU A 29 51.720 34.110 31.417 1.00 15.00 A C +ATOM 85 CB GLU A 29 52.330 32.838 32.078 1.00 15.00 A C +ATOM 86 CG GLU A 29 53.877 32.953 32.241 1.00 15.00 A C +ATOM 87 CD GLU A 29 54.571 31.908 31.374 1.00 15.00 A C +ATOM 88 OE1 GLU A 29 54.250 30.741 31.546 1.00 15.00 A O +ATOM 89 OE2 GLU A 29 55.393 32.287 30.552 1.00 15.00 A O +ATOM 90 C GLU A 29 51.052 33.780 30.117 1.00 15.00 A C +ATOM 91 O GLU A 29 49.942 33.287 30.091 1.00 15.00 A O +ATOM 92 N ILE A 30 51.718 34.059 29.015 1.00 15.00 A N +ATOM 93 HN ILE A 30 52.614 34.452 29.050 1.00 15.00 A H +ATOM 94 CA ILE A 30 51.087 33.766 27.768 1.00 15.00 A C +ATOM 95 CB ILE A 30 51.692 34.547 26.609 1.00 15.00 A C +ATOM 96 CG1 ILE A 30 51.330 36.020 26.804 1.00 15.00 A C +ATOM 97 CG2 ILE A 30 51.132 34.032 25.275 1.00 15.00 A C +ATOM 98 CD1 ILE A 30 51.972 36.885 25.722 1.00 15.00 A C +ATOM 99 C ILE A 30 51.099 32.268 27.509 1.00 15.00 A C +ATOM 100 O ILE A 30 52.035 31.557 27.813 1.00 15.00 A O +ATOM 101 N VAL A 31 50.007 31.804 26.952 1.00 15.00 A N +ATOM 102 HN VAL A 31 49.290 32.432 26.726 1.00 15.00 A H +ATOM 103 CA VAL A 31 49.820 30.401 26.658 1.00 15.00 A C +ATOM 104 CB VAL A 31 48.846 29.829 27.687 1.00 15.00 A C +ATOM 105 CG1 VAL A 31 48.242 28.510 27.205 1.00 15.00 A C +ATOM 106 CG2 VAL A 31 49.548 29.614 29.025 1.00 15.00 A C +ATOM 107 C VAL A 31 49.295 30.264 25.218 1.00 15.00 A C +ATOM 108 O VAL A 31 48.700 31.177 24.679 1.00 15.00 A O +ATOM 109 N ASN A 32 49.517 29.120 24.605 1.00 15.00 A N +ATOM 110 HN ASN A 32 50.013 28.415 25.071 1.00 15.00 A H +ATOM 111 CA ASN A 32 49.037 28.878 23.238 1.00 15.00 A C +ATOM 112 CB ASN A 32 49.563 27.579 22.571 1.00 15.00 A C +ATOM 113 CG ASN A 32 51.071 27.562 22.387 1.00 15.00 A C +ATOM 114 OD1 ASN A 32 51.680 26.500 22.400 1.00 15.00 A O +ATOM 115 ND2 ASN A 32 51.695 28.684 22.193 1.00 15.00 A N +ATOM 116 HD21 ASN A 32 51.167 29.509 22.172 1.00 15.00 A H +ATOM 117 HD22 ASN A 32 52.668 28.658 22.076 1.00 15.00 A H +ATOM 118 C ASN A 32 47.549 28.716 23.211 1.00 15.00 A C +ATOM 119 O ASN A 32 46.967 28.050 24.047 1.00 15.00 A O +ATOM 120 N ILE A 33 46.921 29.294 22.238 1.00 15.00 A N +ATOM 121 HN ILE A 33 47.411 29.806 21.561 1.00 15.00 A H +ATOM 122 CA ILE A 33 45.491 29.170 22.170 1.00 15.00 A C +ATOM 123 CB ILE A 33 44.833 30.207 21.226 1.00 15.00 A C +ATOM 124 CG1 ILE A 33 43.340 30.333 21.601 1.00 15.00 A C +ATOM 125 CG2 ILE A 33 44.983 29.790 19.753 1.00 15.00 A C +ATOM 126 CD1 ILE A 33 42.789 31.682 21.188 1.00 15.00 A C +ATOM 127 C ILE A 33 45.147 27.742 21.863 1.00 15.00 A C +ATOM 128 O ILE A 33 44.070 27.266 22.185 1.00 15.00 A O +ATOM 129 N GLU A 34 46.048 27.032 21.271 1.00 15.00 A N +ATOM 130 HN GLU A 34 46.917 27.420 21.037 1.00 15.00 A H +ATOM 131 CA GLU A 34 45.754 25.673 20.965 1.00 15.00 A C +ATOM 132 CB GLU A 34 46.584 25.088 19.807 1.00 15.00 A C +ATOM 133 CG GLU A 34 48.023 25.596 19.810 1.00 15.00 A C +ATOM 134 CD GLU A 34 48.106 26.983 19.159 1.00 15.00 A C +ATOM 135 OE1 GLU A 34 47.335 27.241 18.249 1.00 15.00 A O +ATOM 136 OE2 GLU A 34 48.956 27.756 19.566 1.00 15.00 A O +ATOM 137 C GLU A 34 45.783 24.833 22.210 1.00 15.00 A C +ATOM 138 O GLU A 34 45.287 23.721 22.201 1.00 15.00 A O +ATOM 139 N ASP A 35 46.322 25.341 23.287 1.00 15.00 A N +ATOM 140 HN ASP A 35 46.691 26.249 23.271 1.00 15.00 A H +ATOM 141 CA ASP A 35 46.372 24.560 24.500 1.00 15.00 A C +ATOM 142 CB ASP A 35 47.701 24.694 25.230 1.00 15.00 A C +ATOM 143 CG ASP A 35 48.870 24.444 24.279 1.00 15.00 A C +ATOM 144 OD1 ASP A 35 48.631 23.898 23.215 1.00 15.00 A O +ATOM 145 OD2 ASP A 35 49.988 24.807 24.629 1.00 15.00 A O +ATOM 146 C ASP A 35 45.216 24.829 25.447 1.00 15.00 A C +ATOM 147 O ASP A 35 45.229 24.396 26.586 1.00 15.00 A O +ATOM 148 N VAL A 36 44.221 25.503 24.981 1.00 15.00 A N +ATOM 149 HN VAL A 36 44.253 25.820 24.054 1.00 15.00 A H +ATOM 150 CA VAL A 36 43.039 25.810 25.801 1.00 15.00 A C +ATOM 151 CB VAL A 36 42.350 27.104 25.340 1.00 15.00 A C +ATOM 152 CG1 VAL A 36 40.876 27.140 25.723 1.00 15.00 A C +ATOM 153 CG2 VAL A 36 43.056 28.339 25.913 1.00 15.00 A C +ATOM 154 C VAL A 36 42.030 24.651 25.721 1.00 15.00 A C +ATOM 155 O VAL A 36 41.819 24.076 24.669 1.00 15.00 A O +ATOM 156 N PRO A 37 41.556 24.207 26.863 1.00 15.00 A N +ATOM 157 CA PRO A 37 40.691 23.029 26.956 1.00 15.00 A C +ATOM 158 CB PRO A 37 40.585 22.740 28.471 1.00 15.00 A C +ATOM 159 CG PRO A 37 41.360 23.779 29.226 1.00 15.00 A C +ATOM 160 CD PRO A 37 42.043 24.660 28.210 1.00 15.00 A C +ATOM 161 C PRO A 37 39.301 23.299 26.377 1.00 15.00 A C +ATOM 162 O PRO A 37 38.285 22.999 26.981 1.00 15.00 A O +ATOM 163 N ASP A 38 39.245 23.864 25.218 1.00 15.00 A N +ATOM 164 HN ASP A 38 40.072 24.102 24.749 1.00 15.00 A H +ATOM 165 CA ASP A 38 37.962 24.146 24.610 1.00 15.00 A C +ATOM 166 CB ASP A 38 37.414 25.506 25.059 1.00 15.00 A C +ATOM 167 CG ASP A 38 35.978 25.667 24.558 1.00 15.00 A C +ATOM 168 OD1 ASP A 38 35.556 24.849 23.757 1.00 15.00 A O +ATOM 169 OD2 ASP A 38 35.322 26.601 24.987 1.00 15.00 A O +ATOM 170 C ASP A 38 38.145 24.095 23.103 1.00 15.00 A C +ATOM 171 O ASP A 38 38.884 24.871 22.531 1.00 15.00 A O +ATOM 172 N VAL A 39 37.501 23.164 22.447 1.00 15.00 A N +ATOM 173 HN VAL A 39 36.907 22.543 22.919 1.00 15.00 A H +ATOM 174 CA VAL A 39 37.679 23.064 21.011 1.00 15.00 A C +ATOM 175 CB VAL A 39 37.057 21.845 20.323 1.00 15.00 A C +ATOM 176 CG1 VAL A 39 37.626 20.565 20.939 1.00 15.00 A C +ATOM 177 CG2 VAL A 39 35.539 21.871 20.517 1.00 15.00 A C +ATOM 178 C VAL A 39 37.250 24.328 20.309 1.00 15.00 A C +ATOM 179 O VAL A 39 37.896 24.717 19.352 1.00 15.00 A O +ATOM 180 N VAL A 40 36.211 24.997 20.712 1.00 15.00 A N +ATOM 181 HN VAL A 40 35.679 24.704 21.481 1.00 15.00 A H +ATOM 182 CA VAL A 40 35.874 26.201 19.968 1.00 15.00 A C +ATOM 183 CB VAL A 40 34.454 26.799 20.091 1.00 15.00 A C +ATOM 184 CG1 VAL A 40 33.446 25.870 19.410 1.00 15.00 A C +ATOM 185 CG2 VAL A 40 34.097 26.943 21.575 1.00 15.00 A C +ATOM 186 C VAL A 40 36.968 27.239 20.038 1.00 15.00 A C +ATOM 187 O VAL A 40 37.196 27.944 19.070 1.00 15.00 A O +ATOM 188 N PHE A 41 37.652 27.365 21.090 1.00 15.00 A N +ATOM 189 HN PHE A 41 37.478 26.798 21.870 1.00 15.00 A H +ATOM 190 CA PHE A 41 38.695 28.359 21.124 1.00 15.00 A C +ATOM 191 CB PHE A 41 39.002 28.721 22.577 1.00 15.00 A C +ATOM 192 CG PHE A 41 37.992 29.708 23.111 1.00 15.00 A C +ATOM 193 CD1 PHE A 41 38.161 31.083 22.855 1.00 15.00 A C +ATOM 194 CD2 PHE A 41 36.901 29.264 23.880 1.00 15.00 A C +ATOM 195 CE1 PHE A 41 37.241 32.013 23.370 1.00 15.00 A C +ATOM 196 CE2 PHE A 41 35.976 30.196 24.392 1.00 15.00 A C +ATOM 197 CZ PHE A 41 36.149 31.571 24.138 1.00 15.00 A C +ATOM 198 C PHE A 41 39.985 27.785 20.503 1.00 15.00 A C +ATOM 199 O PHE A 41 40.689 28.436 19.757 1.00 15.00 A O +ATOM 200 N ALA A 42 40.298 26.573 20.872 1.00 15.00 A N +ATOM 201 HN ALA A 42 39.691 26.098 21.477 1.00 15.00 A H +ATOM 202 CA ALA A 42 41.505 25.895 20.427 1.00 15.00 A C +ATOM 203 CB ALA A 42 41.653 24.529 21.098 1.00 15.00 A C +ATOM 204 C ALA A 42 41.474 25.777 18.945 1.00 15.00 A C +ATOM 205 O ALA A 42 42.496 25.893 18.288 1.00 15.00 A O +ATOM 206 N GLU A 43 40.322 25.563 18.389 1.00 15.00 A N +ATOM 207 HN GLU A 43 39.509 25.484 18.930 1.00 15.00 A H +ATOM 208 CA GLU A 43 40.269 25.443 16.937 1.00 15.00 A C +ATOM 209 CB GLU A 43 39.339 24.302 16.419 1.00 15.00 A C +ATOM 210 CG GLU A 43 39.837 22.956 16.950 1.00 15.00 A C +ATOM 211 CD GLU A 43 38.973 21.830 16.381 1.00 15.00 A C +ATOM 212 OE1 GLU A 43 37.963 22.137 15.769 1.00 15.00 A O +ATOM 213 OE2 GLU A 43 39.335 20.680 16.566 1.00 15.00 A O +ATOM 214 C GLU A 43 40.012 26.815 16.290 1.00 15.00 A C +ATOM 215 O GLU A 43 39.855 26.951 15.094 1.00 15.00 A O +ATOM 216 N LYS A 44 40.049 27.819 17.102 1.00 15.00 A N +ATOM 217 HN LYS A 44 40.184 27.633 18.055 1.00 15.00 A H +ATOM 218 CA LYS A 44 39.903 29.211 16.692 1.00 15.00 A C +ATOM 219 CB LYS A 44 41.095 29.763 15.959 1.00 15.00 A C +ATOM 220 CG LYS A 44 42.417 29.445 16.648 1.00 15.00 A C +ATOM 221 CD LYS A 44 43.351 28.785 15.606 1.00 15.00 A C +ATOM 222 CE LYS A 44 44.800 29.237 15.767 1.00 15.00 A C +ATOM 223 NZ LYS A 44 45.664 28.038 15.791 1.00 15.00 A N +ATOM 224 HZ1 LYS A 44 45.560 27.505 14.904 1.00 15.00 A H +ATOM 225 HZ2 LYS A 44 45.399 27.422 16.586 1.00 15.00 A H +ATOM 226 HZ3 LYS A 44 46.660 28.317 15.900 1.00 15.00 A H +ATOM 227 C LYS A 44 38.679 29.477 15.861 1.00 15.00 A C +ATOM 228 O LYS A 44 38.703 30.258 14.928 1.00 15.00 A O +ATOM 229 N ILE A 45 37.616 28.876 16.202 1.00 15.00 A N +ATOM 230 HN ILE A 45 37.623 28.257 16.962 1.00 15.00 A H +ATOM 231 CA ILE A 45 36.414 29.103 15.479 1.00 15.00 A C +ATOM 232 CB ILE A 45 35.422 28.160 16.114 1.00 15.00 A C +ATOM 233 CG1 ILE A 45 35.958 26.707 16.089 1.00 15.00 A C +ATOM 234 CG2 ILE A 45 34.076 28.235 15.372 1.00 15.00 A C +ATOM 235 CD1 ILE A 45 36.604 26.339 14.741 1.00 15.00 A C +ATOM 236 C ILE A 45 35.921 30.546 15.684 1.00 15.00 A C +ATOM 237 O ILE A 45 35.225 31.141 14.885 1.00 15.00 A O +ATOM 238 N VAL A 46 36.242 31.009 16.821 1.00 15.00 A N +ATOM 239 HN VAL A 46 36.805 30.437 17.383 1.00 15.00 A H +ATOM 240 CA VAL A 46 35.869 32.280 17.372 1.00 15.00 A C +ATOM 241 CB VAL A 46 35.660 31.929 18.858 1.00 15.00 A C +ATOM 242 CG1 VAL A 46 34.748 32.980 19.505 1.00 15.00 A C +ATOM 243 CG2 VAL A 46 35.032 30.533 19.022 1.00 15.00 A C +ATOM 244 C VAL A 46 36.898 33.396 17.005 1.00 15.00 A C +ATOM 245 O VAL A 46 36.651 34.568 17.211 1.00 15.00 A O +ATOM 246 N GLY A 47 38.003 33.036 16.409 1.00 15.00 A N +ATOM 247 HN GLY A 47 38.158 32.079 16.266 1.00 15.00 A H +ATOM 248 CA GLY A 47 39.012 33.980 15.948 1.00 15.00 A C +ATOM 249 C GLY A 47 40.353 33.495 16.376 1.00 15.00 A C +ATOM 250 O GLY A 47 40.447 32.447 16.967 1.00 15.00 A O +ATOM 251 N ASP A 48 41.403 34.243 16.140 1.00 15.00 A N +ATOM 252 HN ASP A 48 41.317 35.106 15.685 1.00 15.00 A H +ATOM 253 CA ASP A 48 42.697 33.751 16.575 1.00 15.00 A C +ATOM 254 CB ASP A 48 43.642 33.605 15.350 1.00 15.00 A C +ATOM 255 CG ASP A 48 44.837 32.697 15.644 1.00 15.00 A C +ATOM 256 OD1 ASP A 48 44.904 32.143 16.729 1.00 15.00 A O +ATOM 257 OD2 ASP A 48 45.672 32.570 14.754 1.00 15.00 A O +ATOM 258 C ASP A 48 43.373 34.676 17.581 1.00 15.00 A C +ATOM 259 O ASP A 48 43.132 35.867 17.601 1.00 15.00 A O +ATOM 260 N GLY A 49 44.266 34.138 18.405 1.00 15.00 A N +ATOM 261 HN GLY A 49 44.449 33.175 18.390 1.00 15.00 A H +ATOM 262 CA GLY A 49 44.957 35.025 19.324 1.00 15.00 A C +ATOM 263 C GLY A 49 45.805 34.231 20.330 1.00 15.00 A C +ATOM 264 O GLY A 49 46.455 33.274 19.966 1.00 15.00 A O +ATOM 265 N ILE A 50 45.790 34.621 21.606 1.00 15.00 A N +ATOM 266 HN ILE A 50 45.260 35.405 21.862 1.00 15.00 A H +ATOM 267 CA ILE A 50 46.543 33.907 22.623 1.00 15.00 A C +ATOM 268 CB ILE A 50 47.825 34.652 23.072 1.00 15.00 A C +ATOM 269 CG1 ILE A 50 47.564 36.120 23.466 1.00 15.00 A C +ATOM 270 CG2 ILE A 50 48.894 34.624 21.973 1.00 15.00 A C +ATOM 271 CD1 ILE A 50 47.049 36.234 24.902 1.00 15.00 A C +ATOM 272 C ILE A 50 45.647 33.721 23.855 1.00 15.00 A C +ATOM 273 O ILE A 50 44.552 34.244 23.930 1.00 15.00 A O +ATOM 274 N ALA A 51 46.158 33.007 24.820 1.00 15.00 A N +ATOM 275 HN ALA A 51 47.032 32.591 24.665 1.00 15.00 A H +ATOM 276 CA ALA A 51 45.521 32.783 26.117 1.00 15.00 A C +ATOM 277 CB ALA A 51 45.306 31.291 26.329 1.00 15.00 A C +ATOM 278 C ALA A 51 46.471 33.296 27.223 1.00 15.00 A C +ATOM 279 O ALA A 51 47.667 33.406 27.014 1.00 15.00 A O +ATOM 280 N ILE A 52 45.945 33.590 28.395 1.00 15.00 A N +ATOM 281 HN ILE A 52 44.976 33.501 28.508 1.00 15.00 A H +ATOM 282 CA ILE A 52 46.733 34.039 29.523 1.00 15.00 A C +ATOM 283 CB ILE A 52 46.555 35.520 29.810 1.00 15.00 A C +ATOM 284 CG1 ILE A 52 47.171 36.333 28.659 1.00 15.00 A C +ATOM 285 CG2 ILE A 52 47.243 35.906 31.130 1.00 15.00 A C +ATOM 286 CD1 ILE A 52 46.589 37.750 28.622 1.00 15.00 A C +ATOM 287 C ILE A 52 46.347 33.293 30.788 1.00 15.00 A C +ATOM 288 O ILE A 52 45.196 33.254 31.169 1.00 15.00 A O +ATOM 289 N LYS A 53 47.325 32.753 31.468 1.00 15.00 A N +ATOM 290 HN LYS A 53 48.237 32.777 31.110 1.00 15.00 A H +ATOM 291 CA LYS A 53 47.073 32.119 32.746 1.00 15.00 A C +ATOM 292 CB LYS A 53 48.064 31.002 33.081 1.00 15.00 A C +ATOM 293 CG LYS A 53 47.373 29.772 33.749 1.00 15.00 A C +ATOM 294 CD LYS A 53 47.317 29.902 35.288 1.00 15.00 A C +ATOM 295 CE LYS A 53 46.424 28.781 35.871 1.00 15.00 A C +ATOM 296 NZ LYS A 53 46.079 29.045 37.304 1.00 15.00 A N +ATOM 297 HZ1 LYS A 53 45.565 29.945 37.388 1.00 15.00 A H +ATOM 298 HZ2 LYS A 53 46.945 29.099 37.876 1.00 15.00 A H +ATOM 299 HZ3 LYS A 53 45.480 28.279 37.674 1.00 15.00 A H +ATOM 300 C LYS A 53 47.162 33.312 33.700 1.00 15.00 A C +ATOM 301 O LYS A 53 48.207 33.909 33.825 1.00 15.00 A O +ATOM 302 N PRO A 54 46.049 33.734 34.243 1.00 15.00 A N +ATOM 303 CA PRO A 54 45.940 34.975 35.019 1.00 15.00 A C +ATOM 304 CB PRO A 54 44.419 35.156 35.247 1.00 15.00 A C +ATOM 305 CG PRO A 54 43.711 33.998 34.631 1.00 15.00 A C +ATOM 306 CD PRO A 54 44.762 32.985 34.242 1.00 15.00 A C +ATOM 307 C PRO A 54 46.634 34.889 36.403 1.00 15.00 A C +ATOM 308 O PRO A 54 46.687 33.848 37.022 1.00 15.00 A O +ATOM 309 N THR A 55 47.121 36.009 36.890 1.00 15.00 A N +ATOM 310 HN THR A 55 47.056 36.823 36.348 1.00 15.00 A H +ATOM 311 CA THR A 55 47.759 36.093 38.212 1.00 15.00 A C +ATOM 312 CB THR A 55 49.294 36.242 38.145 1.00 15.00 A C +ATOM 313 OG1 THR A 55 49.622 37.403 37.398 1.00 15.00 A O +ATOM 314 HG1 THR A 55 48.962 38.082 37.554 1.00 15.00 A H +ATOM 315 CG2 THR A 55 49.937 35.013 37.502 1.00 15.00 A C +ATOM 316 C THR A 55 47.322 37.366 38.926 1.00 15.00 A C +ATOM 317 O THR A 55 47.803 37.649 40.005 1.00 15.00 A O +ATOM 318 N GLY A 56 46.458 38.162 38.327 1.00 15.00 A N +ATOM 319 HN GLY A 56 46.090 37.904 37.456 1.00 15.00 A H +ATOM 320 CA GLY A 56 46.046 39.418 38.947 1.00 15.00 A C +ATOM 321 C GLY A 56 44.604 39.428 39.471 1.00 15.00 A C +ATOM 322 O GLY A 56 44.100 38.441 39.966 1.00 15.00 A O +ATOM 323 N ASN A 57 43.945 40.588 39.356 1.00 15.00 A N +ATOM 324 HN ASN A 57 44.399 41.353 38.944 1.00 15.00 A H +ATOM 325 CA ASN A 57 42.577 40.750 39.822 1.00 15.00 A C +ATOM 326 CB ASN A 57 42.521 41.365 41.224 1.00 15.00 A C +ATOM 327 CG ASN A 57 43.170 42.748 41.224 1.00 15.00 A C +ATOM 328 OD1 ASN A 57 42.697 43.664 40.576 1.00 15.00 A O +ATOM 329 ND2 ASN A 57 44.248 42.933 41.939 1.00 15.00 A N +ATOM 330 HD21 ASN A 57 44.600 42.175 42.450 1.00 15.00 A H +ATOM 331 HD22 ASN A 57 44.659 43.823 41.935 1.00 15.00 A H +ATOM 332 C ASN A 57 41.778 41.630 38.920 1.00 15.00 A C +ATOM 333 O ASN A 57 40.710 42.075 39.306 1.00 15.00 A O +ATOM 334 N LYS A 58 42.221 41.917 37.734 1.00 15.00 A N +ATOM 335 HN LYS A 58 43.084 41.590 37.404 1.00 15.00 A H +ATOM 336 CA LYS A 58 41.372 42.734 36.950 1.00 15.00 A C +ATOM 337 CB LYS A 58 41.517 44.141 37.443 1.00 15.00 A C +ATOM 338 CG LYS A 58 42.825 44.723 36.916 1.00 15.00 A C +ATOM 339 CD LYS A 58 43.121 46.093 37.579 1.00 15.00 A C +ATOM 340 CE LYS A 58 44.587 46.176 38.062 1.00 15.00 A C +ATOM 341 NZ LYS A 58 45.416 46.936 37.087 1.00 15.00 A N +ATOM 342 HZ1 LYS A 58 45.046 47.902 36.980 1.00 15.00 A H +ATOM 343 HZ2 LYS A 58 45.398 46.466 36.160 1.00 15.00 A H +ATOM 344 HZ3 LYS A 58 46.401 46.987 37.418 1.00 15.00 A H +ATOM 345 C LYS A 58 41.628 42.600 35.448 1.00 15.00 A C +ATOM 346 O LYS A 58 42.701 42.244 35.001 1.00 15.00 A O +ATOM 347 N MET A 59 40.589 42.903 34.674 1.00 15.00 A N +ATOM 348 HN MET A 59 39.746 43.166 35.100 1.00 15.00 A H +ATOM 349 CA MET A 59 40.652 42.860 33.238 1.00 15.00 A C +ATOM 350 CB MET A 59 39.550 41.917 32.785 1.00 15.00 A C +ATOM 351 CG MET A 59 40.023 40.839 31.827 1.00 15.00 A C +ATOM 352 SD MET A 59 38.785 39.504 31.625 1.00 15.00 A S +ATOM 353 CE MET A 59 37.878 39.625 33.193 1.00 15.00 A C +ATOM 354 C MET A 59 40.472 44.289 32.682 1.00 15.00 A C +ATOM 355 O MET A 59 39.477 44.941 32.942 1.00 15.00 A O +ATOM 356 N VAL A 60 41.451 44.782 31.927 1.00 15.00 A N +ATOM 357 HN VAL A 60 42.237 44.228 31.738 1.00 15.00 A H +ATOM 358 CA VAL A 60 41.380 46.121 31.378 1.00 15.00 A C +ATOM 359 CB VAL A 60 42.591 46.937 31.700 1.00 15.00 A C +ATOM 360 CG1 VAL A 60 42.961 46.748 33.170 1.00 15.00 A C +ATOM 361 CG2 VAL A 60 43.758 46.432 30.833 1.00 15.00 A C +ATOM 362 C VAL A 60 41.289 46.084 29.877 1.00 15.00 A C +ATOM 363 O VAL A 60 41.393 45.055 29.237 1.00 15.00 A O +ATOM 364 N ALA A 61 41.112 47.242 29.340 1.00 15.00 A N +ATOM 365 HN ALA A 61 41.039 48.030 29.918 1.00 15.00 A H +ATOM 366 CA ALA A 61 41.017 47.412 27.883 1.00 15.00 A C +ATOM 367 CB ALA A 61 40.618 48.853 27.559 1.00 15.00 A C +ATOM 368 C ALA A 61 42.345 47.121 27.252 1.00 15.00 A C +ATOM 369 O ALA A 61 43.335 47.704 27.655 1.00 15.00 A O +ATOM 370 N PRO A 62 42.432 46.240 26.269 1.00 15.00 A N +ATOM 371 CA PRO A 62 43.755 45.976 25.683 1.00 15.00 A C +ATOM 372 CB PRO A 62 43.679 44.581 25.038 1.00 15.00 A C +ATOM 373 CG PRO A 62 42.193 44.301 24.871 1.00 15.00 A C +ATOM 374 CD PRO A 62 41.397 45.423 25.597 1.00 15.00 A C +ATOM 375 C PRO A 62 44.066 46.999 24.574 1.00 15.00 A C +ATOM 376 O PRO A 62 45.111 46.948 23.959 1.00 15.00 A O +ATOM 377 N VAL A 63 43.138 47.896 24.302 1.00 15.00 A N +ATOM 378 HN VAL A 63 42.308 47.899 24.823 1.00 15.00 A H +ATOM 379 CA VAL A 63 43.319 48.897 23.230 1.00 15.00 A C +ATOM 380 CB VAL A 63 43.003 48.369 21.817 1.00 15.00 A C +ATOM 381 CG1 VAL A 63 43.818 47.114 21.503 1.00 15.00 A C +ATOM 382 CG2 VAL A 63 41.508 48.055 21.709 1.00 15.00 A C +ATOM 383 C VAL A 63 42.415 50.097 23.442 1.00 15.00 A C +ATOM 384 O VAL A 63 41.448 50.042 24.178 1.00 15.00 A O +ATOM 385 N ASP A 64 42.708 51.169 22.735 1.00 15.00 A N +ATOM 386 HN ASP A 64 43.516 51.177 22.180 1.00 15.00 A H +ATOM 387 CA ASP A 64 41.847 52.343 22.767 1.00 15.00 A C +ATOM 388 CB ASP A 64 42.570 53.649 22.472 1.00 15.00 A C +ATOM 389 CG ASP A 64 43.757 53.886 23.407 1.00 15.00 A C +ATOM 390 OD1 ASP A 64 43.758 53.367 24.508 1.00 15.00 A O +ATOM 391 OD2 ASP A 64 44.659 54.594 22.986 1.00 15.00 A O +ATOM 392 C ASP A 64 40.735 51.996 21.791 1.00 15.00 A C +ATOM 393 O ASP A 64 40.979 51.554 20.685 1.00 15.00 A O +ATOM 394 N GLY A 65 39.517 52.108 22.234 1.00 15.00 A N +ATOM 395 HN GLY A 65 39.367 52.466 23.134 1.00 15.00 A H +ATOM 396 CA GLY A 65 38.385 51.714 21.424 1.00 15.00 A C +ATOM 397 C GLY A 65 37.103 51.805 22.216 1.00 15.00 A C +ATOM 398 O GLY A 65 37.014 52.544 23.179 1.00 15.00 A O +ATOM 399 N THR A 66 36.090 51.081 21.795 1.00 15.00 A N +ATOM 400 HN THR A 66 36.199 50.484 21.025 1.00 15.00 A H +ATOM 401 CA THR A 66 34.809 51.167 22.473 1.00 15.00 A C +ATOM 402 CB THR A 66 33.791 51.680 21.429 1.00 15.00 A C +ATOM 403 OG1 THR A 66 34.241 52.927 20.930 1.00 15.00 A O +ATOM 404 HG1 THR A 66 34.073 53.612 21.581 1.00 15.00 A H +ATOM 405 CG2 THR A 66 32.403 51.847 22.051 1.00 15.00 A C +ATOM 406 C THR A 66 34.346 49.805 22.951 1.00 15.00 A C +ATOM 407 O THR A 66 34.398 48.843 22.209 1.00 15.00 A O +ATOM 408 N ILE A 67 33.865 49.698 24.170 1.00 15.00 A N +ATOM 409 HN ILE A 67 33.819 50.473 24.768 1.00 15.00 A H +ATOM 410 CA ILE A 67 33.400 48.379 24.603 1.00 15.00 A C +ATOM 411 CB ILE A 67 32.975 48.289 26.069 1.00 15.00 A C +ATOM 412 CG1 ILE A 67 34.148 48.553 27.064 1.00 15.00 A C +ATOM 413 CG2 ILE A 67 32.332 46.912 26.330 1.00 15.00 A C +ATOM 414 CD1 ILE A 67 35.526 48.301 26.445 1.00 15.00 A C +ATOM 415 C ILE A 67 32.165 48.060 23.817 1.00 15.00 A C +ATOM 416 O ILE A 67 31.323 48.910 23.603 1.00 15.00 A O +ATOM 417 N GLY A 68 32.043 46.847 23.422 1.00 15.00 A N +ATOM 418 HN GLY A 68 32.746 46.205 23.646 1.00 15.00 A H +ATOM 419 CA GLY A 68 30.906 46.409 22.664 1.00 15.00 A C +ATOM 420 C GLY A 68 29.880 45.657 23.465 1.00 15.00 A C +ATOM 421 O GLY A 68 28.741 46.063 23.598 1.00 15.00 A O +ATOM 422 N LYS A 69 30.264 44.542 23.959 1.00 15.00 A N +ATOM 423 HN LYS A 69 31.189 44.246 23.829 1.00 15.00 A H +ATOM 424 CA LYS A 69 29.359 43.724 24.698 1.00 15.00 A C +ATOM 425 CB LYS A 69 28.559 42.766 23.808 1.00 15.00 A C +ATOM 426 CG LYS A 69 27.458 42.034 24.639 1.00 15.00 A C +ATOM 427 CD LYS A 69 27.688 40.514 24.625 1.00 15.00 A C +ATOM 428 CE LYS A 69 26.566 39.820 25.402 1.00 15.00 A C +ATOM 429 NZ LYS A 69 25.251 40.133 24.770 1.00 15.00 A N +ATOM 430 HZ1 LYS A 69 25.086 41.160 24.779 1.00 15.00 A H +ATOM 431 HZ2 LYS A 69 24.483 39.666 25.292 1.00 15.00 A H +ATOM 432 HZ3 LYS A 69 25.239 39.798 23.785 1.00 15.00 A H +ATOM 433 C LYS A 69 30.026 43.072 25.879 1.00 15.00 A C +ATOM 434 O LYS A 69 31.116 42.569 25.821 1.00 15.00 A O +ATOM 435 N ILE A 70 29.287 43.116 26.978 1.00 15.00 A N +ATOM 436 HN ILE A 70 28.411 43.553 26.929 1.00 15.00 A H +ATOM 437 CA ILE A 70 29.698 42.559 28.238 1.00 15.00 A C +ATOM 438 CB ILE A 70 29.740 43.624 29.331 1.00 15.00 A C +ATOM 439 CG1 ILE A 70 30.772 44.689 28.924 1.00 15.00 A C +ATOM 440 CG2 ILE A 70 30.139 42.986 30.662 1.00 15.00 A C +ATOM 441 CD1 ILE A 70 30.833 45.831 29.941 1.00 15.00 A C +ATOM 442 C ILE A 70 28.705 41.448 28.535 1.00 15.00 A C +ATOM 443 O ILE A 70 27.504 41.651 28.511 1.00 15.00 A O +ATOM 444 N PHE A 71 29.203 40.266 28.772 1.00 15.00 A N +ATOM 445 HN PHE A 71 30.175 40.138 28.761 1.00 15.00 A H +ATOM 446 CA PHE A 71 28.329 39.132 29.053 1.00 15.00 A C +ATOM 447 CB PHE A 71 29.169 37.845 29.165 1.00 15.00 A C +ATOM 448 CG PHE A 71 29.326 37.209 27.797 1.00 15.00 A C +ATOM 449 CD1 PHE A 71 29.833 37.965 26.723 1.00 15.00 A C +ATOM 450 CD2 PHE A 71 28.957 35.863 27.596 1.00 15.00 A C +ATOM 451 CE1 PHE A 71 29.972 37.377 25.450 1.00 15.00 A C +ATOM 452 CE2 PHE A 71 29.097 35.276 26.324 1.00 15.00 A C +ATOM 453 CZ PHE A 71 29.604 36.033 25.252 1.00 15.00 A C +ATOM 454 C PHE A 71 27.553 39.433 30.351 1.00 15.00 A C +ATOM 455 O PHE A 71 28.035 40.082 31.258 1.00 15.00 A O +ATOM 456 N GLU A 72 26.340 38.977 30.395 1.00 15.00 A N +ATOM 457 HN GLU A 72 26.012 38.461 29.629 1.00 15.00 A H +ATOM 458 CA GLU A 72 25.439 39.189 31.517 1.00 15.00 A C +ATOM 459 CB GLU A 72 23.982 38.713 31.244 1.00 15.00 A C +ATOM 460 CG GLU A 72 23.351 39.613 30.181 1.00 15.00 A C +ATOM 461 CD GLU A 72 21.882 39.233 29.992 1.00 15.00 A C +ATOM 462 OE1 GLU A 72 21.504 38.164 30.442 1.00 15.00 A O +ATOM 463 OE2 GLU A 72 21.160 40.023 29.408 1.00 15.00 A O +ATOM 464 C GLU A 72 26.018 38.543 32.809 1.00 15.00 A C +ATOM 465 O GLU A 72 25.596 38.839 33.909 1.00 15.00 A O +ATOM 466 N THR A 73 26.992 37.696 32.662 1.00 15.00 A N +ATOM 467 HN THR A 73 27.288 37.496 31.750 1.00 15.00 A H +ATOM 468 CA THR A 73 27.683 37.015 33.772 1.00 15.00 A C +ATOM 469 CB THR A 73 27.918 35.516 33.548 1.00 15.00 A C +ATOM 470 OG1 THR A 73 28.602 35.327 32.319 1.00 15.00 A O +ATOM 471 HG1 THR A 73 28.770 36.180 31.912 1.00 15.00 A H +ATOM 472 CG2 THR A 73 26.576 34.777 33.505 1.00 15.00 A C +ATOM 473 C THR A 73 28.957 37.756 34.087 1.00 15.00 A C +ATOM 474 O THR A 73 29.737 37.413 34.948 1.00 15.00 A O +ATOM 475 N ASN A 74 29.092 38.818 33.422 1.00 15.00 A N +ATOM 476 HN ASN A 74 28.422 39.025 32.738 1.00 15.00 A H +ATOM 477 CA ASN A 74 30.179 39.745 33.613 1.00 15.00 A C +ATOM 478 CB ASN A 74 29.936 40.411 34.967 1.00 15.00 A C +ATOM 479 CG ASN A 74 28.553 41.025 35.040 1.00 15.00 A C +ATOM 480 OD1 ASN A 74 27.800 40.738 35.954 1.00 15.00 A O +ATOM 481 ND2 ASN A 74 28.195 41.884 34.130 1.00 15.00 A N +ATOM 482 HD21 ASN A 74 28.838 42.105 33.424 1.00 15.00 A H +ATOM 483 HD22 ASN A 74 27.298 42.274 34.189 1.00 15.00 A H +ATOM 484 C ASN A 74 31.530 39.067 33.600 1.00 15.00 A C +ATOM 485 O ASN A 74 32.365 39.352 34.438 1.00 15.00 A O +ATOM 486 N HIS A 75 31.758 38.167 32.668 1.00 15.00 A N +ATOM 487 HN HIS A 75 31.078 37.979 31.988 1.00 15.00 A H +ATOM 488 CA HIS A 75 33.001 37.465 32.653 1.00 15.00 A C +ATOM 489 CB HIS A 75 32.757 36.006 33.049 1.00 15.00 A C +ATOM 490 CG HIS A 75 32.243 35.218 31.873 1.00 15.00 A C +ATOM 491 ND1 HIS A 75 30.894 35.144 31.561 1.00 15.00 A N +ATOM 492 HD1 HIS A 75 30.163 35.584 32.037 1.00 15.00 A H +ATOM 493 CD2 HIS A 75 32.888 34.457 30.928 1.00 15.00 A C +ATOM 494 CE1 HIS A 75 30.770 34.363 30.472 1.00 15.00 A C +ATOM 495 NE2 HIS A 75 31.955 33.922 30.048 1.00 15.00 A N +ATOM 496 C HIS A 75 33.742 37.541 31.293 1.00 15.00 A C +ATOM 497 O HIS A 75 34.825 37.010 31.144 1.00 15.00 A O +ATOM 498 N ALA A 76 33.181 38.178 30.324 1.00 15.00 A N +ATOM 499 HN ALA A 76 32.307 38.594 30.476 1.00 15.00 A H +ATOM 500 CA ALA A 76 33.778 38.299 29.051 1.00 15.00 A C +ATOM 501 CB ALA A 76 33.344 37.093 28.273 1.00 15.00 A C +ATOM 502 C ALA A 76 33.306 39.548 28.345 1.00 15.00 A C +ATOM 503 O ALA A 76 32.212 40.026 28.574 1.00 15.00 A O +ATOM 504 N PHE A 77 34.110 40.089 27.466 1.00 15.00 A N +ATOM 505 HN PHE A 77 34.992 39.702 27.287 1.00 15.00 A H +ATOM 506 CA PHE A 77 33.667 41.265 26.769 1.00 15.00 A C +ATOM 507 CB PHE A 77 33.925 42.500 27.619 1.00 15.00 A C +ATOM 508 CG PHE A 77 35.399 42.843 27.671 1.00 15.00 A C +ATOM 509 CD1 PHE A 77 35.969 43.669 26.690 1.00 15.00 A C +ATOM 510 CD2 PHE A 77 36.187 42.371 28.723 1.00 15.00 A C +ATOM 511 CE1 PHE A 77 37.322 44.022 26.769 1.00 15.00 A C +ATOM 512 CE2 PHE A 77 37.541 42.719 28.798 1.00 15.00 A C +ATOM 513 CZ PHE A 77 38.108 43.548 27.825 1.00 15.00 A C +ATOM 514 C PHE A 77 34.299 41.422 25.389 1.00 15.00 A C +ATOM 515 O PHE A 77 35.258 40.769 25.019 1.00 15.00 A O +ATOM 516 N SER A 78 33.697 42.321 24.640 1.00 15.00 A N +ATOM 517 HN SER A 78 32.937 42.804 25.026 1.00 15.00 A H +ATOM 518 CA SER A 78 34.082 42.642 23.291 1.00 15.00 A C +ATOM 519 CB SER A 78 32.836 42.581 22.404 1.00 15.00 A C +ATOM 520 OG SER A 78 32.516 41.228 22.141 1.00 15.00 A O +ATOM 521 HG SER A 78 32.427 40.753 22.970 1.00 15.00 A H +ATOM 522 C SER A 78 34.502 44.100 23.209 1.00 15.00 A C +ATOM 523 O SER A 78 33.832 44.949 23.762 1.00 15.00 A O +ATOM 524 N ILE A 79 35.532 44.414 22.477 1.00 15.00 A N +ATOM 525 HN ILE A 79 36.055 43.707 22.044 1.00 15.00 A H +ATOM 526 CA ILE A 79 35.912 45.804 22.297 1.00 15.00 A C +ATOM 527 CB ILE A 79 37.006 46.218 23.273 1.00 15.00 A C +ATOM 528 CG1 ILE A 79 37.588 47.602 22.949 1.00 15.00 A C +ATOM 529 CG2 ILE A 79 38.107 45.178 23.244 1.00 15.00 A C +ATOM 530 CD1 ILE A 79 38.417 48.111 24.142 1.00 15.00 A C +ATOM 531 C ILE A 79 36.407 45.963 20.875 1.00 15.00 A C +ATOM 532 O ILE A 79 36.941 45.038 20.294 1.00 15.00 A O +ATOM 533 N GLU A 80 36.231 47.127 20.318 1.00 15.00 A N +ATOM 534 HN GLU A 80 35.768 47.828 20.822 1.00 15.00 A H +ATOM 535 CA GLU A 80 36.698 47.421 18.975 1.00 15.00 A C +ATOM 536 CB GLU A 80 35.554 47.799 18.031 1.00 15.00 A C +ATOM 537 CG GLU A 80 36.100 47.977 16.613 1.00 15.00 A C +ATOM 538 CD GLU A 80 34.977 48.454 15.690 1.00 15.00 A C +ATOM 539 OE1 GLU A 80 33.875 48.641 16.178 1.00 15.00 A O +ATOM 540 OE2 GLU A 80 35.238 48.623 14.510 1.00 15.00 A O +ATOM 541 C GLU A 80 37.686 48.529 19.126 1.00 15.00 A C +ATOM 542 O GLU A 80 37.411 49.491 19.790 1.00 15.00 A O +ATOM 543 N SER A 81 38.846 48.400 18.559 1.00 15.00 A N +ATOM 544 HN SER A 81 39.051 47.616 18.008 1.00 15.00 A H +ATOM 545 CA SER A 81 39.819 49.429 18.757 1.00 15.00 A C +ATOM 546 CB SER A 81 41.185 48.957 18.353 1.00 15.00 A C +ATOM 547 OG SER A 81 41.147 48.769 16.947 1.00 15.00 A O +ATOM 548 HG SER A 81 40.280 48.448 16.690 1.00 15.00 A H +ATOM 549 C SER A 81 39.515 50.543 17.823 1.00 15.00 A C +ATOM 550 O SER A 81 38.755 50.388 16.884 1.00 15.00 A O +ATOM 551 N ASP A 82 40.123 51.646 18.029 1.00 15.00 A N +ATOM 552 HN ASP A 82 40.731 51.748 18.791 1.00 15.00 A H +ATOM 553 CA ASP A 82 39.894 52.747 17.111 1.00 15.00 A C +ATOM 554 CB ASP A 82 40.434 54.112 17.606 1.00 15.00 A C +ATOM 555 CG ASP A 82 39.735 54.603 18.874 1.00 15.00 A C +ATOM 556 OD1 ASP A 82 38.593 54.223 19.086 1.00 15.00 A O +ATOM 557 OD2 ASP A 82 40.353 55.373 19.602 1.00 15.00 A O +ATOM 558 C ASP A 82 40.511 52.374 15.746 1.00 15.00 A C +ATOM 559 O ASP A 82 40.033 52.776 14.701 1.00 15.00 A O +ATOM 560 N SER A 83 41.570 51.598 15.798 1.00 15.00 A N +ATOM 561 HN SER A 83 41.879 51.317 16.684 1.00 15.00 A H +ATOM 562 CA SER A 83 42.317 51.125 14.651 1.00 15.00 A C +ATOM 563 CB SER A 83 43.627 50.470 15.061 1.00 15.00 A C +ATOM 564 OG SER A 83 43.562 50.103 16.432 1.00 15.00 A O +ATOM 565 HG SER A 83 44.380 50.351 16.869 1.00 15.00 A H +ATOM 566 C SER A 83 41.526 50.095 13.833 1.00 15.00 A C +ATOM 567 O SER A 83 42.036 49.508 12.896 1.00 15.00 A O +ATOM 568 N GLY A 84 40.325 49.878 14.218 1.00 15.00 A N +ATOM 569 HN GLY A 84 39.996 50.392 14.984 1.00 15.00 A H +ATOM 570 CA GLY A 84 39.414 48.918 13.594 1.00 15.00 A C +ATOM 571 C GLY A 84 39.603 47.429 13.946 1.00 15.00 A C +ATOM 572 O GLY A 84 39.040 46.587 13.269 1.00 15.00 A O +ATOM 573 N VAL A 85 40.336 47.062 14.962 1.00 15.00 A N +ATOM 574 HN VAL A 85 40.806 47.732 15.501 1.00 15.00 A H +ATOM 575 CA VAL A 85 40.448 45.637 15.287 1.00 15.00 A C +ATOM 576 CB VAL A 85 41.852 45.293 15.855 1.00 15.00 A C +ATOM 577 CG1 VAL A 85 41.990 43.788 16.135 1.00 15.00 A C +ATOM 578 CG2 VAL A 85 42.915 45.752 14.854 1.00 15.00 A C +ATOM 579 C VAL A 85 39.368 45.219 16.331 1.00 15.00 A C +ATOM 580 O VAL A 85 39.185 45.866 17.344 1.00 15.00 A O +ATOM 581 N GLU A 86 38.677 44.104 16.077 1.00 15.00 A N +ATOM 582 HN GLU A 86 38.843 43.630 15.236 1.00 15.00 A H +ATOM 583 CA GLU A 86 37.674 43.557 17.011 1.00 15.00 A C +ATOM 584 CB GLU A 86 36.476 42.971 16.256 1.00 15.00 A C +ATOM 585 CG GLU A 86 35.777 44.086 15.474 1.00 15.00 A C +ATOM 586 CD GLU A 86 34.583 43.509 14.712 1.00 15.00 A C +ATOM 587 OE1 GLU A 86 34.522 42.300 14.574 1.00 15.00 A O +ATOM 588 OE2 GLU A 86 33.750 44.288 14.279 1.00 15.00 A O +ATOM 589 C GLU A 86 38.302 42.449 17.877 1.00 15.00 A C +ATOM 590 O GLU A 86 38.826 41.474 17.374 1.00 15.00 A O +ATOM 591 N LEU A 87 38.263 42.620 19.185 1.00 15.00 A N +ATOM 592 HN LEU A 87 37.828 43.423 19.541 1.00 15.00 A H +ATOM 593 CA LEU A 87 38.838 41.667 20.119 1.00 15.00 A C +ATOM 594 CB LEU A 87 39.801 42.345 21.125 1.00 15.00 A C +ATOM 595 CG LEU A 87 41.183 42.838 20.650 1.00 15.00 A C +ATOM 596 CD1 LEU A 87 41.826 41.874 19.689 1.00 15.00 A C +ATOM 597 CD2 LEU A 87 41.077 44.229 20.039 1.00 15.00 A C +ATOM 598 C LEU A 87 37.765 41.055 20.993 1.00 15.00 A C +ATOM 599 O LEU A 87 36.707 41.618 21.205 1.00 15.00 A O +ATOM 600 N PHE A 88 38.069 39.920 21.545 1.00 15.00 A N +ATOM 601 HN PHE A 88 38.934 39.501 21.351 1.00 15.00 A H +ATOM 602 CA PHE A 88 37.146 39.270 22.441 1.00 15.00 A C +ATOM 603 CB PHE A 88 36.217 38.306 21.700 1.00 15.00 A C +ATOM 604 CG PHE A 88 35.195 37.751 22.665 1.00 15.00 A C +ATOM 605 CD1 PHE A 88 34.236 38.608 23.236 1.00 15.00 A C +ATOM 606 CD2 PHE A 88 35.198 36.380 22.992 1.00 15.00 A C +ATOM 607 CE1 PHE A 88 33.280 38.097 24.134 1.00 15.00 A C +ATOM 608 CE2 PHE A 88 34.241 35.868 23.889 1.00 15.00 A C +ATOM 609 CZ PHE A 88 33.282 36.727 24.460 1.00 15.00 A C +ATOM 610 C PHE A 88 37.920 38.580 23.573 1.00 15.00 A C +ATOM 611 O PHE A 88 38.624 37.606 23.395 1.00 15.00 A O +ATOM 612 N VAL A 89 37.742 39.127 24.754 1.00 15.00 A N +ATOM 613 HN VAL A 89 37.157 39.911 24.811 1.00 15.00 A H +ATOM 614 CA VAL A 89 38.356 38.646 25.987 1.00 15.00 A C +ATOM 615 CB VAL A 89 38.877 39.844 26.725 1.00 15.00 A C +ATOM 616 CG1 VAL A 89 39.703 39.424 27.945 1.00 15.00 A C +ATOM 617 CG2 VAL A 89 39.737 40.622 25.730 1.00 15.00 A C +ATOM 618 C VAL A 89 37.377 37.849 26.818 1.00 15.00 A C +ATOM 619 O VAL A 89 36.374 38.345 27.292 1.00 15.00 A O +ATOM 620 N HIS A 90 37.677 36.573 26.984 1.00 15.00 A N +ATOM 621 HN HIS A 90 38.499 36.208 26.594 1.00 15.00 A H +ATOM 622 CA HIS A 90 36.797 35.720 27.737 1.00 15.00 A C +ATOM 623 CB HIS A 90 36.172 34.677 26.766 1.00 15.00 A C +ATOM 624 CG HIS A 90 35.330 33.706 27.547 1.00 15.00 A C +ATOM 625 ND1 HIS A 90 35.881 32.806 28.445 1.00 15.00 A N +ATOM 626 HD1 HIS A 90 36.831 32.703 28.662 1.00 15.00 A H +ATOM 627 CD2 HIS A 90 33.975 33.483 27.576 1.00 15.00 A C +ATOM 628 CE1 HIS A 90 34.871 32.089 28.972 1.00 15.00 A C +ATOM 629 NE2 HIS A 90 33.688 32.461 28.476 1.00 15.00 A N +ATOM 630 C HIS A 90 37.548 35.048 28.923 1.00 15.00 A C +ATOM 631 O HIS A 90 38.296 34.127 28.744 1.00 15.00 A O +ATOM 632 N PHE A 91 37.322 35.505 30.162 1.00 15.00 A N +ATOM 633 HN PHE A 91 36.711 36.258 30.301 1.00 15.00 A H +ATOM 634 CA PHE A 91 37.981 34.887 31.299 1.00 15.00 A C +ATOM 635 CB PHE A 91 37.615 35.640 32.583 1.00 15.00 A C +ATOM 636 CG PHE A 91 38.570 35.251 33.687 1.00 15.00 A C +ATOM 637 CD1 PHE A 91 38.322 34.107 34.466 1.00 15.00 A C +ATOM 638 CD2 PHE A 91 39.712 36.037 33.935 1.00 15.00 A C +ATOM 639 CE1 PHE A 91 39.217 33.746 35.493 1.00 15.00 A C +ATOM 640 CE2 PHE A 91 40.606 35.678 34.961 1.00 15.00 A C +ATOM 641 CZ PHE A 91 40.359 34.532 35.740 1.00 15.00 A C +ATOM 642 C PHE A 91 37.629 33.397 31.586 1.00 15.00 A C +ATOM 643 O PHE A 91 36.490 33.050 31.828 1.00 15.00 A O +ATOM 644 N GLY A 92 38.652 32.527 31.637 1.00 15.00 A N +ATOM 645 HN GLY A 92 39.557 32.844 31.435 1.00 15.00 A H +ATOM 646 CA GLY A 92 38.442 31.136 31.983 1.00 15.00 A C +ATOM 647 C GLY A 92 37.692 30.329 30.931 1.00 15.00 A C +ATOM 648 O GLY A 92 37.345 30.803 29.868 1.00 15.00 A O +ATOM 649 N ILE A 93 37.429 29.084 31.290 1.00 15.00 A N +ATOM 650 HN ILE A 93 37.733 28.783 32.172 1.00 15.00 A H +ATOM 651 CA ILE A 93 36.724 28.149 30.462 1.00 15.00 A C +ATOM 652 CB ILE A 93 37.626 26.986 30.060 1.00 15.00 A C +ATOM 653 CG1 ILE A 93 38.890 27.508 29.368 1.00 15.00 A C +ATOM 654 CG2 ILE A 93 36.887 25.990 29.164 1.00 15.00 A C +ATOM 655 CD1 ILE A 93 38.541 28.334 28.130 1.00 15.00 A C +ATOM 656 C ILE A 93 35.432 27.729 31.165 1.00 15.00 A C +ATOM 657 O ILE A 93 35.381 27.439 32.344 1.00 15.00 A O +ATOM 658 N ASP A 94 34.373 27.766 30.401 1.00 15.00 A N +ATOM 659 HN ASP A 94 34.483 28.008 29.458 1.00 15.00 A H +ATOM 660 CA ASP A 94 33.061 27.469 30.883 1.00 15.00 A C +ATOM 661 CB ASP A 94 32.843 26.015 31.315 1.00 15.00 A C +ATOM 662 CG ASP A 94 32.968 25.097 30.098 1.00 15.00 A C +ATOM 663 OD1 ASP A 94 32.946 25.608 28.990 1.00 15.00 A O +ATOM 664 OD2 ASP A 94 33.082 23.898 30.293 1.00 15.00 A O +ATOM 665 C ASP A 94 32.701 28.346 32.105 1.00 15.00 A C +ATOM 666 O ASP A 94 31.893 27.959 32.926 1.00 15.00 A O +ATOM 667 N THR A 95 33.282 29.503 32.244 1.00 15.00 A N +ATOM 668 HN THR A 95 33.931 29.800 31.572 1.00 15.00 A H +ATOM 669 CA THR A 95 32.988 30.350 33.364 1.00 15.00 A C +ATOM 670 CB THR A 95 34.054 31.455 33.419 1.00 15.00 A C +ATOM 671 OG1 THR A 95 34.344 31.849 32.087 1.00 15.00 A O +ATOM 672 HG1 THR A 95 35.210 31.519 31.836 1.00 15.00 A H +ATOM 673 CG2 THR A 95 35.317 30.900 34.061 1.00 15.00 A C +ATOM 674 C THR A 95 31.528 30.879 33.436 1.00 15.00 A C +ATOM 675 O THR A 95 31.080 31.254 34.507 1.00 15.00 A O +ATOM 676 N VAL A 96 30.782 30.891 32.381 1.00 15.00 A N +ATOM 677 HN VAL A 96 31.152 30.592 31.524 1.00 15.00 A H +ATOM 678 CA VAL A 96 29.381 31.348 32.449 1.00 15.00 A C +ATOM 679 CB VAL A 96 28.584 31.190 31.131 1.00 15.00 A C +ATOM 680 CG1 VAL A 96 28.409 29.705 30.786 1.00 15.00 A C +ATOM 681 CG2 VAL A 96 27.207 31.845 31.279 1.00 15.00 A C +ATOM 682 C VAL A 96 28.626 30.511 33.479 1.00 15.00 A C +ATOM 683 O VAL A 96 27.717 30.980 34.136 1.00 15.00 A O +ATOM 684 N GLU A 97 28.993 29.262 33.611 1.00 15.00 A N +ATOM 685 HN GLU A 97 29.729 28.907 33.070 1.00 15.00 A H +ATOM 686 CA GLU A 97 28.307 28.401 34.562 1.00 15.00 A C +ATOM 687 CB GLU A 97 28.741 26.911 34.483 1.00 15.00 A C +ATOM 688 CG GLU A 97 28.385 26.340 33.107 1.00 15.00 A C +ATOM 689 CD GLU A 97 26.865 26.325 32.931 1.00 15.00 A C +ATOM 690 OE1 GLU A 97 26.171 26.412 33.930 1.00 15.00 A O +ATOM 691 OE2 GLU A 97 26.421 26.226 31.799 1.00 15.00 A O +ATOM 692 C GLU A 97 28.385 28.958 36.024 1.00 15.00 A C +ATOM 693 O GLU A 97 27.562 28.608 36.847 1.00 15.00 A O +ATOM 694 N LEU A 98 29.308 29.828 36.357 1.00 15.00 A N +ATOM 695 HN LEU A 98 29.971 30.108 35.691 1.00 15.00 A H +ATOM 696 CA LEU A 98 29.363 30.382 37.694 1.00 15.00 A C +ATOM 697 CB LEU A 98 30.741 30.978 37.954 1.00 15.00 A C +ATOM 698 CG LEU A 98 31.698 29.928 38.520 1.00 15.00 A C +ATOM 699 CD1 LEU A 98 31.504 28.595 37.792 1.00 15.00 A C +ATOM 700 CD2 LEU A 98 33.135 30.420 38.330 1.00 15.00 A C +ATOM 701 C LEU A 98 28.312 31.510 37.955 1.00 15.00 A C +ATOM 702 O LEU A 98 28.220 32.041 39.045 1.00 15.00 A O +ATOM 703 N LYS A 99 27.577 31.863 36.971 1.00 15.00 A N +ATOM 704 HN LYS A 99 27.712 31.396 36.120 1.00 15.00 A H +ATOM 705 CA LYS A 99 26.555 32.901 37.008 1.00 15.00 A C +ATOM 706 CB LYS A 99 25.223 32.439 37.615 1.00 15.00 A C +ATOM 707 CG LYS A 99 24.651 31.293 36.776 1.00 15.00 A C +ATOM 708 CD LYS A 99 23.216 30.990 37.224 1.00 15.00 A C +ATOM 709 CE LYS A 99 23.211 30.462 38.665 1.00 15.00 A C +ATOM 710 NZ LYS A 99 23.257 31.609 39.615 1.00 15.00 A N +ATOM 711 HZ1 LYS A 99 24.143 32.140 39.493 1.00 15.00 A H +ATOM 712 HZ2 LYS A 99 23.205 31.264 40.595 1.00 15.00 A H +ATOM 713 HZ3 LYS A 99 22.455 32.249 39.442 1.00 15.00 A H +ATOM 714 C LYS A 99 26.975 34.234 37.619 1.00 15.00 A C +ATOM 715 O LYS A 99 26.239 34.837 38.374 1.00 15.00 A O +ATOM 716 N GLY A 100 28.118 34.736 37.243 1.00 15.00 A N +ATOM 717 HN GLY A 100 28.692 34.226 36.634 1.00 15.00 A H +ATOM 718 CA GLY A 100 28.547 36.049 37.723 1.00 15.00 A C +ATOM 719 C GLY A 100 29.380 36.040 39.021 1.00 15.00 A C +ATOM 720 O GLY A 100 29.981 37.037 39.387 1.00 15.00 A O +ATOM 721 N GLU A 101 29.409 34.955 39.706 1.00 15.00 A N +ATOM 722 HN GLU A 101 28.913 34.176 39.380 1.00 15.00 A H +ATOM 723 CA GLU A 101 30.155 34.843 40.952 1.00 15.00 A C +ATOM 724 CB GLU A 101 29.936 33.470 41.602 1.00 15.00 A C +ATOM 725 CG GLU A 101 29.601 33.592 43.122 1.00 15.00 A C +ATOM 726 CD GLU A 101 30.363 32.545 43.942 1.00 15.00 A C +ATOM 727 OE1 GLU A 101 30.358 31.390 43.543 1.00 15.00 A O +ATOM 728 OE2 GLU A 101 30.925 32.918 44.965 1.00 15.00 A O +ATOM 729 C GLU A 101 31.670 35.057 40.741 1.00 15.00 A C +ATOM 730 O GLU A 101 32.304 34.329 40.002 1.00 15.00 A O +ATOM 731 N GLY A 102 32.242 36.057 41.425 1.00 15.00 A N +ATOM 732 HN GLY A 102 31.676 36.614 41.999 1.00 15.00 A H +ATOM 733 CA GLY A 102 33.663 36.346 41.348 1.00 15.00 A C +ATOM 734 C GLY A 102 34.037 37.460 40.386 1.00 15.00 A C +ATOM 735 O GLY A 102 35.165 37.871 40.347 1.00 15.00 A O +ATOM 736 N PHE A 103 33.101 37.932 39.646 1.00 15.00 A N +ATOM 737 HN PHE A 103 32.211 37.527 39.716 1.00 15.00 A H +ATOM 738 CA PHE A 103 33.278 39.036 38.705 1.00 15.00 A C +ATOM 739 CB PHE A 103 32.807 38.647 37.280 1.00 15.00 A C +ATOM 740 CG PHE A 103 33.515 37.392 36.833 1.00 15.00 A C +ATOM 741 CD1 PHE A 103 34.812 37.464 36.328 1.00 15.00 A C +ATOM 742 CD2 PHE A 103 32.862 36.158 36.911 1.00 15.00 A C +ATOM 743 CE1 PHE A 103 35.458 36.300 35.894 1.00 15.00 A C +ATOM 744 CE2 PHE A 103 33.506 34.994 36.483 1.00 15.00 A C +ATOM 745 CZ PHE A 103 34.804 35.065 35.971 1.00 15.00 A C +ATOM 746 C PHE A 103 32.430 40.259 39.120 1.00 15.00 A C +ATOM 747 O PHE A 103 31.382 40.132 39.721 1.00 15.00 A O +ATOM 748 N LYS A 104 32.896 41.432 38.742 1.00 15.00 A N +ATOM 749 HN LYS A 104 33.757 41.451 38.274 1.00 15.00 A H +ATOM 750 CA LYS A 104 32.228 42.690 38.968 1.00 15.00 A C +ATOM 751 CB LYS A 104 32.642 43.452 40.217 1.00 15.00 A C +ATOM 752 CG LYS A 104 32.857 42.506 41.420 1.00 15.00 A C +ATOM 753 CD LYS A 104 34.239 41.818 41.348 1.00 15.00 A C +ATOM 754 CE LYS A 104 34.229 40.470 42.093 1.00 15.00 A C +ATOM 755 NZ LYS A 104 35.477 39.704 41.796 1.00 15.00 A N +ATOM 756 HZ1 LYS A 104 36.311 40.247 42.100 1.00 15.00 A H +ATOM 757 HZ2 LYS A 104 35.550 39.521 40.775 1.00 15.00 A H +ATOM 758 HZ3 LYS A 104 35.466 38.794 42.300 1.00 15.00 A H +ATOM 759 C LYS A 104 32.422 43.580 37.763 1.00 15.00 A C +ATOM 760 O LYS A 104 33.520 44.017 37.472 1.00 15.00 A O +ATOM 761 N ARG A 105 31.345 43.858 37.070 1.00 15.00 A N +ATOM 762 HN ARG A 105 30.482 43.478 37.337 1.00 15.00 A H +ATOM 763 CA ARG A 105 31.422 44.722 35.913 1.00 15.00 A C +ATOM 764 CB ARG A 105 30.170 44.662 35.063 1.00 15.00 A C +ATOM 765 CG ARG A 105 29.981 45.853 34.129 1.00 15.00 A C +ATOM 766 CD ARG A 105 28.582 45.813 33.476 1.00 15.00 A C +ATOM 767 NE ARG A 105 28.176 44.391 33.193 1.00 15.00 A N +ATOM 768 HE ARG A 105 28.592 43.670 33.711 1.00 15.00 A H +ATOM 769 CZ ARG A 105 27.284 44.106 32.274 1.00 15.00 A C +ATOM 770 NH1 ARG A 105 26.790 45.062 31.516 1.00 15.00 A N +ATOM 771 HH11 ARG A 105 27.107 46.044 31.645 1.00 15.00 A H +ATOM 772 HH12 ARG A 105 26.083 44.835 30.788 1.00 15.00 A H +ATOM 773 NH2 ARG A 105 26.890 42.873 32.087 1.00 15.00 A N +ATOM 774 HH21 ARG A 105 26.182 42.660 31.356 1.00 15.00 A H +ATOM 775 HH22 ARG A 105 27.283 42.107 32.666 1.00 15.00 A H +ATOM 776 C ARG A 105 31.755 46.083 36.329 1.00 15.00 A C +ATOM 777 O ARG A 105 31.069 46.672 37.144 1.00 15.00 A O +ATOM 778 N ILE A 106 32.834 46.629 35.785 1.00 15.00 A N +ATOM 779 HN ILE A 106 33.387 46.159 35.126 1.00 15.00 A H +ATOM 780 CA ILE A 106 33.127 47.940 36.226 1.00 15.00 A C +ATOM 781 CB ILE A 106 34.587 48.049 36.605 1.00 15.00 A C +ATOM 782 CG1 ILE A 106 34.931 47.101 37.746 1.00 15.00 A C +ATOM 783 CG2 ILE A 106 34.973 49.502 36.933 1.00 15.00 A C +ATOM 784 CD1 ILE A 106 34.335 47.554 39.080 1.00 15.00 A C +ATOM 785 C ILE A 106 32.774 48.896 35.118 1.00 15.00 A C +ATOM 786 O ILE A 106 32.323 49.999 35.369 1.00 15.00 A O +ATOM 787 N ALA A 107 32.968 48.498 33.880 1.00 15.00 A N +ATOM 788 HN ALA A 107 33.321 47.603 33.692 1.00 15.00 A H +ATOM 789 CA ALA A 107 32.652 49.400 32.809 1.00 15.00 A C +ATOM 790 CB ALA A 107 33.688 49.282 31.697 1.00 15.00 A C +ATOM 791 C ALA A 107 31.241 49.164 32.249 1.00 15.00 A C +ATOM 792 O ALA A 107 30.533 48.272 32.683 1.00 15.00 A O +ATOM 793 N GLU A 108 30.832 49.981 31.266 1.00 15.00 A N +ATOM 794 HN GLU A 108 31.425 50.696 30.954 1.00 15.00 A H +ATOM 795 CA GLU A 108 29.516 49.819 30.654 1.00 15.00 A C +ATOM 796 CB GLU A 108 28.666 51.102 30.727 1.00 15.00 A C +ATOM 797 CG GLU A 108 28.699 51.805 32.080 1.00 15.00 A C +ATOM 798 CD GLU A 108 27.819 53.060 31.992 1.00 15.00 A C +ATOM 799 OE1 GLU A 108 27.467 53.447 30.883 1.00 15.00 A O +ATOM 800 OE2 GLU A 108 27.503 53.607 33.039 1.00 15.00 A O +ATOM 801 C GLU A 108 29.598 49.502 29.161 1.00 15.00 A C +ATOM 802 O GLU A 108 30.503 49.943 28.485 1.00 15.00 A O +ATOM 803 N GLU A 109 28.613 48.790 28.621 1.00 15.00 A N +ATOM 804 HN GLU A 109 27.895 48.424 29.179 1.00 15.00 A H +ATOM 805 CA GLU A 109 28.624 48.563 27.164 1.00 15.00 A C +ATOM 806 CB GLU A 109 27.573 47.598 26.537 1.00 15.00 A C +ATOM 807 CG GLU A 109 27.709 46.212 27.140 1.00 15.00 A C +ATOM 808 CD GLU A 109 26.631 45.298 26.557 1.00 15.00 A C +ATOM 809 OE1 GLU A 109 25.843 45.778 25.758 1.00 15.00 A O +ATOM 810 OE2 GLU A 109 26.604 44.137 26.926 1.00 15.00 A O +ATOM 811 C GLU A 109 28.551 49.935 26.469 1.00 15.00 A C +ATOM 812 O GLU A 109 27.810 50.815 26.861 1.00 15.00 A O +ATOM 813 N GLY A 110 29.344 50.106 25.433 1.00 15.00 A N +ATOM 814 HN GLY A 110 29.921 49.362 25.161 1.00 15.00 A H +ATOM 815 CA GLY A 110 29.399 51.366 24.668 1.00 15.00 A C +ATOM 816 C GLY A 110 30.417 52.318 25.239 1.00 15.00 A C +ATOM 817 O GLY A 110 30.672 53.377 24.691 1.00 15.00 A O +ATOM 818 N GLN A 111 31.000 51.967 26.333 1.00 15.00 A N +ATOM 819 HN GLN A 111 30.777 51.119 26.771 1.00 15.00 A H +ATOM 820 CA GLN A 111 31.983 52.848 26.895 1.00 15.00 A C +ATOM 821 CB GLN A 111 32.432 52.339 28.287 1.00 15.00 A C +ATOM 822 CG GLN A 111 33.037 53.489 29.104 1.00 15.00 A C +ATOM 823 CD GLN A 111 33.268 53.040 30.542 1.00 15.00 A C +ATOM 824 OE1 GLN A 111 32.370 52.527 31.192 1.00 15.00 A O +ATOM 825 NE2 GLN A 111 34.451 53.223 31.064 1.00 15.00 A N +ATOM 826 HE21 GLN A 111 35.142 53.642 30.509 1.00 15.00 A H +ATOM 827 HE22 GLN A 111 34.599 52.934 31.989 1.00 15.00 A H +ATOM 828 C GLN A 111 33.220 52.993 26.017 1.00 15.00 A C +ATOM 829 O GLN A 111 33.776 52.043 25.495 1.00 15.00 A O +ATOM 830 N ARG A 112 33.671 54.218 25.927 1.00 15.00 A N +ATOM 831 HN ARG A 112 33.166 54.940 26.357 1.00 15.00 A H +ATOM 832 CA ARG A 112 34.866 54.540 25.229 1.00 15.00 A C +ATOM 833 CB ARG A 112 34.852 55.918 24.588 1.00 15.00 A C +ATOM 834 CG ARG A 112 35.198 55.803 23.085 1.00 15.00 A C +ATOM 835 CD ARG A 112 34.867 57.120 22.329 1.00 15.00 A C +ATOM 836 NE ARG A 112 36.005 57.637 21.512 1.00 15.00 A N +ATOM 837 HE ARG A 112 36.149 58.606 21.499 1.00 15.00 A H +ATOM 838 CZ ARG A 112 36.794 56.891 20.836 1.00 15.00 A C +ATOM 839 NH1 ARG A 112 36.488 55.623 20.643 1.00 15.00 A N +ATOM 840 HH11 ARG A 112 35.609 55.234 21.038 1.00 15.00 A H +ATOM 841 HH12 ARG A 112 37.127 55.012 20.095 1.00 15.00 A H +ATOM 842 NH2 ARG A 112 37.852 57.402 20.268 1.00 15.00 A N +ATOM 843 HH21 ARG A 112 38.055 58.417 20.365 1.00 15.00 A H +ATOM 844 HH22 ARG A 112 38.492 56.794 19.719 1.00 15.00 A H +ATOM 845 C ARG A 112 35.998 54.363 26.183 1.00 15.00 A C +ATOM 846 O ARG A 112 35.928 54.792 27.322 1.00 15.00 A O +ATOM 847 N VAL A 113 37.042 53.689 25.755 1.00 15.00 A N +ATOM 848 HN VAL A 113 37.091 53.358 24.834 1.00 15.00 A H +ATOM 849 CA VAL A 113 38.113 53.455 26.693 1.00 15.00 A C +ATOM 850 CB VAL A 113 38.091 52.029 27.244 1.00 15.00 A C +ATOM 851 CG1 VAL A 113 36.789 51.764 27.999 1.00 15.00 A C +ATOM 852 CG2 VAL A 113 38.256 51.019 26.111 1.00 15.00 A C +ATOM 853 C VAL A 113 39.448 53.595 26.089 1.00 15.00 A C +ATOM 854 O VAL A 113 39.660 53.456 24.897 1.00 15.00 A O +ATOM 855 N LYS A 114 40.358 53.787 26.977 1.00 15.00 A N +ATOM 856 HN LYS A 114 40.094 53.901 27.914 1.00 15.00 A H +ATOM 857 CA LYS A 114 41.739 53.839 26.635 1.00 15.00 A C +ATOM 858 CB LYS A 114 42.454 55.038 27.227 1.00 15.00 A C +ATOM 859 CG LYS A 114 41.910 56.369 26.670 1.00 15.00 A C +ATOM 860 CD LYS A 114 41.487 57.340 27.796 1.00 15.00 A C +ATOM 861 CE LYS A 114 40.492 56.687 28.779 1.00 15.00 A C +ATOM 862 NZ LYS A 114 40.461 57.426 30.075 1.00 15.00 A N +ATOM 863 HZ1 LYS A 114 41.405 57.422 30.512 1.00 15.00 A H +ATOM 864 HZ2 LYS A 114 39.788 56.976 30.727 1.00 15.00 A H +ATOM 865 HZ3 LYS A 114 40.168 58.412 29.918 1.00 15.00 A H +ATOM 866 C LYS A 114 42.414 52.614 27.195 1.00 15.00 A C +ATOM 867 O LYS A 114 41.971 52.030 28.169 1.00 15.00 A O +ATOM 868 N VAL A 115 43.507 52.259 26.616 1.00 15.00 A N +ATOM 869 HN VAL A 115 43.821 52.752 25.835 1.00 15.00 A H +ATOM 870 CA VAL A 115 44.274 51.158 27.108 1.00 15.00 A C +ATOM 871 CB VAL A 115 45.653 51.216 26.494 1.00 15.00 A C +ATOM 872 CG1 VAL A 115 46.467 49.992 26.928 1.00 15.00 A C +ATOM 873 CG2 VAL A 115 45.512 51.219 24.954 1.00 15.00 A C +ATOM 874 C VAL A 115 44.437 51.218 28.626 1.00 15.00 A C +ATOM 875 O VAL A 115 44.738 52.250 29.194 1.00 15.00 A O +ATOM 876 N GLY A 116 44.263 50.094 29.283 1.00 15.00 A N +ATOM 877 HN GLY A 116 44.012 49.284 28.791 1.00 15.00 A H +ATOM 878 CA GLY A 116 44.437 50.039 30.711 1.00 15.00 A C +ATOM 879 C GLY A 116 43.170 50.347 31.516 1.00 15.00 A C +ATOM 880 O GLY A 116 43.124 50.096 32.703 1.00 15.00 A O +ATOM 881 N ASP A 117 42.155 50.866 30.907 1.00 15.00 A N +ATOM 882 HN ASP A 117 42.215 51.065 29.949 1.00 15.00 A H +ATOM 883 CA ASP A 117 40.906 51.163 31.638 1.00 15.00 A C +ATOM 884 CB ASP A 117 39.916 51.977 30.757 1.00 15.00 A C +ATOM 885 CG ASP A 117 40.290 53.445 30.606 1.00 15.00 A C +ATOM 886 OD1 ASP A 117 41.131 53.929 31.350 1.00 15.00 A O +ATOM 887 OD2 ASP A 117 39.689 54.066 29.741 1.00 15.00 A O +ATOM 888 C ASP A 117 40.301 49.874 32.169 1.00 15.00 A C +ATOM 889 O ASP A 117 40.273 48.866 31.494 1.00 15.00 A O +ATOM 890 N THR A 118 39.840 49.898 33.418 1.00 15.00 A N +ATOM 891 HN THR A 118 39.870 50.728 33.938 1.00 15.00 A H +ATOM 892 CA THR A 118 39.283 48.667 34.016 1.00 15.00 A C +ATOM 893 CB THR A 118 39.280 48.644 35.577 1.00 15.00 A C +ATOM 894 OG1 THR A 118 40.573 48.983 36.052 1.00 15.00 A O +ATOM 895 HG1 THR A 118 40.503 49.350 36.936 1.00 15.00 A H +ATOM 896 CG2 THR A 118 38.881 47.270 36.127 1.00 15.00 A C +ATOM 897 C THR A 118 37.904 48.393 33.499 1.00 15.00 A C +ATOM 898 O THR A 118 37.035 49.247 33.442 1.00 15.00 A O +ATOM 899 N VAL A 119 37.729 47.154 33.115 1.00 15.00 A N +ATOM 900 HN VAL A 119 38.476 46.524 33.188 1.00 15.00 A H +ATOM 901 CA VAL A 119 36.503 46.699 32.601 1.00 15.00 A C +ATOM 902 CB VAL A 119 36.746 45.897 31.302 1.00 15.00 A C +ATOM 903 CG1 VAL A 119 35.407 45.478 30.686 1.00 15.00 A C +ATOM 904 CG2 VAL A 119 37.548 46.716 30.287 1.00 15.00 A C +ATOM 905 C VAL A 119 35.812 45.846 33.639 1.00 15.00 A C +ATOM 906 O VAL A 119 34.637 46.013 33.916 1.00 15.00 A O +ATOM 907 N ILE A 120 36.539 44.928 34.199 1.00 15.00 A N +ATOM 908 HN ILE A 120 37.487 44.859 33.959 1.00 15.00 A H +ATOM 909 CA ILE A 120 35.997 44.014 35.157 1.00 15.00 A C +ATOM 910 CB ILE A 120 35.564 42.765 34.443 1.00 15.00 A C +ATOM 911 CG1 ILE A 120 34.228 42.991 33.688 1.00 15.00 A C +ATOM 912 CG2 ILE A 120 35.419 41.584 35.433 1.00 15.00 A C +ATOM 913 CD1 ILE A 120 34.138 42.129 32.422 1.00 15.00 A C +ATOM 914 C ILE A 120 36.964 43.577 36.189 1.00 15.00 A C +ATOM 915 O ILE A 120 38.118 43.318 35.893 1.00 15.00 A O +ATOM 916 N GLU A 121 36.480 43.404 37.412 1.00 15.00 A N +ATOM 917 HN GLU A 121 35.548 43.614 37.631 1.00 15.00 A H +ATOM 918 CA GLU A 121 37.392 42.893 38.402 1.00 15.00 A C +ATOM 919 CB GLU A 121 37.539 43.810 39.621 1.00 15.00 A C +ATOM 920 CG GLU A 121 37.782 45.230 39.136 1.00 15.00 A C +ATOM 921 CD GLU A 121 37.721 46.193 40.316 1.00 15.00 A C +ATOM 922 OE1 GLU A 121 37.022 45.874 41.268 1.00 15.00 A O +ATOM 923 OE2 GLU A 121 38.371 47.225 40.255 1.00 15.00 A O +ATOM 924 C GLU A 121 36.933 41.529 38.763 1.00 15.00 A C +ATOM 925 O GLU A 121 35.761 41.230 38.715 1.00 15.00 A O +ATOM 926 N PHE A 122 37.864 40.682 39.079 1.00 15.00 A N +ATOM 927 HN PHE A 122 38.802 40.967 39.079 1.00 15.00 A H +ATOM 928 CA PHE A 122 37.530 39.336 39.427 1.00 15.00 A C +ATOM 929 CB PHE A 122 37.927 38.408 38.240 1.00 15.00 A C +ATOM 930 CG PHE A 122 39.362 38.595 37.783 1.00 15.00 A C +ATOM 931 CD1 PHE A 122 40.398 37.866 38.379 1.00 15.00 A C +ATOM 932 CD2 PHE A 122 39.645 39.440 36.703 1.00 15.00 A C +ATOM 933 CE1 PHE A 122 41.710 37.983 37.898 1.00 15.00 A C +ATOM 934 CE2 PHE A 122 40.956 39.562 36.229 1.00 15.00 A C +ATOM 935 CZ PHE A 122 41.988 38.832 36.823 1.00 15.00 A C +ATOM 936 C PHE A 122 38.257 38.884 40.709 1.00 15.00 A C +ATOM 937 O PHE A 122 39.232 39.469 41.138 1.00 15.00 A O +ATOM 938 N ASP A 123 37.753 37.805 41.274 1.00 15.00 A N +ATOM 939 HN ASP A 123 36.949 37.415 40.872 1.00 15.00 A H +ATOM 940 CA ASP A 123 38.306 37.148 42.458 1.00 15.00 A C +ATOM 941 CB ASP A 123 37.167 36.627 43.320 1.00 15.00 A C +ATOM 942 CG ASP A 123 37.636 36.259 44.727 1.00 15.00 A C +ATOM 943 OD1 ASP A 123 38.572 35.494 44.837 1.00 15.00 A O +ATOM 944 OD2 ASP A 123 37.024 36.726 45.676 1.00 15.00 A O +ATOM 945 C ASP A 123 39.124 35.922 42.037 1.00 15.00 A C +ATOM 946 O ASP A 123 38.567 34.873 41.780 1.00 15.00 A O +ATOM 947 N LEU A 124 40.408 36.025 41.937 1.00 15.00 A N +ATOM 948 HN LEU A 124 40.858 36.860 42.183 1.00 15.00 A H +ATOM 949 CA LEU A 124 41.177 34.891 41.456 1.00 15.00 A C +ATOM 950 CB LEU A 124 42.671 35.275 41.319 1.00 15.00 A C +ATOM 951 CG LEU A 124 43.506 34.374 40.342 1.00 15.00 A C +ATOM 952 CD1 LEU A 124 42.709 33.855 39.142 1.00 15.00 A C +ATOM 953 CD2 LEU A 124 44.698 35.182 39.800 1.00 15.00 A C +ATOM 954 C LEU A 124 41.061 33.622 42.262 1.00 15.00 A C +ATOM 955 O LEU A 124 40.787 32.556 41.727 1.00 15.00 A O +ATOM 956 N PRO A 125 41.317 33.692 43.480 1.00 15.00 A N +ATOM 957 CA PRO A 125 41.324 32.514 44.319 1.00 15.00 A C +ATOM 958 CB PRO A 125 41.611 33.060 45.712 1.00 15.00 A C +ATOM 959 CG PRO A 125 42.125 34.455 45.560 1.00 15.00 A C +ATOM 960 CD PRO A 125 41.571 34.943 44.249 1.00 15.00 A C +ATOM 961 C PRO A 125 39.962 31.809 44.233 1.00 15.00 A C +ATOM 962 O PRO A 125 39.886 30.604 44.076 1.00 15.00 A O +ATOM 963 N LEU A 126 38.891 32.568 44.304 1.00 15.00 A N +ATOM 964 HN LEU A 126 38.991 33.533 44.440 1.00 15.00 A H +ATOM 965 CA LEU A 126 37.557 31.995 44.183 1.00 15.00 A C +ATOM 966 CB LEU A 126 36.423 33.047 44.393 1.00 15.00 A C +ATOM 967 CG LEU A 126 35.045 32.742 43.758 1.00 15.00 A C +ATOM 968 CD1 LEU A 126 34.663 31.304 43.892 1.00 15.00 A C +ATOM 969 CD2 LEU A 126 33.954 33.569 44.457 1.00 15.00 A C +ATOM 970 C LEU A 126 37.449 31.246 42.841 1.00 15.00 A C +ATOM 971 O LEU A 126 37.058 30.091 42.795 1.00 15.00 A O +ATOM 972 N LEU A 127 37.800 31.870 41.779 1.00 15.00 A N +ATOM 973 HN LEU A 127 38.141 32.785 41.857 1.00 15.00 A H +ATOM 974 CA LEU A 127 37.708 31.261 40.455 1.00 15.00 A C +ATOM 975 CB LEU A 127 38.013 32.319 39.392 1.00 15.00 A C +ATOM 976 CG LEU A 127 37.016 33.458 39.454 1.00 15.00 A C +ATOM 977 CD1 LEU A 127 37.561 34.632 38.642 1.00 15.00 A C +ATOM 978 CD2 LEU A 127 35.699 32.990 38.839 1.00 15.00 A C +ATOM 979 C LEU A 127 38.689 30.140 40.281 1.00 15.00 A C +ATOM 980 O LEU A 127 38.451 29.195 39.551 1.00 15.00 A O +ATOM 981 N GLU A 128 39.796 30.230 40.913 1.00 15.00 A N +ATOM 982 HN GLU A 128 39.986 31.004 41.483 1.00 15.00 A H +ATOM 983 CA GLU A 128 40.757 29.171 40.770 1.00 15.00 A C +ATOM 984 CB GLU A 128 42.055 29.531 41.454 1.00 15.00 A C +ATOM 985 CG GLU A 128 43.001 30.188 40.444 1.00 15.00 A C +ATOM 986 CD GLU A 128 44.366 30.420 41.068 1.00 15.00 A C +ATOM 987 OE1 GLU A 128 44.452 30.421 42.286 1.00 15.00 A O +ATOM 988 OE2 GLU A 128 45.311 30.582 40.306 1.00 15.00 A O +ATOM 989 C GLU A 128 40.135 27.936 41.376 1.00 15.00 A C +ATOM 990 O GLU A 128 40.266 26.837 40.872 1.00 15.00 A O +ATOM 991 N GLU A 129 39.423 28.142 42.446 1.00 15.00 A N +ATOM 992 HN GLU A 129 39.354 29.048 42.814 1.00 15.00 A H +ATOM 993 CA GLU A 129 38.732 27.050 43.099 1.00 15.00 A C +ATOM 994 CB GLU A 129 38.267 27.444 44.497 1.00 15.00 A C +ATOM 995 CG GLU A 129 37.519 26.265 45.158 1.00 15.00 A C +ATOM 996 CD GLU A 129 37.663 26.311 46.681 1.00 15.00 A C +ATOM 997 OE1 GLU A 129 38.697 25.888 47.180 1.00 15.00 A O +ATOM 998 OE2 GLU A 129 36.720 26.756 47.321 1.00 15.00 A O +ATOM 999 C GLU A 129 37.481 26.600 42.359 1.00 15.00 A C +ATOM 1000 O GLU A 129 37.204 25.416 42.284 1.00 15.00 A O +ATOM 1001 N LYS A 130 36.688 27.514 41.863 1.00 15.00 A N +ATOM 1002 HN LYS A 130 36.932 28.462 41.916 1.00 15.00 A H +ATOM 1003 CA LYS A 130 35.447 27.115 41.235 1.00 15.00 A C +ATOM 1004 CB LYS A 130 34.311 28.041 41.596 1.00 15.00 A C +ATOM 1005 CG LYS A 130 34.255 28.297 43.102 1.00 15.00 A C +ATOM 1006 CD LYS A 130 32.902 27.866 43.741 1.00 15.00 A C +ATOM 1007 CE LYS A 130 33.114 26.771 44.808 1.00 15.00 A C +ATOM 1008 NZ LYS A 130 32.239 25.609 44.524 1.00 15.00 A N +ATOM 1009 HZ1 LYS A 130 31.241 25.902 44.536 1.00 15.00 A H +ATOM 1010 HZ2 LYS A 130 32.381 24.871 45.242 1.00 15.00 A H +ATOM 1011 HZ3 LYS A 130 32.462 25.214 43.588 1.00 15.00 A H +ATOM 1012 C LYS A 130 35.480 26.941 39.729 1.00 15.00 A C +ATOM 1013 O LYS A 130 34.707 26.168 39.194 1.00 15.00 A O +ATOM 1014 N ALA A 131 36.285 27.625 39.039 1.00 15.00 A N +ATOM 1015 HN ALA A 131 36.918 28.228 39.482 1.00 15.00 A H +ATOM 1016 CA ALA A 131 36.276 27.522 37.604 1.00 15.00 A C +ATOM 1017 CB ALA A 131 36.850 28.805 37.039 1.00 15.00 A C +ATOM 1018 C ALA A 131 36.974 26.294 37.033 1.00 15.00 A C +ATOM 1019 O ALA A 131 37.992 25.851 37.521 1.00 15.00 A O +ATOM 1020 N LYS A 132 36.390 25.746 35.944 1.00 15.00 A N +ATOM 1021 HN LYS A 132 35.565 26.135 35.586 1.00 15.00 A H +ATOM 1022 CA LYS A 132 36.988 24.567 35.292 1.00 15.00 A C +ATOM 1023 CB LYS A 132 36.184 24.095 34.078 1.00 15.00 A C +ATOM 1024 CG LYS A 132 36.069 22.541 33.942 1.00 15.00 A C +ATOM 1025 CD LYS A 132 36.634 21.736 35.167 1.00 15.00 A C +ATOM 1026 CE LYS A 132 37.474 20.526 34.743 1.00 15.00 A C +ATOM 1027 NZ LYS A 132 38.781 20.535 35.478 1.00 15.00 A N +ATOM 1028 HZ1 LYS A 132 39.356 19.716 35.195 1.00 15.00 A H +ATOM 1029 HZ2 LYS A 132 38.615 20.489 36.503 1.00 15.00 A H +ATOM 1030 HZ3 LYS A 132 39.307 21.406 35.262 1.00 15.00 A H +ATOM 1031 C LYS A 132 38.448 24.904 34.918 1.00 15.00 A C +ATOM 1032 O LYS A 132 39.345 24.091 35.030 1.00 15.00 A O +ATOM 1033 N SER A 133 38.647 26.115 34.502 1.00 15.00 A N +ATOM 1034 HN SER A 133 37.867 26.704 34.433 1.00 15.00 A H +ATOM 1035 CA SER A 133 39.931 26.663 34.132 1.00 15.00 A C +ATOM 1036 CB SER A 133 40.509 26.060 32.859 1.00 15.00 A C +ATOM 1037 OG SER A 133 41.475 26.946 32.315 1.00 15.00 A O +ATOM 1038 HG SER A 133 42.142 26.442 31.843 1.00 15.00 A H +ATOM 1039 C SER A 133 39.870 28.195 34.077 1.00 15.00 A C +ATOM 1040 O SER A 133 38.878 28.786 33.696 1.00 15.00 A O +ATOM 1041 N THR A 134 40.979 28.815 34.491 1.00 15.00 A N +ATOM 1042 HN THR A 134 41.726 28.260 34.798 1.00 15.00 A H +ATOM 1043 CA THR A 134 41.150 30.260 34.516 1.00 15.00 A C +ATOM 1044 CB THR A 134 41.874 30.775 35.794 1.00 15.00 A C +ATOM 1045 OG1 THR A 134 43.184 30.245 35.892 1.00 15.00 A O +ATOM 1046 HG1 THR A 134 43.805 30.955 36.070 1.00 15.00 A H +ATOM 1047 CG2 THR A 134 41.063 30.398 37.029 1.00 15.00 A C +ATOM 1048 C THR A 134 41.865 30.736 33.256 1.00 15.00 A C +ATOM 1049 O THR A 134 42.072 31.925 33.054 1.00 15.00 A O +ATOM 1050 N LEU A 135 42.206 29.818 32.401 1.00 15.00 A N +ATOM 1051 HN LEU A 135 42.034 28.876 32.611 1.00 15.00 A H +ATOM 1052 CA LEU A 135 42.851 30.172 31.114 1.00 15.00 A C +ATOM 1053 CB LEU A 135 43.095 28.940 30.251 1.00 15.00 A C +ATOM 1054 CG LEU A 135 44.416 28.300 30.651 1.00 15.00 A C +ATOM 1055 CD1 LEU A 135 44.591 26.988 29.885 1.00 15.00 A C +ATOM 1056 CD2 LEU A 135 45.557 29.279 30.307 1.00 15.00 A C +ATOM 1057 C LEU A 135 41.913 31.153 30.389 1.00 15.00 A C +ATOM 1058 O LEU A 135 40.726 30.939 30.301 1.00 15.00 A O +ATOM 1059 N THR A 136 42.473 32.242 29.937 1.00 15.00 A N +ATOM 1060 HN THR A 136 43.448 32.309 30.010 1.00 15.00 A H +ATOM 1061 CA THR A 136 41.782 33.346 29.344 1.00 15.00 A C +ATOM 1062 CB THR A 136 41.979 34.564 30.264 1.00 15.00 A C +ATOM 1063 OG1 THR A 136 41.442 34.245 31.535 1.00 15.00 A O +ATOM 1064 HG1 THR A 136 41.550 33.306 31.702 1.00 15.00 A H +ATOM 1065 CG2 THR A 136 41.284 35.808 29.710 1.00 15.00 A C +ATOM 1066 C THR A 136 42.107 33.703 27.925 1.00 15.00 A C +ATOM 1067 O THR A 136 43.071 34.393 27.654 1.00 15.00 A O +ATOM 1068 N PRO A 137 41.300 33.226 26.972 1.00 15.00 A N +ATOM 1069 CA PRO A 137 41.627 33.557 25.602 1.00 15.00 A C +ATOM 1070 CB PRO A 137 40.575 32.831 24.752 1.00 15.00 A C +ATOM 1071 CG PRO A 137 39.806 31.908 25.652 1.00 15.00 A C +ATOM 1072 CD PRO A 137 40.193 32.244 27.090 1.00 15.00 A C +ATOM 1073 C PRO A 137 41.482 35.037 25.259 1.00 15.00 A C +ATOM 1074 O PRO A 137 40.543 35.699 25.661 1.00 15.00 A O +ATOM 1075 N VAL A 138 42.378 35.502 24.445 1.00 15.00 A N +ATOM 1076 HN VAL A 138 43.122 34.923 24.188 1.00 15.00 A H +ATOM 1077 CA VAL A 138 42.320 36.835 23.901 1.00 15.00 A C +ATOM 1078 CB VAL A 138 43.214 37.878 24.539 1.00 15.00 A C +ATOM 1079 CG1 VAL A 138 43.769 37.357 25.865 1.00 15.00 A C +ATOM 1080 CG2 VAL A 138 44.313 38.336 23.583 1.00 15.00 A C +ATOM 1081 C VAL A 138 42.399 36.658 22.428 1.00 15.00 A C +ATOM 1082 O VAL A 138 43.421 36.318 21.880 1.00 15.00 A O +ATOM 1083 N VAL A 139 41.243 36.821 21.765 1.00 15.00 A N +ATOM 1084 HN VAL A 139 40.425 37.090 22.233 1.00 15.00 A H +ATOM 1085 CA VAL A 139 41.244 36.590 20.358 1.00 15.00 A C +ATOM 1086 CB VAL A 139 40.539 35.280 19.995 1.00 15.00 A C +ATOM 1087 CG1 VAL A 139 41.143 34.120 20.758 1.00 15.00 A C +ATOM 1088 CG2 VAL A 139 39.051 35.382 20.312 1.00 15.00 A C +ATOM 1089 C VAL A 139 40.768 37.743 19.486 1.00 15.00 A C +ATOM 1090 O VAL A 139 40.067 38.649 19.901 1.00 15.00 A O +ATOM 1091 N ILE A 140 41.200 37.661 18.208 1.00 15.00 A N +ATOM 1092 HN ILE A 140 41.777 36.912 17.949 1.00 15.00 A H +ATOM 1093 CA ILE A 140 40.839 38.640 17.215 1.00 15.00 A C +ATOM 1094 CB ILE A 140 41.989 39.038 16.255 1.00 15.00 A C +ATOM 1095 CG1 ILE A 140 42.891 40.102 16.887 1.00 15.00 A C +ATOM 1096 CG2 ILE A 140 41.420 39.645 14.972 1.00 15.00 A C +ATOM 1097 CD1 ILE A 140 43.617 39.570 18.119 1.00 15.00 A C +ATOM 1098 C ILE A 140 39.691 38.029 16.485 1.00 15.00 A C +ATOM 1099 O ILE A 140 39.773 36.909 16.028 1.00 15.00 A O +ATOM 1100 N SER A 141 38.606 38.735 16.420 1.00 15.00 A N +ATOM 1101 HN SER A 141 38.596 39.645 16.784 1.00 15.00 A H +ATOM 1102 CA SER A 141 37.412 38.192 15.816 1.00 15.00 A C +ATOM 1103 CB SER A 141 36.167 38.436 16.665 1.00 15.00 A C +ATOM 1104 OG SER A 141 35.786 39.801 16.558 1.00 15.00 A O +ATOM 1105 HG SER A 141 34.888 39.858 16.225 1.00 15.00 A H +ATOM 1106 C SER A 141 37.215 38.653 14.333 1.00 15.00 A C +ATOM 1107 O SER A 141 36.312 38.250 13.626 1.00 15.00 A O +ATOM 1108 N ASN A 142 38.075 39.484 13.944 1.00 15.00 A N +ATOM 1109 HN ASN A 142 38.749 39.725 14.613 1.00 15.00 A H +ATOM 1110 CA ASN A 142 38.226 40.144 12.655 1.00 15.00 A C +ATOM 1111 CB ASN A 142 39.006 41.423 13.072 1.00 15.00 A C +ATOM 1112 CG ASN A 142 38.203 42.661 12.706 1.00 15.00 A C +ATOM 1113 OD1 ASN A 142 38.670 43.768 12.863 1.00 15.00 A O +ATOM 1114 ND2 ASN A 142 36.997 42.519 12.235 1.00 15.00 A N +ATOM 1115 HD21 ASN A 142 36.645 41.610 12.131 1.00 15.00 A H +ATOM 1116 HD22 ASN A 142 36.492 43.327 12.004 1.00 15.00 A H +ATOM 1117 C ASN A 142 39.261 39.480 11.712 1.00 15.00 A C +ATOM 1118 O ASN A 142 39.740 40.123 10.795 1.00 15.00 A O +ATOM 1119 N MET A 143 39.670 38.294 11.973 1.00 15.00 A N +ATOM 1120 HN MET A 143 39.261 37.796 12.712 1.00 15.00 A H +ATOM 1121 CA MET A 143 40.724 37.675 11.198 1.00 15.00 A C +ATOM 1122 CB MET A 143 40.833 36.159 11.443 1.00 15.00 A C +ATOM 1123 CG MET A 143 41.387 35.772 12.829 1.00 15.00 A C +ATOM 1124 SD MET A 143 42.837 36.758 13.309 1.00 15.00 A S +ATOM 1125 CE MET A 143 44.113 35.861 12.380 1.00 15.00 A C +ATOM 1126 C MET A 143 40.762 38.056 9.693 1.00 15.00 A C +ATOM 1127 O MET A 143 41.817 38.359 9.160 1.00 15.00 A O +ATOM 1128 N ASP A 144 39.701 38.073 9.029 1.00 15.00 A N +ATOM 1129 HN ASP A 144 38.859 37.837 9.471 1.00 15.00 A H +ATOM 1130 CA ASP A 144 39.682 38.433 7.618 1.00 15.00 A C +ATOM 1131 CB ASP A 144 38.320 38.115 6.946 1.00 15.00 A C +ATOM 1132 CG ASP A 144 38.117 36.599 6.895 1.00 15.00 A C +ATOM 1133 OD1 ASP A 144 39.075 35.885 7.142 1.00 15.00 A O +ATOM 1134 OD2 ASP A 144 37.008 36.179 6.609 1.00 15.00 A O +ATOM 1135 C ASP A 144 40.100 39.857 7.366 1.00 15.00 A C +ATOM 1136 O ASP A 144 40.334 40.192 6.221 1.00 15.00 A O +ATOM 1137 N GLU A 145 40.218 40.717 8.354 1.00 15.00 A N +ATOM 1138 HN GLU A 145 40.035 40.458 9.278 1.00 15.00 A H +ATOM 1139 CA GLU A 145 40.632 42.069 8.015 1.00 15.00 A C +ATOM 1140 CB GLU A 145 39.708 43.156 8.624 1.00 15.00 A C +ATOM 1141 CG GLU A 145 38.232 42.752 8.480 1.00 15.00 A C +ATOM 1142 CD GLU A 145 37.345 43.689 9.311 1.00 15.00 A C +ATOM 1143 OE1 GLU A 145 37.840 44.728 9.730 1.00 15.00 A O +ATOM 1144 OE2 GLU A 145 36.188 43.349 9.521 1.00 15.00 A O +ATOM 1145 C GLU A 145 42.035 42.322 8.408 1.00 15.00 A C +ATOM 1146 O GLU A 145 42.451 43.469 8.423 1.00 15.00 A O +ATOM 1147 N ILE A 146 42.798 41.309 8.750 1.00 15.00 A N +ATOM 1148 HN ILE A 146 42.479 40.383 8.714 1.00 15.00 A H +ATOM 1149 CA ILE A 146 44.132 41.641 9.181 1.00 15.00 A C +ATOM 1150 CB ILE A 146 44.322 41.388 10.685 1.00 15.00 A C +ATOM 1151 CG1 ILE A 146 44.518 39.888 10.947 1.00 15.00 A C +ATOM 1152 CG2 ILE A 146 43.131 41.888 11.516 1.00 15.00 A C +ATOM 1153 CD1 ILE A 146 45.441 39.715 12.134 1.00 15.00 A C +ATOM 1154 C ILE A 146 45.224 41.015 8.339 1.00 15.00 A C +ATOM 1155 O ILE A 146 45.151 39.886 7.894 1.00 15.00 A O +ATOM 1156 N LYS A 147 46.267 41.806 8.113 1.00 15.00 A N +ATOM 1157 HN LYS A 147 46.284 42.713 8.484 1.00 15.00 A H +ATOM 1158 CA LYS A 147 47.392 41.323 7.309 1.00 15.00 A C +ATOM 1159 CB LYS A 147 48.194 42.424 6.592 1.00 15.00 A C +ATOM 1160 CG LYS A 147 48.813 41.956 5.239 1.00 15.00 A C +ATOM 1161 CD LYS A 147 47.756 41.372 4.248 1.00 15.00 A C +ATOM 1162 CE LYS A 147 48.376 41.134 2.853 1.00 15.00 A C +ATOM 1163 NZ LYS A 147 47.694 39.996 2.150 1.00 15.00 A N +ATOM 1164 HZ1 LYS A 147 46.682 40.206 2.029 1.00 15.00 A H +ATOM 1165 HZ2 LYS A 147 47.791 39.123 2.706 1.00 15.00 A H +ATOM 1166 HZ3 LYS A 147 48.122 39.847 1.214 1.00 15.00 A H +ATOM 1167 C LYS A 147 48.220 40.338 8.121 1.00 15.00 A C +ATOM 1168 O LYS A 147 48.397 39.207 7.693 1.00 15.00 A O +ATOM 1169 N GLU A 148 48.692 40.671 9.274 1.00 15.00 A N +ATOM 1170 HN GLU A 148 48.563 41.575 9.629 1.00 15.00 A H +ATOM 1171 CA GLU A 148 49.415 39.676 10.028 1.00 15.00 A C +ATOM 1172 CB GLU A 148 50.905 39.513 9.649 1.00 15.00 A C +ATOM 1173 CG GLU A 148 51.255 38.040 9.229 1.00 15.00 A C +ATOM 1174 CD GLU A 148 51.972 37.967 7.866 1.00 15.00 A C +ATOM 1175 OE1 GLU A 148 52.606 38.936 7.475 1.00 15.00 A O +ATOM 1176 OE2 GLU A 148 51.868 36.915 7.238 1.00 15.00 A O +ATOM 1177 C GLU A 148 49.258 39.805 11.526 1.00 15.00 A C +ATOM 1178 O GLU A 148 49.166 40.857 12.099 1.00 15.00 A O +ATOM 1179 N LEU A 149 49.258 38.620 12.107 1.00 15.00 A N +ATOM 1180 HN LEU A 149 49.315 37.836 11.521 1.00 15.00 A H +ATOM 1181 CA LEU A 149 49.183 38.379 13.500 1.00 15.00 A C +ATOM 1182 CB LEU A 149 47.959 37.504 13.799 1.00 15.00 A C +ATOM 1183 CG LEU A 149 47.313 37.817 15.166 1.00 15.00 A C +ATOM 1184 CD1 LEU A 149 45.790 37.715 15.048 1.00 15.00 A C +ATOM 1185 CD2 LEU A 149 47.794 36.801 16.198 1.00 15.00 A C +ATOM 1186 C LEU A 149 50.482 37.710 13.986 1.00 15.00 A C +ATOM 1187 O LEU A 149 50.785 36.571 13.679 1.00 15.00 A O +ATOM 1188 N ILE A 150 51.214 38.454 14.774 1.00 15.00 A N +ATOM 1189 HN ILE A 150 50.905 39.365 14.961 1.00 15.00 A H +ATOM 1190 CA ILE A 150 52.468 38.014 15.396 1.00 15.00 A C +ATOM 1191 CB ILE A 150 53.556 39.060 15.182 1.00 15.00 A C +ATOM 1192 CG1 ILE A 150 53.688 39.309 13.671 1.00 15.00 A C +ATOM 1193 CG2 ILE A 150 54.891 38.628 15.810 1.00 15.00 A C +ATOM 1194 CD1 ILE A 150 54.722 40.399 13.371 1.00 15.00 A C +ATOM 1195 C ILE A 150 52.210 37.832 16.902 1.00 15.00 A C +ATOM 1196 O ILE A 150 51.965 38.778 17.624 1.00 15.00 A O +ATOM 1197 N LYS A 151 52.260 36.604 17.342 1.00 15.00 A N +ATOM 1198 HN LYS A 151 52.467 35.896 16.697 1.00 15.00 A H +ATOM 1199 CA LYS A 151 52.029 36.215 18.723 1.00 15.00 A C +ATOM 1200 CB LYS A 151 51.425 34.806 18.827 1.00 15.00 A C +ATOM 1201 CG LYS A 151 50.160 34.638 17.970 1.00 15.00 A C +ATOM 1202 CD LYS A 151 49.438 33.319 18.349 1.00 15.00 A C +ATOM 1203 CE LYS A 151 48.354 32.961 17.303 1.00 15.00 A C +ATOM 1204 NZ LYS A 151 48.243 31.478 17.148 1.00 15.00 A N +ATOM 1205 HZ1 LYS A 151 47.513 31.246 16.444 1.00 15.00 A H +ATOM 1206 HZ2 LYS A 151 47.984 31.042 18.056 1.00 15.00 A H +ATOM 1207 HZ3 LYS A 151 49.152 31.083 16.833 1.00 15.00 A H +ATOM 1208 C LYS A 151 53.252 36.322 19.582 1.00 15.00 A C +ATOM 1209 O LYS A 151 54.316 35.829 19.253 1.00 15.00 A O +ATOM 1210 N LEU A 152 53.085 36.989 20.730 1.00 15.00 A N +ATOM 1211 HN LEU A 152 52.208 37.358 20.965 1.00 15.00 A H +ATOM 1212 CA LEU A 152 54.188 37.156 21.603 1.00 15.00 A C +ATOM 1213 CB LEU A 152 54.404 38.574 22.119 1.00 15.00 A C +ATOM 1214 CG LEU A 152 54.400 39.558 20.974 1.00 15.00 A C +ATOM 1215 CD1 LEU A 152 54.413 40.975 21.550 1.00 15.00 A C +ATOM 1216 CD2 LEU A 152 55.651 39.314 20.125 1.00 15.00 A C +ATOM 1217 C LEU A 152 54.241 36.105 22.653 1.00 15.00 A C +ATOM 1218 O LEU A 152 53.429 35.204 22.721 1.00 15.00 A O +ATOM 1219 N SER A 153 55.289 36.184 23.411 1.00 15.00 A N +ATOM 1220 HN SER A 153 55.899 36.943 23.303 1.00 15.00 A H +ATOM 1221 CA SER A 153 55.585 35.175 24.419 1.00 15.00 A C +ATOM 1222 CB SER A 153 56.882 34.538 23.944 1.00 15.00 A C +ATOM 1223 OG SER A 153 56.605 33.262 23.391 1.00 15.00 A O +ATOM 1224 HG SER A 153 56.961 32.580 23.965 1.00 15.00 A H +ATOM 1225 C SER A 153 55.921 35.736 25.815 1.00 15.00 A C +ATOM 1226 O SER A 153 56.357 36.865 25.956 1.00 15.00 A O +ATOM 1227 N GLY A 154 55.803 34.890 26.850 1.00 15.00 A N +ATOM 1228 HN GLY A 154 55.438 33.992 26.704 1.00 15.00 A H +ATOM 1229 CA GLY A 154 56.217 35.305 28.186 1.00 15.00 A C +ATOM 1230 C GLY A 154 55.149 35.758 29.183 1.00 15.00 A C +ATOM 1231 O GLY A 154 53.973 35.453 29.106 1.00 15.00 A O +ATOM 1232 N SER A 155 55.657 36.509 30.152 1.00 15.00 A N +ATOM 1233 HN SER A 155 56.617 36.703 30.125 1.00 15.00 A H +ATOM 1234 CA SER A 155 54.883 37.062 31.250 1.00 15.00 A C +ATOM 1235 CB SER A 155 55.730 37.023 32.509 1.00 15.00 A C +ATOM 1236 OG SER A 155 56.849 36.179 32.280 1.00 15.00 A O +ATOM 1237 HG SER A 155 57.439 36.594 31.647 1.00 15.00 A H +ATOM 1238 C SER A 155 54.448 38.474 30.916 1.00 15.00 A C +ATOM 1239 O SER A 155 55.174 39.219 30.291 1.00 15.00 A O +ATOM 1240 N VAL A 156 53.244 38.841 31.305 1.00 15.00 A N +ATOM 1241 HN VAL A 156 52.683 38.224 31.819 1.00 15.00 A H +ATOM 1242 CA VAL A 156 52.757 40.152 30.971 1.00 15.00 A C +ATOM 1243 CB VAL A 156 51.662 40.111 29.908 1.00 15.00 A C +ATOM 1244 CG1 VAL A 156 52.306 39.681 28.564 1.00 15.00 A C +ATOM 1245 CG2 VAL A 156 50.615 39.061 30.319 1.00 15.00 A C +ATOM 1246 C VAL A 156 52.195 40.793 32.155 1.00 15.00 A C +ATOM 1247 O VAL A 156 51.825 40.167 33.132 1.00 15.00 A O +ATOM 1248 N THR A 157 52.128 42.060 32.043 1.00 15.00 A N +ATOM 1249 HN THR A 157 52.435 42.488 31.217 1.00 15.00 A H +ATOM 1250 CA THR A 157 51.621 42.854 33.086 1.00 15.00 A C +ATOM 1251 CB THR A 157 52.814 43.687 33.679 1.00 15.00 A C +ATOM 1252 OG1 THR A 157 53.704 42.823 34.376 1.00 15.00 A O +ATOM 1253 HG1 THR A 157 53.735 43.075 35.302 1.00 15.00 A H +ATOM 1254 CG2 THR A 157 52.306 44.782 34.617 1.00 15.00 A C +ATOM 1255 C THR A 157 50.437 43.677 32.535 1.00 15.00 A C +ATOM 1256 O THR A 157 50.551 44.402 31.568 1.00 15.00 A O +ATOM 1257 N VAL A 158 49.287 43.519 33.190 1.00 15.00 A N +ATOM 1258 HN VAL A 158 49.267 42.899 33.949 1.00 15.00 A H +ATOM 1259 CA VAL A 158 48.065 44.213 32.842 1.00 15.00 A C +ATOM 1260 CB VAL A 158 47.008 44.118 33.989 1.00 15.00 A C +ATOM 1261 CG1 VAL A 158 47.440 44.858 35.261 1.00 15.00 A C +ATOM 1262 CG2 VAL A 158 45.663 44.681 33.534 1.00 15.00 A C +ATOM 1263 C VAL A 158 48.280 45.658 32.379 1.00 15.00 A C +ATOM 1264 O VAL A 158 48.818 46.512 33.059 1.00 15.00 A O +ATOM 1265 N GLY A 159 47.774 45.894 31.171 1.00 15.00 A N +ATOM 1266 HN GLY A 159 47.382 45.143 30.679 1.00 15.00 A H +ATOM 1267 CA GLY A 159 47.775 47.199 30.555 1.00 15.00 A C +ATOM 1268 C GLY A 159 49.132 47.767 30.333 1.00 15.00 A C +ATOM 1269 O GLY A 159 49.292 48.974 30.246 1.00 15.00 A O +ATOM 1270 N GLU A 160 50.102 46.930 30.208 1.00 15.00 A N +ATOM 1271 HN GLU A 160 49.934 45.967 30.277 1.00 15.00 A H +ATOM 1272 CA GLU A 160 51.429 47.415 29.968 1.00 15.00 A C +ATOM 1273 CB GLU A 160 52.248 47.340 31.282 1.00 15.00 A C +ATOM 1274 CG GLU A 160 53.327 48.453 31.361 1.00 15.00 A C +ATOM 1275 CD GLU A 160 52.979 49.457 32.467 1.00 15.00 A C +ATOM 1276 OE1 GLU A 160 53.191 49.135 33.627 1.00 15.00 A O +ATOM 1277 OE2 GLU A 160 52.500 50.530 32.126 1.00 15.00 A O +ATOM 1278 C GLU A 160 52.148 46.603 28.893 1.00 15.00 A C +ATOM 1279 O GLU A 160 52.697 47.132 27.949 1.00 15.00 A O +ATOM 1280 N THR A 161 52.183 45.334 29.072 1.00 15.00 A N +ATOM 1281 HN THR A 161 51.705 44.947 29.835 1.00 15.00 A H +ATOM 1282 CA THR A 161 52.912 44.455 28.174 1.00 15.00 A C +ATOM 1283 CB THR A 161 53.310 43.175 28.940 1.00 15.00 A C +ATOM 1284 OG1 THR A 161 53.855 43.524 30.205 1.00 15.00 A O +ATOM 1285 HG1 THR A 161 54.408 44.303 30.112 1.00 15.00 A H +ATOM 1286 CG2 THR A 161 54.362 42.425 28.121 1.00 15.00 A C +ATOM 1287 C THR A 161 52.121 44.024 26.943 1.00 15.00 A C +ATOM 1288 O THR A 161 51.070 43.422 27.059 1.00 15.00 A O +ATOM 1289 N PRO A 162 52.667 44.304 25.759 1.00 15.00 A N +ATOM 1290 CA PRO A 162 52.054 43.911 24.481 1.00 15.00 A C +ATOM 1291 CB PRO A 162 52.967 44.464 23.369 1.00 15.00 A C +ATOM 1292 CG PRO A 162 54.053 45.268 24.027 1.00 15.00 A C +ATOM 1293 CD PRO A 162 53.914 45.097 25.539 1.00 15.00 A C +ATOM 1294 C PRO A 162 51.973 42.376 24.394 1.00 15.00 A C +ATOM 1295 O PRO A 162 52.879 41.690 24.826 1.00 15.00 A O +ATOM 1296 N VAL A 163 50.898 41.839 23.845 1.00 15.00 A N +ATOM 1297 HN VAL A 163 50.188 42.426 23.512 1.00 15.00 A H +ATOM 1298 CA VAL A 163 50.741 40.376 23.721 1.00 15.00 A C +ATOM 1299 CB VAL A 163 49.513 39.870 24.450 1.00 15.00 A C +ATOM 1300 CG1 VAL A 163 49.604 40.237 25.923 1.00 15.00 A C +ATOM 1301 CG2 VAL A 163 48.247 40.480 23.839 1.00 15.00 A C +ATOM 1302 C VAL A 163 50.675 39.921 22.255 1.00 15.00 A C +ATOM 1303 O VAL A 163 51.040 38.807 21.920 1.00 15.00 A O +ATOM 1304 N ILE A 164 50.212 40.773 21.405 1.00 15.00 A N +ATOM 1305 HN ILE A 164 49.924 41.648 21.739 1.00 15.00 A H +ATOM 1306 CA ILE A 164 50.093 40.513 19.989 1.00 15.00 A C +ATOM 1307 CB ILE A 164 48.668 40.084 19.615 1.00 15.00 A C +ATOM 1308 CG1 ILE A 164 48.288 38.723 20.251 1.00 15.00 A C +ATOM 1309 CG2 ILE A 164 48.507 39.982 18.100 1.00 15.00 A C +ATOM 1310 CD1 ILE A 164 46.759 38.615 20.451 1.00 15.00 A C +ATOM 1311 C ILE A 164 50.470 41.796 19.222 1.00 15.00 A C +ATOM 1312 O ILE A 164 50.278 42.899 19.692 1.00 15.00 A O +ATOM 1313 N ARG A 165 50.980 41.619 18.033 1.00 15.00 A N +ATOM 1314 HN ARG A 165 51.130 40.698 17.735 1.00 15.00 A H +ATOM 1315 CA ARG A 165 51.338 42.683 17.127 1.00 15.00 A C +ATOM 1316 CB ARG A 165 52.843 42.705 16.939 1.00 15.00 A C +ATOM 1317 CG ARG A 165 53.457 43.926 17.644 1.00 15.00 A C +ATOM 1318 CD ARG A 165 54.977 43.775 17.826 1.00 15.00 A C +ATOM 1319 NE ARG A 165 55.430 44.678 18.923 1.00 15.00 A N +ATOM 1320 HE ARG A 165 55.093 45.598 18.935 1.00 15.00 A H +ATOM 1321 CZ ARG A 165 56.251 44.285 19.856 1.00 15.00 A C +ATOM 1322 NH1 ARG A 165 56.703 43.062 19.885 1.00 15.00 A N +ATOM 1323 HH11 ARG A 165 57.357 42.767 20.638 1.00 15.00 A H +ATOM 1324 HH12 ARG A 165 56.409 42.382 19.156 1.00 15.00 A H +ATOM 1325 NH2 ARG A 165 56.599 45.114 20.801 1.00 15.00 A N +ATOM 1326 HH21 ARG A 165 57.254 44.806 21.548 1.00 15.00 A H +ATOM 1327 HH22 ARG A 165 56.222 46.083 20.807 1.00 15.00 A H +ATOM 1328 C ARG A 165 50.615 42.385 15.841 1.00 15.00 A C +ATOM 1329 O ARG A 165 50.642 41.263 15.363 1.00 15.00 A O +ATOM 1330 N ILE A 166 49.937 43.347 15.290 1.00 15.00 A N +ATOM 1331 HN ILE A 166 49.927 44.241 15.690 1.00 15.00 A H +ATOM 1332 CA ILE A 166 49.193 43.076 14.070 1.00 15.00 A C +ATOM 1333 CB ILE A 166 47.658 43.137 14.227 1.00 15.00 A C +ATOM 1334 CG1 ILE A 166 47.271 44.427 14.763 1.00 15.00 A C +ATOM 1335 CG2 ILE A 166 47.108 42.037 15.148 1.00 15.00 A C +ATOM 1336 CD1 ILE A 166 45.762 44.553 14.734 1.00 15.00 A C +ATOM 1337 C ILE A 166 49.545 44.092 13.025 1.00 15.00 A C +ATOM 1338 O ILE A 166 49.914 45.199 13.332 1.00 15.00 A O +ATOM 1339 N LYS A 167 49.368 43.722 11.796 1.00 15.00 A N +ATOM 1340 HN LYS A 167 49.072 42.806 11.614 1.00 15.00 A H +ATOM 1341 CA LYS A 167 49.594 44.620 10.682 1.00 15.00 A C +ATOM 1342 CB LYS A 167 50.776 44.251 9.778 1.00 15.00 A C +ATOM 1343 CG LYS A 167 51.482 45.521 9.247 1.00 15.00 A C +ATOM 1344 CD LYS A 167 52.981 45.240 8.945 1.00 15.00 A C +ATOM 1345 CE LYS A 167 53.361 45.731 7.539 1.00 15.00 A C +ATOM 1346 NZ LYS A 167 54.487 44.919 7.009 1.00 15.00 A N +ATOM 1347 HZ1 LYS A 167 55.315 45.006 7.633 1.00 15.00 A H +ATOM 1348 HZ2 LYS A 167 54.748 45.247 6.058 1.00 15.00 A H +ATOM 1349 HZ3 LYS A 167 54.211 43.918 6.954 1.00 15.00 A H +ATOM 1350 C LYS A 167 48.302 44.763 9.890 1.00 15.00 A C +ATOM 1351 O LYS A 167 47.442 43.904 9.923 1.00 15.00 A O +ATOM 1352 N LYS A 168 48.170 45.888 9.208 1.00 15.00 A N +ATOM 1353 HN LYS A 168 48.909 46.532 9.218 1.00 15.00 A H +ATOM 1354 CA LYS A 168 46.969 46.212 8.440 1.00 15.00 A C +ATOM 1355 CB LYS A 168 47.014 45.719 6.995 1.00 15.00 A C +ATOM 1356 CG LYS A 168 45.594 45.584 6.346 1.00 15.00 A C +ATOM 1357 CD LYS A 168 45.496 44.324 5.461 1.00 15.00 A C +ATOM 1358 CE LYS A 168 44.107 44.222 4.824 1.00 15.00 A C +ATOM 1359 NZ LYS A 168 43.803 42.803 4.459 1.00 15.00 A N +ATOM 1360 HZ1 LYS A 168 42.859 42.740 4.027 1.00 15.00 A H +ATOM 1361 HZ2 LYS A 168 43.824 42.203 5.308 1.00 15.00 A H +ATOM 1362 HZ3 LYS A 168 44.508 42.450 3.781 1.00 15.00 A H +ATOM 1363 C LYS A 168 45.738 45.676 9.191 1.00 15.00 A C +ATOM 1364 O LYS A 168 45.202 46.340 10.079 1.00 15.00 A O +ATOM 1365 N MET B 1 13.639 37.821 -0.846 1.00 15.00 B N +ATOM 1366 HN MET B 1 13.367 38.711 -1.154 1.00 15.00 B H +ATOM 1367 CA MET B 1 14.123 37.656 0.530 1.00 15.00 B C +ATOM 1368 CB MET B 1 14.116 39.022 1.227 1.00 15.00 B C +ATOM 1369 CG MET B 1 13.755 38.872 2.711 1.00 15.00 B C +ATOM 1370 SD MET B 1 13.906 40.480 3.509 1.00 15.00 B S +ATOM 1371 CE MET B 1 15.668 40.712 3.151 1.00 15.00 B C +ATOM 1372 C MET B 1 13.201 36.682 1.252 1.00 15.00 B C +ATOM 1373 O MET B 1 12.049 36.500 0.900 1.00 15.00 B O +ATOM 1374 N PHE B 2 13.709 36.079 2.279 1.00 15.00 B N +ATOM 1375 HN PHE B 2 14.639 36.254 2.533 1.00 15.00 B H +ATOM 1376 CA PHE B 2 12.907 35.138 3.066 1.00 15.00 B C +ATOM 1377 CB PHE B 2 13.200 33.779 2.434 1.00 15.00 B C +ATOM 1378 CG PHE B 2 12.433 32.720 3.155 1.00 15.00 B C +ATOM 1379 CD1 PHE B 2 11.049 32.687 3.040 1.00 15.00 B C +ATOM 1380 CD2 PHE B 2 13.098 31.779 3.926 1.00 15.00 B C +ATOM 1381 CE1 PHE B 2 10.319 31.700 3.699 1.00 15.00 B C +ATOM 1382 CE2 PHE B 2 12.381 30.780 4.586 1.00 15.00 B C +ATOM 1383 CZ PHE B 2 10.989 30.741 4.471 1.00 15.00 B C +ATOM 1384 C PHE B 2 13.306 35.323 4.540 1.00 15.00 B C +ATOM 1385 O PHE B 2 14.460 35.552 4.851 1.00 15.00 B O +ATOM 1386 N GLN B 3 12.352 35.266 5.454 1.00 15.00 B N +ATOM 1387 HN GLN B 3 11.426 35.095 5.181 1.00 15.00 B H +ATOM 1388 CA GLN B 3 12.674 35.459 6.891 1.00 15.00 B C +ATOM 1389 CB GLN B 3 12.681 36.930 7.295 1.00 15.00 B C +ATOM 1390 CG GLN B 3 11.407 37.762 7.085 1.00 15.00 B C +ATOM 1391 CD GLN B 3 11.836 39.239 7.246 1.00 15.00 B C +ATOM 1392 OE1 GLN B 3 11.476 39.903 8.199 1.00 15.00 B O +ATOM 1393 NE2 GLN B 3 12.552 39.790 6.309 1.00 15.00 B N +ATOM 1394 HE21 GLN B 3 12.795 39.245 5.531 1.00 15.00 B H +ATOM 1395 HE22 GLN B 3 12.819 40.726 6.421 1.00 15.00 B H +ATOM 1396 C GLN B 3 11.679 34.676 7.745 1.00 15.00 B C +ATOM 1397 O GLN B 3 10.579 34.357 7.327 1.00 15.00 B O +ATOM 1398 N GLN B 4 12.076 34.372 8.937 1.00 15.00 B N +ATOM 1399 HN GLN B 4 12.969 34.655 9.225 1.00 15.00 B H +ATOM 1400 CA GLN B 4 11.223 33.607 9.889 1.00 15.00 B C +ATOM 1401 CB GLN B 4 11.427 32.077 9.744 1.00 15.00 B C +ATOM 1402 CG GLN B 4 10.982 31.455 8.393 1.00 15.00 B C +ATOM 1403 CD GLN B 4 9.480 31.254 8.482 1.00 15.00 B C +ATOM 1404 OE1 GLN B 4 9.028 30.209 8.927 1.00 15.00 B O +ATOM 1405 NE2 GLN B 4 8.689 32.120 7.931 1.00 15.00 B N +ATOM 1406 HE21 GLN B 4 9.090 32.886 7.469 1.00 15.00 B H +ATOM 1407 HE22 GLN B 4 7.722 31.973 7.999 1.00 15.00 B H +ATOM 1408 C GLN B 4 11.665 34.006 11.311 1.00 15.00 B C +ATOM 1409 O GLN B 4 12.827 34.277 11.539 1.00 15.00 B O +ATOM 1410 N GLU B 5 10.758 34.025 12.256 1.00 15.00 B N +ATOM 1411 HN GLU B 5 9.829 33.812 12.028 1.00 15.00 B H +ATOM 1412 CA GLU B 5 11.095 34.358 13.653 1.00 15.00 B C +ATOM 1413 CB GLU B 5 9.874 34.978 14.380 1.00 15.00 B C +ATOM 1414 CG GLU B 5 9.987 36.511 14.541 1.00 15.00 B C +ATOM 1415 CD GLU B 5 8.615 37.199 14.486 1.00 15.00 B C +ATOM 1416 OE1 GLU B 5 7.900 37.012 13.513 1.00 15.00 B O +ATOM 1417 OE2 GLU B 5 8.314 37.926 15.424 1.00 15.00 B O +ATOM 1418 C GLU B 5 11.365 33.050 14.409 1.00 15.00 B C +ATOM 1419 O GLU B 5 10.768 32.028 14.115 1.00 15.00 B O +ATOM 1420 N VAL B 6 12.181 33.091 15.425 1.00 15.00 B N +ATOM 1421 HN VAL B 6 12.656 33.922 15.636 1.00 15.00 B H +ATOM 1422 CA VAL B 6 12.393 31.890 16.260 1.00 15.00 B C +ATOM 1423 CB VAL B 6 13.500 30.972 15.693 1.00 15.00 B C +ATOM 1424 CG1 VAL B 6 14.831 31.704 15.578 1.00 15.00 B C +ATOM 1425 CG2 VAL B 6 13.694 29.733 16.589 1.00 15.00 B C +ATOM 1426 C VAL B 6 12.712 32.372 17.683 1.00 15.00 B C +ATOM 1427 O VAL B 6 13.353 33.391 17.872 1.00 15.00 B O +ATOM 1428 N THR B 7 12.254 31.650 18.679 1.00 15.00 B N +ATOM 1429 HN THR B 7 11.719 30.853 18.482 1.00 15.00 B H +ATOM 1430 CA THR B 7 12.522 32.005 20.094 1.00 15.00 B C +ATOM 1431 CB THR B 7 11.352 31.602 20.995 1.00 15.00 B C +ATOM 1432 OG1 THR B 7 10.195 32.281 20.512 1.00 15.00 B O +ATOM 1433 HG1 THR B 7 9.848 32.852 21.201 1.00 15.00 B H +ATOM 1434 CG2 THR B 7 11.634 32.021 22.451 1.00 15.00 B C +ATOM 1435 C THR B 7 13.772 31.253 20.603 1.00 15.00 B C +ATOM 1436 O THR B 7 13.934 30.061 20.388 1.00 15.00 B O +ATOM 1437 N ILE B 8 14.612 31.953 21.315 1.00 15.00 B N +ATOM 1438 HN ILE B 8 14.423 32.904 21.457 1.00 15.00 B H +ATOM 1439 CA ILE B 8 15.832 31.383 21.916 1.00 15.00 B C +ATOM 1440 CB ILE B 8 16.933 32.467 22.134 1.00 15.00 B C +ATOM 1441 CG1 ILE B 8 17.465 32.868 20.746 1.00 15.00 B C +ATOM 1442 CG2 ILE B 8 18.059 31.908 23.010 1.00 15.00 B C +ATOM 1443 CD1 ILE B 8 18.523 33.974 20.835 1.00 15.00 B C +ATOM 1444 C ILE B 8 15.367 30.802 23.254 1.00 15.00 B C +ATOM 1445 O ILE B 8 14.911 31.511 24.138 1.00 15.00 B O +ATOM 1446 N THR B 9 15.440 29.516 23.363 1.00 15.00 B N +ATOM 1447 HN THR B 9 15.801 29.002 22.611 1.00 15.00 B H +ATOM 1448 CA THR B 9 14.993 28.768 24.601 1.00 15.00 B C +ATOM 1449 CB THR B 9 14.055 27.572 24.219 1.00 15.00 B C +ATOM 1450 OG1 THR B 9 14.754 26.720 23.298 1.00 15.00 B O +ATOM 1451 HG1 THR B 9 15.398 26.192 23.775 1.00 15.00 B H +ATOM 1452 CG2 THR B 9 12.748 28.127 23.633 1.00 15.00 B C +ATOM 1453 C THR B 9 16.152 28.218 25.476 1.00 15.00 B C +ATOM 1454 O THR B 9 15.887 27.673 26.531 1.00 15.00 B O +ATOM 1455 N ALA B 10 17.396 28.348 25.084 1.00 15.00 B N +ATOM 1456 HN ALA B 10 17.582 28.793 24.231 1.00 15.00 B H +ATOM 1457 CA ALA B 10 18.534 27.840 25.896 1.00 15.00 B C +ATOM 1458 CB ALA B 10 19.777 27.935 25.015 1.00 15.00 B C +ATOM 1459 C ALA B 10 18.738 28.706 27.151 1.00 15.00 B C +ATOM 1460 O ALA B 10 18.656 29.907 27.052 1.00 15.00 B O +ATOM 1461 N PRO B 11 19.025 28.117 28.314 1.00 15.00 B N +ATOM 1462 CA PRO B 11 19.258 28.881 29.580 1.00 15.00 B C +ATOM 1463 CB PRO B 11 19.774 27.791 30.541 1.00 15.00 B C +ATOM 1464 CG PRO B 11 19.132 26.521 30.048 1.00 15.00 B C +ATOM 1465 CD PRO B 11 19.132 26.630 28.515 1.00 15.00 B C +ATOM 1466 C PRO B 11 20.163 30.070 29.501 1.00 15.00 B C +ATOM 1467 O PRO B 11 19.811 31.108 30.043 1.00 15.00 B O +ATOM 1468 N ASN B 12 21.283 30.019 28.867 1.00 15.00 B N +ATOM 1469 HN ASN B 12 21.592 29.203 28.420 1.00 15.00 B H +ATOM 1470 CA ASN B 12 22.086 31.288 28.855 1.00 15.00 B C +ATOM 1471 CB ASN B 12 23.556 30.981 29.187 1.00 15.00 B C +ATOM 1472 CG ASN B 12 23.659 30.470 30.625 1.00 15.00 B C +ATOM 1473 OD1 ASN B 12 22.751 30.650 31.413 1.00 15.00 B O +ATOM 1474 ND2 ASN B 12 24.735 29.836 31.004 1.00 15.00 B N +ATOM 1475 HD21 ASN B 12 25.451 29.706 30.348 1.00 15.00 B H +ATOM 1476 HD22 ASN B 12 24.782 29.516 31.929 1.00 15.00 B H +ATOM 1477 C ASN B 12 21.915 31.914 27.477 1.00 15.00 B C +ATOM 1478 O ASN B 12 22.793 32.599 26.989 1.00 15.00 B O +ATOM 1479 N GLY B 13 20.778 31.687 26.819 1.00 15.00 B N +ATOM 1480 HN GLY B 13 20.070 31.135 27.212 1.00 15.00 B H +ATOM 1481 CA GLY B 13 20.626 32.301 25.471 1.00 15.00 B C +ATOM 1482 C GLY B 13 21.721 31.822 24.526 1.00 15.00 B C +ATOM 1483 O GLY B 13 22.197 30.695 24.605 1.00 15.00 B O +ATOM 1484 N LEU B 14 22.117 32.662 23.597 1.00 15.00 B N +ATOM 1485 HN LEU B 14 21.743 33.566 23.545 1.00 15.00 B H +ATOM 1486 CA LEU B 14 23.141 32.209 22.632 1.00 15.00 B C +ATOM 1487 CB LEU B 14 22.910 32.956 21.312 1.00 15.00 B C +ATOM 1488 CG LEU B 14 23.721 32.365 20.155 1.00 15.00 B C +ATOM 1489 CD1 LEU B 14 23.130 31.034 19.682 1.00 15.00 B C +ATOM 1490 CD2 LEU B 14 23.675 33.366 18.999 1.00 15.00 B C +ATOM 1491 C LEU B 14 24.516 32.470 23.213 1.00 15.00 B C +ATOM 1492 O LEU B 14 25.190 33.391 22.800 1.00 15.00 B O +ATOM 1493 N HIS B 15 24.940 31.677 24.190 1.00 15.00 B N +ATOM 1494 HN HIS B 15 24.383 30.937 24.510 1.00 15.00 B H +ATOM 1495 CA HIS B 15 26.285 31.936 24.792 1.00 15.00 B C +ATOM 1496 CB HIS B 15 26.427 31.192 26.135 1.00 15.00 B C +ATOM 1497 CG HIS B 15 26.055 29.743 25.976 1.00 15.00 B C +ATOM 1498 ND1 HIS B 15 27.006 28.735 25.967 1.00 15.00 B N +ATOM 1499 CD2 HIS B 15 24.842 29.115 25.848 1.00 15.00 B C +ATOM 1500 CE1 HIS B 15 26.356 27.565 25.840 1.00 15.00 B C +ATOM 1501 NE2 HIS B 15 25.034 27.739 25.762 1.00 15.00 B N +ATOM 1502 HE2 HIS B 15 24.349 27.045 25.665 1.00 15.00 B H +ATOM 1503 C HIS B 15 27.427 31.625 23.834 1.00 15.00 B C +ATOM 1504 O HIS B 15 27.237 31.345 22.669 1.00 15.00 B O +ATOM 1505 N THR B 16 28.623 31.796 24.323 1.00 15.00 B N +ATOM 1506 HN THR B 16 28.725 32.025 25.270 1.00 15.00 B H +ATOM 1507 CA THR B 16 29.847 31.650 23.470 1.00 15.00 B C +ATOM 1508 CB THR B 16 31.127 31.844 24.346 1.00 15.00 B C +ATOM 1509 OG1 THR B 16 30.907 32.899 25.272 1.00 15.00 B O +ATOM 1510 HG1 THR B 16 31.549 32.840 25.983 1.00 15.00 B H +ATOM 1511 CG2 THR B 16 32.318 32.197 23.452 1.00 15.00 B C +ATOM 1512 C THR B 16 29.988 30.408 22.588 1.00 15.00 B C +ATOM 1513 O THR B 16 30.137 30.563 21.388 1.00 15.00 B O +ATOM 1514 N ARG B 17 30.014 29.219 23.068 1.00 15.00 B N +ATOM 1515 HN ARG B 17 29.896 29.048 24.026 1.00 15.00 B H +ATOM 1516 CA ARG B 17 30.233 28.107 22.095 1.00 15.00 B C +ATOM 1517 CB ARG B 17 30.550 26.827 22.900 1.00 15.00 B C +ATOM 1518 CG ARG B 17 30.285 25.575 22.050 1.00 15.00 B C +ATOM 1519 CD ARG B 17 30.674 24.322 22.839 1.00 15.00 B C +ATOM 1520 NE ARG B 17 32.034 24.494 23.422 1.00 15.00 B N +ATOM 1521 HE ARG B 17 32.616 25.208 23.087 1.00 15.00 B H +ATOM 1522 CZ ARG B 17 32.439 23.695 24.372 1.00 15.00 B C +ATOM 1523 NH1 ARG B 17 31.654 22.749 24.808 1.00 15.00 B N +ATOM 1524 HH11 ARG B 17 31.977 22.113 25.565 1.00 15.00 B H +ATOM 1525 HH12 ARG B 17 30.705 22.631 24.399 1.00 15.00 B H +ATOM 1526 NH2 ARG B 17 33.630 23.843 24.884 1.00 15.00 B N +ATOM 1527 HH21 ARG B 17 33.955 23.207 25.640 1.00 15.00 B H +ATOM 1528 HH22 ARG B 17 34.248 24.597 24.539 1.00 15.00 B H +ATOM 1529 C ARG B 17 29.093 27.973 21.065 1.00 15.00 B C +ATOM 1530 O ARG B 17 29.372 27.809 19.894 1.00 15.00 B O +ATOM 1531 N PRO B 18 27.850 28.042 21.427 1.00 15.00 B N +ATOM 1532 CA PRO B 18 26.784 27.922 20.414 1.00 15.00 B C +ATOM 1533 CB PRO B 18 25.517 27.772 21.274 1.00 15.00 B C +ATOM 1534 CG PRO B 18 25.871 28.154 22.721 1.00 15.00 B C +ATOM 1535 CD PRO B 18 27.406 28.206 22.842 1.00 15.00 B C +ATOM 1536 C PRO B 18 26.758 29.130 19.461 1.00 15.00 B C +ATOM 1537 O PRO B 18 26.369 29.011 18.316 1.00 15.00 B O +ATOM 1538 N ALA B 19 27.171 30.284 19.911 1.00 15.00 B N +ATOM 1539 HN ALA B 19 27.483 30.370 20.836 1.00 15.00 B H +ATOM 1540 CA ALA B 19 27.165 31.484 18.997 1.00 15.00 B C +ATOM 1541 CB ALA B 19 27.330 32.766 19.838 1.00 15.00 B C +ATOM 1542 C ALA B 19 28.248 31.292 17.915 1.00 15.00 B C +ATOM 1543 O ALA B 19 28.065 31.651 16.766 1.00 15.00 B O +ATOM 1544 N ALA B 20 29.351 30.688 18.258 1.00 15.00 B N +ATOM 1545 HN ALA B 20 29.476 30.409 19.189 1.00 15.00 B H +ATOM 1546 CA ALA B 20 30.425 30.414 17.262 1.00 15.00 B C +ATOM 1547 CB ALA B 20 31.695 29.900 17.957 1.00 15.00 B C +ATOM 1548 C ALA B 20 29.951 29.302 16.314 1.00 15.00 B C +ATOM 1549 O ALA B 20 30.199 29.337 15.119 1.00 15.00 B O +ATOM 1550 N GLN B 21 29.265 28.295 16.836 1.00 15.00 B N +ATOM 1551 HN GLN B 21 29.079 28.257 17.797 1.00 15.00 B H +ATOM 1552 CA GLN B 21 28.781 27.215 15.913 1.00 15.00 B C +ATOM 1553 CB GLN B 21 28.198 26.016 16.676 1.00 15.00 B C +ATOM 1554 CG GLN B 21 29.303 25.378 17.521 1.00 15.00 B C +ATOM 1555 CD GLN B 21 28.721 24.242 18.364 1.00 15.00 B C +ATOM 1556 OE1 GLN B 21 27.522 24.047 18.398 1.00 15.00 B O +ATOM 1557 NE2 GLN B 21 29.527 23.482 19.054 1.00 15.00 B N +ATOM 1558 HE21 GLN B 21 30.489 23.666 19.009 1.00 15.00 B H +ATOM 1559 HE22 GLN B 21 29.137 22.759 19.588 1.00 15.00 B H +ATOM 1560 C GLN B 21 27.687 27.812 14.974 1.00 15.00 B C +ATOM 1561 O GLN B 21 27.585 27.443 13.820 1.00 15.00 B O +ATOM 1562 N PHE B 22 26.857 28.725 15.477 1.00 15.00 B N +ATOM 1563 HN PHE B 22 26.964 29.003 16.411 1.00 15.00 B H +ATOM 1564 CA PHE B 22 25.774 29.334 14.662 1.00 15.00 B C +ATOM 1565 CB PHE B 22 24.915 30.243 15.585 1.00 15.00 B C +ATOM 1566 CG PHE B 22 23.824 30.953 14.793 1.00 15.00 B C +ATOM 1567 CD1 PHE B 22 22.607 30.306 14.573 1.00 15.00 B C +ATOM 1568 CD2 PHE B 22 24.022 32.249 14.290 1.00 15.00 B C +ATOM 1569 CE1 PHE B 22 21.581 30.936 13.859 1.00 15.00 B C +ATOM 1570 CE2 PHE B 22 23.000 32.883 13.574 1.00 15.00 B C +ATOM 1571 CZ PHE B 22 21.780 32.230 13.358 1.00 15.00 B C +ATOM 1572 C PHE B 22 26.409 30.135 13.525 1.00 15.00 B C +ATOM 1573 O PHE B 22 26.008 30.066 12.374 1.00 15.00 B O +ATOM 1574 N VAL B 23 27.414 30.881 13.868 1.00 15.00 B N +ATOM 1575 HN VAL B 23 27.695 30.893 14.807 1.00 15.00 B H +ATOM 1576 CA VAL B 23 28.163 31.727 12.878 1.00 15.00 B C +ATOM 1577 CB VAL B 23 29.165 32.675 13.609 1.00 15.00 B C +ATOM 1578 CG1 VAL B 23 30.066 33.360 12.581 1.00 15.00 B C +ATOM 1579 CG2 VAL B 23 28.383 33.737 14.387 1.00 15.00 B C +ATOM 1580 C VAL B 23 28.871 30.846 11.846 1.00 15.00 B C +ATOM 1581 O VAL B 23 28.889 31.155 10.671 1.00 15.00 B O +ATOM 1582 N LYS B 24 29.442 29.760 12.254 1.00 15.00 B N +ATOM 1583 HN LYS B 24 29.421 29.522 13.204 1.00 15.00 B H +ATOM 1584 CA LYS B 24 30.128 28.876 11.284 1.00 15.00 B C +ATOM 1585 CB LYS B 24 30.816 27.705 12.019 1.00 15.00 B C +ATOM 1586 CG LYS B 24 31.759 26.971 11.064 1.00 15.00 B C +ATOM 1587 CD LYS B 24 32.338 25.741 11.767 1.00 15.00 B C +ATOM 1588 CE LYS B 24 33.397 25.092 10.873 1.00 15.00 B C +ATOM 1589 NZ LYS B 24 34.165 24.088 11.662 1.00 15.00 B N +ATOM 1590 HZ1 LYS B 24 34.634 24.549 12.467 1.00 15.00 B H +ATOM 1591 HZ2 LYS B 24 34.888 23.640 11.064 1.00 15.00 B H +ATOM 1592 HZ3 LYS B 24 33.525 23.351 12.022 1.00 15.00 B H +ATOM 1593 C LYS B 24 29.110 28.303 10.301 1.00 15.00 B C +ATOM 1594 O LYS B 24 29.356 28.205 9.115 1.00 15.00 B O +ATOM 1595 N GLU B 25 27.967 27.925 10.793 1.00 15.00 B N +ATOM 1596 HN GLU B 25 27.797 28.016 11.754 1.00 15.00 B H +ATOM 1597 CA GLU B 25 26.935 27.366 9.923 1.00 15.00 B C +ATOM 1598 CB GLU B 25 25.784 26.772 10.757 1.00 15.00 B C +ATOM 1599 CG GLU B 25 24.806 26.202 9.673 1.00 15.00 B C +ATOM 1600 CD GLU B 25 23.664 25.269 10.101 1.00 15.00 B C +ATOM 1601 OE1 GLU B 25 23.922 24.167 10.558 1.00 15.00 B O +ATOM 1602 OE2 GLU B 25 22.530 25.643 9.835 1.00 15.00 B O +ATOM 1603 C GLU B 25 26.401 28.483 8.984 1.00 15.00 B C +ATOM 1604 O GLU B 25 26.151 28.248 7.814 1.00 15.00 B O +ATOM 1605 N ALA B 26 26.220 29.697 9.489 1.00 15.00 B N +ATOM 1606 HN ALA B 26 26.410 29.860 10.437 1.00 15.00 B H +ATOM 1607 CA ALA B 26 25.732 30.817 8.634 1.00 15.00 B C +ATOM 1608 CB ALA B 26 25.578 32.038 9.553 1.00 15.00 B C +ATOM 1609 C ALA B 26 26.725 31.042 7.472 1.00 15.00 B C +ATOM 1610 O ALA B 26 26.325 31.226 6.336 1.00 15.00 B O +ATOM 1611 N LYS B 27 28.003 31.002 7.740 1.00 15.00 B N +ATOM 1612 HN LYS B 27 28.297 30.858 8.664 1.00 15.00 B H +ATOM 1613 CA LYS B 27 29.025 31.172 6.664 1.00 15.00 B C +ATOM 1614 CB LYS B 27 30.439 31.179 7.273 1.00 15.00 B C +ATOM 1615 CG LYS B 27 30.661 32.476 8.045 1.00 15.00 B C +ATOM 1616 CD LYS B 27 32.090 32.508 8.592 1.00 15.00 B C +ATOM 1617 CE LYS B 27 32.294 33.780 9.416 1.00 15.00 B C +ATOM 1618 NZ LYS B 27 33.748 33.972 9.681 1.00 15.00 B N +ATOM 1619 HZ1 LYS B 27 34.126 33.159 10.209 1.00 15.00 B H +ATOM 1620 HZ2 LYS B 27 33.899 34.835 10.241 1.00 15.00 B H +ATOM 1621 HZ3 LYS B 27 34.266 34.060 8.783 1.00 15.00 B H +ATOM 1622 C LYS B 27 28.964 30.053 5.591 1.00 15.00 B C +ATOM 1623 O LYS B 27 29.543 30.193 4.532 1.00 15.00 B O +ATOM 1624 N GLY B 28 28.298 28.954 5.833 1.00 15.00 B N +ATOM 1625 HN GLY B 28 27.833 28.847 6.689 1.00 15.00 B H +ATOM 1626 CA GLY B 28 28.247 27.878 4.820 1.00 15.00 B C +ATOM 1627 C GLY B 28 27.236 28.260 3.747 1.00 15.00 B C +ATOM 1628 O GLY B 28 27.195 27.620 2.705 1.00 15.00 B O +ATOM 1629 N PHE B 29 26.417 29.311 3.971 1.00 15.00 B N +ATOM 1630 HN PHE B 29 26.466 29.812 4.812 1.00 15.00 B H +ATOM 1631 CA PHE B 29 25.427 29.698 2.904 1.00 15.00 B C +ATOM 1632 CB PHE B 29 24.040 30.004 3.472 1.00 15.00 B C +ATOM 1633 CG PHE B 29 23.528 28.823 4.245 1.00 15.00 B C +ATOM 1634 CD1 PHE B 29 22.870 27.795 3.579 1.00 15.00 B C +ATOM 1635 CD2 PHE B 29 23.700 28.763 5.631 1.00 15.00 B C +ATOM 1636 CE1 PHE B 29 22.380 26.711 4.299 1.00 15.00 B C +ATOM 1637 CE2 PHE B 29 23.202 27.670 6.344 1.00 15.00 B C +ATOM 1638 CZ PHE B 29 22.540 26.648 5.673 1.00 15.00 B C +ATOM 1639 C PHE B 29 25.909 30.940 2.170 1.00 15.00 B C +ATOM 1640 O PHE B 29 26.508 31.824 2.751 1.00 15.00 B O +ATOM 1641 N THR B 30 25.639 31.014 0.891 1.00 15.00 B N +ATOM 1642 HN THR B 30 25.144 30.291 0.452 1.00 15.00 B H +ATOM 1643 CA THR B 30 26.088 32.208 0.095 1.00 15.00 B C +ATOM 1644 CB THR B 30 26.214 31.842 -1.408 1.00 15.00 B C +ATOM 1645 OG1 THR B 30 24.948 31.381 -1.876 1.00 15.00 B O +ATOM 1646 HG1 THR B 30 25.077 30.803 -2.632 1.00 15.00 B H +ATOM 1647 CG2 THR B 30 27.288 30.751 -1.524 1.00 15.00 B C +ATOM 1648 C THR B 30 25.208 33.435 0.335 1.00 15.00 B C +ATOM 1649 O THR B 30 25.709 34.541 0.234 1.00 15.00 B O +ATOM 1650 N SER B 31 23.938 33.295 0.663 1.00 15.00 B N +ATOM 1651 HN SER B 31 23.538 32.404 0.745 1.00 15.00 B H +ATOM 1652 CA SER B 31 23.129 34.514 0.905 1.00 15.00 B C +ATOM 1653 CB SER B 31 21.708 34.178 1.365 1.00 15.00 B C +ATOM 1654 OG SER B 31 21.088 33.306 0.448 1.00 15.00 B O +ATOM 1655 HG SER B 31 21.680 32.577 0.248 1.00 15.00 B H +ATOM 1656 C SER B 31 23.653 35.426 2.024 1.00 15.00 B C +ATOM 1657 O SER B 31 24.285 35.015 2.986 1.00 15.00 B O +ATOM 1658 N GLU B 32 23.243 36.670 1.927 1.00 15.00 B N +ATOM 1659 HN GLU B 32 22.753 36.951 1.126 1.00 15.00 B H +ATOM 1660 CA GLU B 32 23.502 37.653 2.993 1.00 15.00 B C +ATOM 1661 CB GLU B 32 23.539 39.120 2.481 1.00 15.00 B C +ATOM 1662 CG GLU B 32 22.431 40.155 2.865 1.00 15.00 B C +ATOM 1663 CD GLU B 32 21.765 40.086 4.244 1.00 15.00 B C +ATOM 1664 OE1 GLU B 32 22.335 40.606 5.194 1.00 15.00 B O +ATOM 1665 OE2 GLU B 32 20.628 39.640 4.295 1.00 15.00 B O +ATOM 1666 C GLU B 32 22.415 37.310 4.024 1.00 15.00 B C +ATOM 1667 O GLU B 32 21.256 37.149 3.681 1.00 15.00 B O +ATOM 1668 N ILE B 33 22.793 37.117 5.264 1.00 15.00 B N +ATOM 1669 HN ILE B 33 23.733 37.261 5.499 1.00 15.00 B H +ATOM 1670 CA ILE B 33 21.850 36.689 6.323 1.00 15.00 B C +ATOM 1671 CB ILE B 33 22.268 35.280 6.837 1.00 15.00 B C +ATOM 1672 CG1 ILE B 33 22.324 34.284 5.646 1.00 15.00 B C +ATOM 1673 CG2 ILE B 33 21.304 34.821 7.949 1.00 15.00 B C +ATOM 1674 CD1 ILE B 33 23.170 33.032 5.968 1.00 15.00 B C +ATOM 1675 C ILE B 33 21.944 37.682 7.472 1.00 15.00 B C +ATOM 1676 O ILE B 33 23.028 38.053 7.895 1.00 15.00 B O +ATOM 1677 N THR B 34 20.811 38.104 7.967 1.00 15.00 B N +ATOM 1678 HN THR B 34 19.972 37.768 7.588 1.00 15.00 B H +ATOM 1679 CA THR B 34 20.755 39.073 9.082 1.00 15.00 B C +ATOM 1680 CB THR B 34 20.068 40.412 8.589 1.00 15.00 B C +ATOM 1681 OG1 THR B 34 20.865 40.935 7.536 1.00 15.00 B O +ATOM 1682 HG1 THR B 34 20.402 41.663 7.115 1.00 15.00 B H +ATOM 1683 CG2 THR B 34 19.893 41.530 9.645 1.00 15.00 B C +ATOM 1684 C THR B 34 19.921 38.481 10.224 1.00 15.00 B C +ATOM 1685 O THR B 34 18.876 37.883 10.024 1.00 15.00 B O +ATOM 1686 N VAL B 35 20.395 38.735 11.402 1.00 15.00 B N +ATOM 1687 HN VAL B 35 21.261 39.191 11.452 1.00 15.00 B H +ATOM 1688 CA VAL B 35 19.728 38.389 12.685 1.00 15.00 B C +ATOM 1689 CB VAL B 35 20.701 37.672 13.672 1.00 15.00 B C +ATOM 1690 CG1 VAL B 35 19.961 37.454 15.002 1.00 15.00 B C +ATOM 1691 CG2 VAL B 35 21.183 36.334 13.078 1.00 15.00 B C +ATOM 1692 C VAL B 35 19.219 39.739 13.261 1.00 15.00 B C +ATOM 1693 O VAL B 35 19.969 40.691 13.375 1.00 15.00 B O +ATOM 1694 N THR B 36 17.938 39.821 13.605 1.00 15.00 B N +ATOM 1695 HN THR B 36 17.369 39.031 13.488 1.00 15.00 B H +ATOM 1696 CA THR B 36 17.328 41.063 14.162 1.00 15.00 B C +ATOM 1697 CB THR B 36 16.271 41.716 13.209 1.00 15.00 B C +ATOM 1698 OG1 THR B 36 16.912 42.027 11.980 1.00 15.00 B O +ATOM 1699 HG1 THR B 36 17.729 42.499 12.155 1.00 15.00 B H +ATOM 1700 CG2 THR B 36 15.664 42.990 13.824 1.00 15.00 B C +ATOM 1701 C THR B 36 16.678 40.781 15.468 1.00 15.00 B C +ATOM 1702 O THR B 36 15.761 39.976 15.574 1.00 15.00 B O +ATOM 1703 N SER B 37 17.143 41.478 16.474 1.00 15.00 B N +ATOM 1704 HN SER B 37 17.890 42.100 16.351 1.00 15.00 B H +ATOM 1705 CA SER B 37 16.506 41.302 17.816 1.00 15.00 B C +ATOM 1706 CB SER B 37 17.476 40.582 18.756 1.00 15.00 B C +ATOM 1707 OG SER B 37 16.887 40.527 20.048 1.00 15.00 B O +ATOM 1708 HG SER B 37 16.083 40.003 20.012 1.00 15.00 B H +ATOM 1709 C SER B 37 16.071 42.696 18.330 1.00 15.00 B C +ATOM 1710 O SER B 37 16.863 43.621 18.399 1.00 15.00 B O +ATOM 1711 N ASN B 38 14.785 42.848 18.651 1.00 15.00 B N +ATOM 1712 HN ASN B 38 14.180 42.081 18.573 1.00 15.00 B H +ATOM 1713 CA ASN B 38 14.236 44.174 19.133 1.00 15.00 B C +ATOM 1714 CB ASN B 38 14.700 44.416 20.584 1.00 15.00 B C +ATOM 1715 CG ASN B 38 13.935 45.567 21.247 1.00 15.00 B C +ATOM 1716 OD1 ASN B 38 14.452 46.220 22.147 1.00 15.00 B O +ATOM 1717 ND2 ASN B 38 12.781 45.925 20.769 1.00 15.00 B N +ATOM 1718 HD21 ASN B 38 12.432 45.442 19.991 1.00 15.00 B H +ATOM 1719 HD22 ASN B 38 12.307 46.663 21.207 1.00 15.00 B H +ATOM 1720 C ASN B 38 14.630 45.353 18.221 1.00 15.00 B C +ATOM 1721 O ASN B 38 14.888 46.437 18.699 1.00 15.00 B O +ATOM 1722 N GLY B 39 14.623 45.184 16.913 1.00 15.00 B N +ATOM 1723 HN GLY B 39 14.420 44.303 16.535 1.00 15.00 B H +ATOM 1724 CA GLY B 39 14.924 46.333 16.021 1.00 15.00 B C +ATOM 1725 C GLY B 39 16.408 46.601 15.868 1.00 15.00 B C +ATOM 1726 O GLY B 39 16.787 47.632 15.336 1.00 15.00 B O +ATOM 1727 N LYS B 40 17.252 45.704 16.297 1.00 15.00 B N +ATOM 1728 HN LYS B 40 16.922 44.890 16.732 1.00 15.00 B H +ATOM 1729 CA LYS B 40 18.711 45.913 16.128 1.00 15.00 B C +ATOM 1730 CB LYS B 40 19.369 46.018 17.497 1.00 15.00 B C +ATOM 1731 CG LYS B 40 18.838 47.256 18.222 1.00 15.00 B C +ATOM 1732 CD LYS B 40 19.588 47.436 19.543 1.00 15.00 B C +ATOM 1733 CE LYS B 40 18.981 48.606 20.318 1.00 15.00 B C +ATOM 1734 NZ LYS B 40 19.592 48.672 21.675 1.00 15.00 B N +ATOM 1735 HZ1 LYS B 40 19.410 47.788 22.192 1.00 15.00 B H +ATOM 1736 HZ2 LYS B 40 19.186 49.465 22.212 1.00 15.00 B H +ATOM 1737 HZ3 LYS B 40 20.620 48.811 21.598 1.00 15.00 B H +ATOM 1738 C LYS B 40 19.157 44.692 15.314 1.00 15.00 B C +ATOM 1739 O LYS B 40 18.690 43.596 15.520 1.00 15.00 B O +ATOM 1740 N SER B 41 19.978 44.913 14.348 1.00 15.00 B N +ATOM 1741 HN SER B 41 20.323 45.823 14.235 1.00 15.00 B H +ATOM 1742 CA SER B 41 20.427 43.884 13.407 1.00 15.00 B C +ATOM 1743 CB SER B 41 20.094 44.362 11.988 1.00 15.00 B C +ATOM 1744 OG SER B 41 18.688 44.467 11.857 1.00 15.00 B O +ATOM 1745 HG SER B 41 18.458 44.556 10.929 1.00 15.00 B H +ATOM 1746 C SER B 41 21.921 43.667 13.362 1.00 15.00 B C +ATOM 1747 O SER B 41 22.751 44.519 13.647 1.00 15.00 B O +ATOM 1748 N ALA B 42 22.222 42.489 12.936 1.00 15.00 B N +ATOM 1749 HN ALA B 42 21.496 41.862 12.736 1.00 15.00 B H +ATOM 1750 CA ALA B 42 23.597 42.052 12.740 1.00 15.00 B C +ATOM 1751 CB ALA B 42 24.053 41.339 14.020 1.00 15.00 B C +ATOM 1752 C ALA B 42 23.679 40.991 11.637 1.00 15.00 B C +ATOM 1753 O ALA B 42 22.814 40.139 11.500 1.00 15.00 B O +ATOM 1754 N SER B 43 24.771 40.991 10.939 1.00 15.00 B N +ATOM 1755 HN SER B 43 25.425 41.709 11.072 1.00 15.00 B H +ATOM 1756 CA SER B 43 25.050 39.940 9.955 1.00 15.00 B C +ATOM 1757 CB SER B 43 26.403 40.224 9.315 1.00 15.00 B C +ATOM 1758 OG SER B 43 26.877 39.045 8.672 1.00 15.00 B O +ATOM 1759 HG SER B 43 26.144 38.443 8.526 1.00 15.00 B H +ATOM 1760 C SER B 43 25.211 38.629 10.753 1.00 15.00 B C +ATOM 1761 O SER B 43 25.920 38.593 11.751 1.00 15.00 B O +ATOM 1762 N ALA B 44 24.595 37.562 10.350 1.00 15.00 B N +ATOM 1763 HN ALA B 44 24.019 37.591 9.558 1.00 15.00 B H +ATOM 1764 CA ALA B 44 24.773 36.299 11.103 1.00 15.00 B C +ATOM 1765 CB ALA B 44 23.723 35.328 10.588 1.00 15.00 B C +ATOM 1766 C ALA B 44 26.170 35.700 10.847 1.00 15.00 B C +ATOM 1767 O ALA B 44 26.537 34.703 11.448 1.00 15.00 B O +ATOM 1768 N LYS B 45 26.947 36.276 9.944 1.00 15.00 B N +ATOM 1769 HN LYS B 45 26.641 37.081 9.476 1.00 15.00 B H +ATOM 1770 CA LYS B 45 28.289 35.699 9.638 1.00 15.00 B C +ATOM 1771 CB LYS B 45 28.626 35.752 8.123 1.00 15.00 B C +ATOM 1772 CG LYS B 45 27.594 34.951 7.278 1.00 15.00 B C +ATOM 1773 CD LYS B 45 27.916 35.034 5.764 1.00 15.00 B C +ATOM 1774 CE LYS B 45 26.702 34.545 4.945 1.00 15.00 B C +ATOM 1775 NZ LYS B 45 27.107 34.401 3.509 1.00 15.00 B N +ATOM 1776 HZ1 LYS B 45 27.429 35.317 3.135 1.00 15.00 B H +ATOM 1777 HZ2 LYS B 45 26.301 34.072 2.941 1.00 15.00 B H +ATOM 1778 HZ3 LYS B 45 27.881 33.711 3.423 1.00 15.00 B H +ATOM 1779 C LYS B 45 29.348 36.460 10.412 1.00 15.00 B C +ATOM 1780 O LYS B 45 30.533 36.318 10.149 1.00 15.00 B O +ATOM 1781 N SER B 46 28.943 37.269 11.371 1.00 15.00 B N +ATOM 1782 HN SER B 46 27.987 37.359 11.569 1.00 15.00 B H +ATOM 1783 CA SER B 46 29.939 38.041 12.147 1.00 15.00 B C +ATOM 1784 CB SER B 46 29.932 39.490 11.614 1.00 15.00 B C +ATOM 1785 OG SER B 46 30.070 40.404 12.694 1.00 15.00 B O +ATOM 1786 HG SER B 46 29.474 41.145 12.565 1.00 15.00 B H +ATOM 1787 C SER B 46 29.634 37.961 13.638 1.00 15.00 B C +ATOM 1788 O SER B 46 28.722 38.575 14.166 1.00 15.00 B O +ATOM 1789 N LEU B 47 30.443 37.183 14.303 1.00 15.00 B N +ATOM 1790 HN LEU B 47 31.152 36.709 13.820 1.00 15.00 B H +ATOM 1791 CA LEU B 47 30.320 36.994 15.776 1.00 15.00 B C +ATOM 1792 CB LEU B 47 31.462 36.039 16.219 1.00 15.00 B C +ATOM 1793 CG LEU B 47 31.346 35.730 17.720 1.00 15.00 B C +ATOM 1794 CD1 LEU B 47 30.166 34.780 17.986 1.00 15.00 B C +ATOM 1795 CD2 LEU B 47 32.647 35.074 18.193 1.00 15.00 B C +ATOM 1796 C LEU B 47 30.421 38.366 16.477 1.00 15.00 B C +ATOM 1797 O LEU B 47 29.739 38.611 17.446 1.00 15.00 B O +ATOM 1798 N PHE B 48 31.258 39.264 16.009 1.00 15.00 B N +ATOM 1799 HN PHE B 48 31.807 39.066 15.222 1.00 15.00 B H +ATOM 1800 CA PHE B 48 31.365 40.600 16.695 1.00 15.00 B C +ATOM 1801 CB PHE B 48 32.477 41.474 16.091 1.00 15.00 B C +ATOM 1802 CG PHE B 48 32.601 42.748 16.892 1.00 15.00 B C +ATOM 1803 CD1 PHE B 48 31.889 43.896 16.499 1.00 15.00 B C +ATOM 1804 CD2 PHE B 48 33.424 42.786 18.034 1.00 15.00 B C +ATOM 1805 CE1 PHE B 48 31.999 45.084 17.247 1.00 15.00 B C +ATOM 1806 CE2 PHE B 48 33.536 43.975 18.781 1.00 15.00 B C +ATOM 1807 CZ PHE B 48 32.823 45.123 18.388 1.00 15.00 B C +ATOM 1808 C PHE B 48 30.035 41.391 16.690 1.00 15.00 B C +ATOM 1809 O PHE B 48 29.617 41.868 17.727 1.00 15.00 B O +ATOM 1810 N LYS B 49 29.362 41.569 15.577 1.00 15.00 B N +ATOM 1811 HN LYS B 49 29.688 41.190 14.734 1.00 15.00 B H +ATOM 1812 CA LYS B 49 28.107 42.347 15.610 1.00 15.00 B C +ATOM 1813 CB LYS B 49 27.634 42.521 14.170 1.00 15.00 B C +ATOM 1814 CG LYS B 49 28.723 43.192 13.319 1.00 15.00 B C +ATOM 1815 CD LYS B 49 28.863 44.672 13.696 1.00 15.00 B C +ATOM 1816 CE LYS B 49 29.721 45.383 12.648 1.00 15.00 B C +ATOM 1817 NZ LYS B 49 30.166 46.702 13.181 1.00 15.00 B N +ATOM 1818 HZ1 LYS B 49 30.727 46.567 14.047 1.00 15.00 B H +ATOM 1819 HZ2 LYS B 49 29.341 47.294 13.405 1.00 15.00 B H +ATOM 1820 HZ3 LYS B 49 30.750 47.194 12.475 1.00 15.00 B H +ATOM 1821 C LYS B 49 27.033 41.586 16.342 1.00 15.00 B C +ATOM 1822 O LYS B 49 26.141 42.152 16.942 1.00 15.00 B O +ATOM 1823 N LEU B 50 27.084 40.306 16.251 1.00 15.00 B N +ATOM 1824 HN LEU B 50 27.814 39.872 15.761 1.00 15.00 B H +ATOM 1825 CA LEU B 50 26.017 39.486 16.901 1.00 15.00 B C +ATOM 1826 CB LEU B 50 26.315 38.035 16.494 1.00 15.00 B C +ATOM 1827 CG LEU B 50 25.427 37.293 15.487 1.00 15.00 B C +ATOM 1828 CD1 LEU B 50 25.854 35.800 15.606 1.00 15.00 B C +ATOM 1829 CD2 LEU B 50 23.942 37.427 15.814 1.00 15.00 B C +ATOM 1830 C LEU B 50 26.100 39.663 18.424 1.00 15.00 B C +ATOM 1831 O LEU B 50 25.097 39.606 19.120 1.00 15.00 B O +ATOM 1832 N GLN B 51 27.283 39.866 18.934 1.00 15.00 B N +ATOM 1833 HN GLN B 51 28.063 39.919 18.343 1.00 15.00 B H +ATOM 1834 CA GLN B 51 27.460 40.018 20.397 1.00 15.00 B C +ATOM 1835 CB GLN B 51 28.951 40.092 20.735 1.00 15.00 B C +ATOM 1836 CG GLN B 51 29.567 38.696 20.612 1.00 15.00 B C +ATOM 1837 CD GLN B 51 31.091 38.798 20.693 1.00 15.00 B C +ATOM 1838 OE1 GLN B 51 31.656 39.841 20.431 1.00 15.00 B O +ATOM 1839 NE2 GLN B 51 31.786 37.752 21.047 1.00 15.00 B N +ATOM 1840 HE21 GLN B 51 31.304 36.924 21.252 1.00 15.00 B H +ATOM 1841 HE22 GLN B 51 32.761 37.838 21.093 1.00 15.00 B H +ATOM 1842 C GLN B 51 26.825 41.312 20.859 1.00 15.00 B C +ATOM 1843 O GLN B 51 26.716 41.550 22.039 1.00 15.00 B O +ATOM 1844 N THR B 52 26.431 42.181 19.956 1.00 15.00 B N +ATOM 1845 HN THR B 52 26.516 41.985 19.000 1.00 15.00 B H +ATOM 1846 CA THR B 52 25.851 43.475 20.422 1.00 15.00 B C +ATOM 1847 CB THR B 52 26.277 44.658 19.505 1.00 15.00 B C +ATOM 1848 OG1 THR B 52 26.271 44.234 18.149 1.00 15.00 B O +ATOM 1849 HG1 THR B 52 26.801 44.837 17.622 1.00 15.00 B H +ATOM 1850 CG2 THR B 52 27.681 45.137 19.901 1.00 15.00 B C +ATOM 1851 C THR B 52 24.324 43.373 20.553 1.00 15.00 B C +ATOM 1852 O THR B 52 23.665 44.294 20.994 1.00 15.00 B O +ATOM 1853 N LEU B 53 23.763 42.258 20.181 1.00 15.00 B N +ATOM 1854 HN LEU B 53 24.324 41.535 19.830 1.00 15.00 B H +ATOM 1855 CA LEU B 53 22.307 42.054 20.274 1.00 15.00 B C +ATOM 1856 CB LEU B 53 21.904 41.110 19.103 1.00 15.00 B C +ATOM 1857 CG LEU B 53 21.829 41.905 17.787 1.00 15.00 B C +ATOM 1858 CD1 LEU B 53 21.892 40.932 16.605 1.00 15.00 B C +ATOM 1859 CD2 LEU B 53 20.506 42.709 17.705 1.00 15.00 B C +ATOM 1860 C LEU B 53 21.956 41.348 21.593 1.00 15.00 B C +ATOM 1861 O LEU B 53 22.761 40.643 22.169 1.00 15.00 B O +ATOM 1862 N GLY B 54 20.735 41.502 22.042 1.00 15.00 B N +ATOM 1863 HN GLY B 54 20.108 42.077 21.556 1.00 15.00 B H +ATOM 1864 CA GLY B 54 20.301 40.802 23.293 1.00 15.00 B C +ATOM 1865 C GLY B 54 19.838 39.433 22.830 1.00 15.00 B C +ATOM 1866 O GLY B 54 18.810 39.324 22.193 1.00 15.00 B O +ATOM 1867 N LEU B 55 20.599 38.388 23.081 1.00 15.00 B N +ATOM 1868 HN LEU B 55 21.435 38.493 23.581 1.00 15.00 B H +ATOM 1869 CA LEU B 55 20.181 37.064 22.604 1.00 15.00 B C +ATOM 1870 CB LEU B 55 21.193 36.547 21.573 1.00 15.00 B C +ATOM 1871 CG LEU B 55 21.364 37.399 20.300 1.00 15.00 B C +ATOM 1872 CD1 LEU B 55 22.437 36.731 19.407 1.00 15.00 B C +ATOM 1873 CD2 LEU B 55 20.054 37.481 19.508 1.00 15.00 B C +ATOM 1874 C LEU B 55 20.097 36.177 23.838 1.00 15.00 B C +ATOM 1875 O LEU B 55 20.627 35.078 23.864 1.00 15.00 B O +ATOM 1876 N THR B 56 19.430 36.677 24.879 1.00 15.00 B N +ATOM 1877 HN THR B 56 19.035 37.572 24.821 1.00 15.00 B H +ATOM 1878 CA THR B 56 19.284 35.890 26.115 1.00 15.00 B C +ATOM 1879 CB THR B 56 19.016 36.835 27.301 1.00 15.00 B C +ATOM 1880 OG1 THR B 56 17.682 37.317 27.226 1.00 15.00 B O +ATOM 1881 HG1 THR B 56 17.532 37.956 27.927 1.00 15.00 B H +ATOM 1882 CG2 THR B 56 19.988 38.014 27.252 1.00 15.00 B C +ATOM 1883 C THR B 56 18.105 34.917 25.963 1.00 15.00 B C +ATOM 1884 O THR B 56 17.350 34.989 25.014 1.00 15.00 B O +ATOM 1885 N GLN B 57 17.939 34.013 26.893 1.00 15.00 B N +ATOM 1886 HN GLN B 57 18.560 33.972 27.650 1.00 15.00 B H +ATOM 1887 CA GLN B 57 16.813 33.048 26.806 1.00 15.00 B C +ATOM 1888 CB GLN B 57 16.823 32.168 28.075 1.00 15.00 B C +ATOM 1889 CG GLN B 57 15.698 31.138 27.979 1.00 15.00 B C +ATOM 1890 CD GLN B 57 15.840 30.191 29.157 1.00 15.00 B C +ATOM 1891 OE1 GLN B 57 15.520 29.016 29.068 1.00 15.00 B O +ATOM 1892 NE2 GLN B 57 16.331 30.681 30.266 1.00 15.00 B N +ATOM 1893 HE21 GLN B 57 16.581 31.628 30.283 1.00 15.00 B H +ATOM 1894 HE22 GLN B 57 16.428 30.080 31.034 1.00 15.00 B H +ATOM 1895 C GLN B 57 15.484 33.780 26.738 1.00 15.00 B C +ATOM 1896 O GLN B 57 15.256 34.733 27.464 1.00 15.00 B O +ATOM 1897 N GLY B 58 14.574 33.321 25.895 1.00 15.00 B N +ATOM 1898 HN GLY B 58 14.781 32.558 25.321 1.00 15.00 B H +ATOM 1899 CA GLY B 58 13.252 33.967 25.835 1.00 15.00 B C +ATOM 1900 C GLY B 58 13.184 35.068 24.781 1.00 15.00 B C +ATOM 1901 O GLY B 58 12.147 35.684 24.565 1.00 15.00 B O +ATOM 1902 N THR B 59 14.272 35.333 24.139 1.00 15.00 B N +ATOM 1903 HN THR B 59 15.088 34.828 24.337 1.00 15.00 B H +ATOM 1904 CA THR B 59 14.298 36.393 23.106 1.00 15.00 B C +ATOM 1905 CB THR B 59 15.761 36.889 22.938 1.00 15.00 B C +ATOM 1906 OG1 THR B 59 16.191 37.523 24.139 1.00 15.00 B O +ATOM 1907 HG1 THR B 59 16.347 36.858 24.814 1.00 15.00 B H +ATOM 1908 CG2 THR B 59 15.819 37.896 21.778 1.00 15.00 B C +ATOM 1909 C THR B 59 13.828 35.854 21.745 1.00 15.00 B C +ATOM 1910 O THR B 59 14.310 34.838 21.292 1.00 15.00 B O +ATOM 1911 N VAL B 60 12.938 36.561 21.059 1.00 15.00 B N +ATOM 1912 HN VAL B 60 12.570 37.381 21.450 1.00 15.00 B H +ATOM 1913 CA VAL B 60 12.492 36.133 19.716 1.00 15.00 B C +ATOM 1914 CB VAL B 60 11.020 36.566 19.486 1.00 15.00 B C +ATOM 1915 CG1 VAL B 60 10.555 36.204 18.066 1.00 15.00 B C +ATOM 1916 CG2 VAL B 60 10.107 35.952 20.545 1.00 15.00 B C +ATOM 1917 C VAL B 60 13.360 36.857 18.711 1.00 15.00 B C +ATOM 1918 O VAL B 60 13.391 38.083 18.703 1.00 15.00 B O +ATOM 1919 N VAL B 61 14.059 36.157 17.835 1.00 15.00 B N +ATOM 1920 HN VAL B 61 14.052 35.177 17.839 1.00 15.00 B H +ATOM 1921 CA VAL B 61 14.864 36.932 16.833 1.00 15.00 B C +ATOM 1922 CB VAL B 61 16.312 36.441 16.765 1.00 15.00 B C +ATOM 1923 CG1 VAL B 61 17.074 36.774 18.062 1.00 15.00 B C +ATOM 1924 CG2 VAL B 61 16.281 34.931 16.524 1.00 15.00 B C +ATOM 1925 C VAL B 61 14.293 36.732 15.446 1.00 15.00 B C +ATOM 1926 O VAL B 61 13.603 35.745 15.209 1.00 15.00 B O +ATOM 1927 N THR B 62 14.625 37.620 14.502 1.00 15.00 B N +ATOM 1928 HN THR B 62 15.167 38.407 14.720 1.00 15.00 B H +ATOM 1929 CA THR B 62 14.149 37.382 13.113 1.00 15.00 B C +ATOM 1930 CB THR B 62 13.423 38.601 12.484 1.00 15.00 B C +ATOM 1931 OG1 THR B 62 12.316 38.915 13.324 1.00 15.00 B O +ATOM 1932 HG1 THR B 62 11.511 38.563 12.938 1.00 15.00 B H +ATOM 1933 CG2 THR B 62 12.914 38.197 11.088 1.00 15.00 B C +ATOM 1934 C THR B 62 15.386 37.021 12.291 1.00 15.00 B C +ATOM 1935 O THR B 62 16.382 37.717 12.330 1.00 15.00 B O +ATOM 1936 N ILE B 63 15.323 35.952 11.540 1.00 15.00 B N +ATOM 1937 HN ILE B 63 14.505 35.413 11.548 1.00 15.00 B H +ATOM 1938 CA ILE B 63 16.459 35.529 10.672 1.00 15.00 B C +ATOM 1939 CB ILE B 63 16.865 34.022 10.831 1.00 15.00 B C +ATOM 1940 CG1 ILE B 63 17.198 33.728 12.319 1.00 15.00 B C +ATOM 1941 CG2 ILE B 63 18.059 33.733 9.891 1.00 15.00 B C +ATOM 1942 CD1 ILE B 63 17.608 32.259 12.559 1.00 15.00 B C +ATOM 1943 C ILE B 63 15.924 35.795 9.251 1.00 15.00 B C +ATOM 1944 O ILE B 63 14.906 35.258 8.877 1.00 15.00 B O +ATOM 1945 N SER B 64 16.588 36.634 8.493 1.00 15.00 B N +ATOM 1946 HN SER B 64 17.396 37.049 8.861 1.00 15.00 B H +ATOM 1947 CA SER B 64 16.183 36.994 7.099 1.00 15.00 B C +ATOM 1948 CB SER B 64 15.827 38.499 6.933 1.00 15.00 B C +ATOM 1949 OG SER B 64 15.323 39.025 8.147 1.00 15.00 B O +ATOM 1950 HG SER B 64 15.666 39.912 8.279 1.00 15.00 B H +ATOM 1951 C SER B 64 17.357 36.727 6.197 1.00 15.00 B C +ATOM 1952 O SER B 64 18.506 36.929 6.580 1.00 15.00 B O +ATOM 1953 N ALA B 65 17.104 36.323 4.990 1.00 15.00 B N +ATOM 1954 HN ALA B 65 16.184 36.173 4.687 1.00 15.00 B H +ATOM 1955 CA ALA B 65 18.265 36.095 4.081 1.00 15.00 B C +ATOM 1956 CB ALA B 65 18.665 34.633 3.955 1.00 15.00 B C +ATOM 1957 C ALA B 65 17.898 36.569 2.710 1.00 15.00 B C +ATOM 1958 O ALA B 65 16.735 36.574 2.324 1.00 15.00 B O +ATOM 1959 N GLU B 66 18.891 36.937 1.961 1.00 15.00 B N +ATOM 1960 HN GLU B 66 19.809 36.913 2.304 1.00 15.00 B H +ATOM 1961 CA GLU B 66 18.615 37.396 0.571 1.00 15.00 B C +ATOM 1962 CB GLU B 66 18.606 38.934 0.607 1.00 15.00 B C +ATOM 1963 CG GLU B 66 17.597 39.684 -0.288 1.00 15.00 B C +ATOM 1964 CD GLU B 66 17.462 39.109 -1.688 1.00 15.00 B C +ATOM 1965 OE1 GLU B 66 18.262 39.442 -2.552 1.00 15.00 B O +ATOM 1966 OE2 GLU B 66 16.512 38.377 -1.881 1.00 15.00 B O +ATOM 1967 C GLU B 66 19.730 36.869 -0.297 1.00 15.00 B C +ATOM 1968 O GLU B 66 20.875 37.281 -0.180 1.00 15.00 B O +ATOM 1969 N GLY B 67 19.425 35.957 -1.164 1.00 15.00 B N +ATOM 1970 HN GLY B 67 18.506 35.627 -1.246 1.00 15.00 B H +ATOM 1971 CA GLY B 67 20.507 35.436 -2.019 1.00 15.00 B C +ATOM 1972 C GLY B 67 20.029 34.156 -2.681 1.00 15.00 B C +ATOM 1973 O GLY B 67 18.888 33.755 -2.568 1.00 15.00 B O +ATOM 1974 N GLU B 68 20.935 33.536 -3.350 1.00 15.00 B N +ATOM 1975 HN GLU B 68 21.832 33.930 -3.383 1.00 15.00 B H +ATOM 1976 CA GLU B 68 20.711 32.275 -4.068 1.00 15.00 B C +ATOM 1977 CB GLU B 68 22.102 31.787 -4.531 1.00 15.00 B C +ATOM 1978 CG GLU B 68 22.077 31.007 -5.847 1.00 15.00 B C +ATOM 1979 CD GLU B 68 23.504 31.001 -6.399 1.00 15.00 B C +ATOM 1980 OE1 GLU B 68 24.399 30.748 -5.606 1.00 15.00 B O +ATOM 1981 OE2 GLU B 68 23.678 31.278 -7.577 1.00 15.00 B O +ATOM 1982 C GLU B 68 20.142 31.173 -3.184 1.00 15.00 B C +ATOM 1983 O GLU B 68 19.299 30.436 -3.659 1.00 15.00 B O +ATOM 1984 N ASP B 69 20.601 30.990 -1.932 1.00 15.00 B N +ATOM 1985 HN ASP B 69 21.281 31.579 -1.544 1.00 15.00 B H +ATOM 1986 CA ASP B 69 20.024 29.843 -1.157 1.00 15.00 B C +ATOM 1987 CB ASP B 69 21.163 28.906 -0.694 1.00 15.00 B C +ATOM 1988 CG ASP B 69 22.301 29.706 -0.020 1.00 15.00 B C +ATOM 1989 OD1 ASP B 69 22.058 30.827 0.412 1.00 15.00 B O +ATOM 1990 OD2 ASP B 69 23.403 29.176 0.051 1.00 15.00 B O +ATOM 1991 C ASP B 69 19.284 30.403 0.025 1.00 15.00 B C +ATOM 1992 O ASP B 69 19.334 29.849 1.109 1.00 15.00 B O +ATOM 1993 N GLU B 70 18.630 31.531 -0.149 1.00 15.00 B N +ATOM 1994 HN GLU B 70 18.576 31.952 -1.032 1.00 15.00 B H +ATOM 1995 CA GLU B 70 17.973 32.150 1.040 1.00 15.00 B C +ATOM 1996 CB GLU B 70 17.418 33.500 0.593 1.00 15.00 B C +ATOM 1997 CG GLU B 70 16.199 33.364 -0.350 1.00 15.00 B C +ATOM 1998 CD GLU B 70 15.802 34.749 -0.903 1.00 15.00 B C +ATOM 1999 OE1 GLU B 70 16.693 35.470 -1.324 1.00 15.00 B O +ATOM 2000 OE2 GLU B 70 14.618 35.063 -0.902 1.00 15.00 B O +ATOM 2001 C GLU B 70 16.915 31.349 1.803 1.00 15.00 B C +ATOM 2002 O GLU B 70 16.749 31.565 2.995 1.00 15.00 B O +ATOM 2003 N GLN B 71 16.179 30.492 1.206 1.00 15.00 B N +ATOM 2004 HN GLN B 71 16.299 30.309 0.251 1.00 15.00 B H +ATOM 2005 CA GLN B 71 15.119 29.765 2.004 1.00 15.00 B C +ATOM 2006 CB GLN B 71 13.944 29.180 1.160 1.00 15.00 B C +ATOM 2007 CG GLN B 71 13.728 29.752 -0.280 1.00 15.00 B C +ATOM 2008 CD GLN B 71 12.376 30.498 -0.366 1.00 15.00 B C +ATOM 2009 OE1 GLN B 71 12.265 31.586 0.163 1.00 15.00 B O +ATOM 2010 NE2 GLN B 71 11.427 30.084 -1.185 1.00 15.00 B N +ATOM 2011 HE21 GLN B 71 11.603 29.293 -1.735 1.00 15.00 B H +ATOM 2012 HE22 GLN B 71 10.585 30.585 -1.209 1.00 15.00 B H +ATOM 2013 C GLN B 71 15.771 28.642 2.834 1.00 15.00 B C +ATOM 2014 O GLN B 71 15.469 28.439 3.995 1.00 15.00 B O +ATOM 2015 N LYS B 72 16.656 27.934 2.225 1.00 15.00 B N +ATOM 2016 HN LYS B 72 16.854 28.136 1.287 1.00 15.00 B H +ATOM 2017 CA LYS B 72 17.375 26.846 2.870 1.00 15.00 B C +ATOM 2018 CB LYS B 72 18.355 26.160 1.898 1.00 15.00 B C +ATOM 2019 CG LYS B 72 18.606 24.736 2.440 1.00 15.00 B C +ATOM 2020 CD LYS B 72 19.641 23.986 1.580 1.00 15.00 B C +ATOM 2021 CE LYS B 72 21.014 24.023 2.246 1.00 15.00 B C +ATOM 2022 NZ LYS B 72 21.027 23.108 3.427 1.00 15.00 B N +ATOM 2023 HZ1 LYS B 72 22.005 22.846 3.665 1.00 15.00 B H +ATOM 2024 HZ2 LYS B 72 20.488 22.244 3.218 1.00 15.00 B H +ATOM 2025 HZ3 LYS B 72 20.598 23.582 4.246 1.00 15.00 B H +ATOM 2026 C LYS B 72 18.199 27.462 3.991 1.00 15.00 B C +ATOM 2027 O LYS B 72 18.319 26.898 5.057 1.00 15.00 B O +ATOM 2028 N ALA B 73 18.810 28.627 3.743 1.00 15.00 B N +ATOM 2029 HN ALA B 73 18.704 29.075 2.878 1.00 15.00 B H +ATOM 2030 CA ALA B 73 19.652 29.223 4.810 1.00 15.00 B C +ATOM 2031 CB ALA B 73 20.334 30.492 4.259 1.00 15.00 B C +ATOM 2032 C ALA B 73 18.807 29.550 6.049 1.00 15.00 B C +ATOM 2033 O ALA B 73 19.191 29.239 7.159 1.00 15.00 B O +ATOM 2034 N VAL B 74 17.676 30.170 5.873 1.00 15.00 B N +ATOM 2035 HN VAL B 74 17.386 30.398 4.965 1.00 15.00 B H +ATOM 2036 CA VAL B 74 16.807 30.541 7.045 1.00 15.00 B C +ATOM 2037 CB VAL B 74 15.705 31.532 6.593 1.00 15.00 B C +ATOM 2038 CG1 VAL B 74 14.668 31.781 7.705 1.00 15.00 B C +ATOM 2039 CG2 VAL B 74 16.361 32.865 6.167 1.00 15.00 B C +ATOM 2040 C VAL B 74 16.243 29.267 7.650 1.00 15.00 B C +ATOM 2041 O VAL B 74 16.155 29.130 8.866 1.00 15.00 B O +ATOM 2042 N GLU B 75 15.871 28.332 6.806 1.00 15.00 B N +ATOM 2043 HN GLU B 75 15.969 28.472 5.841 1.00 15.00 B H +ATOM 2044 CA GLU B 75 15.294 27.046 7.326 1.00 15.00 B C +ATOM 2045 CB GLU B 75 14.881 26.071 6.189 1.00 15.00 B C +ATOM 2046 CG GLU B 75 13.539 26.619 5.658 1.00 15.00 B C +ATOM 2047 CD GLU B 75 13.027 25.980 4.367 1.00 15.00 B C +ATOM 2048 OE1 GLU B 75 13.613 25.028 3.877 1.00 15.00 B O +ATOM 2049 OE2 GLU B 75 12.027 26.495 3.882 1.00 15.00 B O +ATOM 2050 C GLU B 75 16.283 26.387 8.243 1.00 15.00 B C +ATOM 2051 O GLU B 75 15.953 25.933 9.326 1.00 15.00 B O +ATOM 2052 N HIS B 76 17.492 26.324 7.819 1.00 15.00 B N +ATOM 2053 HN HIS B 76 17.725 26.704 6.946 1.00 15.00 B H +ATOM 2054 CA HIS B 76 18.525 25.686 8.637 1.00 15.00 B C +ATOM 2055 CB HIS B 76 19.771 25.441 7.750 1.00 15.00 B C +ATOM 2056 CG HIS B 76 19.368 24.390 6.747 1.00 15.00 B C +ATOM 2057 ND1 HIS B 76 20.129 23.266 6.459 1.00 15.00 B N +ATOM 2058 HD1 HIS B 76 21.007 23.039 6.832 1.00 15.00 B H +ATOM 2059 CD2 HIS B 76 18.234 24.270 5.991 1.00 15.00 B C +ATOM 2060 CE1 HIS B 76 19.435 22.533 5.561 1.00 15.00 B C +ATOM 2061 NE2 HIS B 76 18.278 23.105 5.247 1.00 15.00 B N +ATOM 2062 C HIS B 76 18.900 26.490 9.861 1.00 15.00 B C +ATOM 2063 O HIS B 76 19.221 25.910 10.884 1.00 15.00 B O +ATOM 2064 N LEU B 77 18.922 27.789 9.794 1.00 15.00 B N +ATOM 2065 HN LEU B 77 18.639 28.254 8.979 1.00 15.00 B H +ATOM 2066 CA LEU B 77 19.387 28.553 10.985 1.00 15.00 B C +ATOM 2067 CB LEU B 77 19.939 29.927 10.535 1.00 15.00 B C +ATOM 2068 CG LEU B 77 21.229 29.750 9.700 1.00 15.00 B C +ATOM 2069 CD1 LEU B 77 21.642 31.122 9.180 1.00 15.00 B C +ATOM 2070 CD2 LEU B 77 22.399 29.243 10.560 1.00 15.00 B C +ATOM 2071 C LEU B 77 18.312 28.674 12.023 1.00 15.00 B C +ATOM 2072 O LEU B 77 18.603 28.822 13.199 1.00 15.00 B O +ATOM 2073 N VAL B 78 17.091 28.596 11.620 1.00 15.00 B N +ATOM 2074 HN VAL B 78 16.894 28.472 10.668 1.00 15.00 B H +ATOM 2075 CA VAL B 78 16.008 28.692 12.580 1.00 15.00 B C +ATOM 2076 CB VAL B 78 14.735 28.939 11.757 1.00 15.00 B C +ATOM 2077 CG1 VAL B 78 13.539 28.310 12.469 1.00 15.00 B C +ATOM 2078 CG2 VAL B 78 14.463 30.445 11.623 1.00 15.00 B C +ATOM 2079 C VAL B 78 16.003 27.377 13.351 1.00 15.00 B C +ATOM 2080 O VAL B 78 15.791 27.343 14.554 1.00 15.00 B O +ATOM 2081 N LYS B 79 16.249 26.299 12.641 1.00 15.00 B N +ATOM 2082 HN LYS B 79 16.421 26.377 11.679 1.00 15.00 B H +ATOM 2083 CA LYS B 79 16.268 24.971 13.286 1.00 15.00 B C +ATOM 2084 CB LYS B 79 16.265 23.894 12.222 1.00 15.00 B C +ATOM 2085 CG LYS B 79 16.173 22.539 12.911 1.00 15.00 B C +ATOM 2086 CD LYS B 79 15.783 21.467 11.871 1.00 15.00 B C +ATOM 2087 CE LYS B 79 16.881 20.402 11.748 1.00 15.00 B C +ATOM 2088 NZ LYS B 79 17.160 20.233 10.304 1.00 15.00 B N +ATOM 2089 HZ1 LYS B 79 17.481 21.133 9.894 1.00 15.00 B H +ATOM 2090 HZ2 LYS B 79 16.300 19.926 9.807 1.00 15.00 B H +ATOM 2091 HZ3 LYS B 79 17.902 19.517 10.165 1.00 15.00 B H +ATOM 2092 C LYS B 79 17.490 24.920 14.197 1.00 15.00 B C +ATOM 2093 O LYS B 79 17.394 24.574 15.362 1.00 15.00 B O +ATOM 2094 N LEU B 80 18.638 25.300 13.704 1.00 15.00 B N +ATOM 2095 HN LEU B 80 18.714 25.566 12.764 1.00 15.00 B H +ATOM 2096 CA LEU B 80 19.809 25.322 14.581 1.00 15.00 B C +ATOM 2097 CB LEU B 80 20.977 25.916 13.778 1.00 15.00 B C +ATOM 2098 CG LEU B 80 22.248 25.864 14.593 1.00 15.00 B C +ATOM 2099 CD1 LEU B 80 22.514 24.445 15.113 1.00 15.00 B C +ATOM 2100 CD2 LEU B 80 23.416 26.304 13.731 1.00 15.00 B C +ATOM 2101 C LEU B 80 19.541 26.193 15.829 1.00 15.00 B C +ATOM 2102 O LEU B 80 19.814 25.796 16.949 1.00 15.00 B O +ATOM 2103 N MET B 81 19.009 27.376 15.650 1.00 15.00 B N +ATOM 2104 HN MET B 81 18.766 27.669 14.747 1.00 15.00 B H +ATOM 2105 CA MET B 81 18.772 28.275 16.803 1.00 15.00 B C +ATOM 2106 CB MET B 81 18.237 29.656 16.365 1.00 15.00 B C +ATOM 2107 CG MET B 81 18.560 30.632 17.519 1.00 15.00 B C +ATOM 2108 SD MET B 81 18.693 32.312 16.876 1.00 15.00 B S +ATOM 2109 CE MET B 81 20.484 32.566 17.066 1.00 15.00 B C +ATOM 2110 C MET B 81 17.807 27.701 17.833 1.00 15.00 B C +ATOM 2111 O MET B 81 17.933 27.941 19.021 1.00 15.00 B O +ATOM 2112 N ALA B 82 16.837 26.983 17.400 1.00 15.00 B N +ATOM 2113 HN ALA B 82 16.749 26.807 16.440 1.00 15.00 B H +ATOM 2114 CA ALA B 82 15.837 26.413 18.361 1.00 15.00 B C +ATOM 2115 CB ALA B 82 14.538 26.054 17.626 1.00 15.00 B C +ATOM 2116 C ALA B 82 16.461 25.188 19.064 1.00 15.00 B C +ATOM 2117 O ALA B 82 16.140 24.892 20.199 1.00 15.00 B O +ATOM 2118 N GLU B 83 17.366 24.497 18.390 1.00 15.00 B N +ATOM 2119 HN GLU B 83 17.590 24.783 17.480 1.00 15.00 B H +ATOM 2120 CA GLU B 83 18.059 23.308 18.950 1.00 15.00 B C +ATOM 2121 CB GLU B 83 18.873 22.627 17.841 1.00 15.00 B C +ATOM 2122 CG GLU B 83 18.067 21.572 17.098 1.00 15.00 B C +ATOM 2123 CD GLU B 83 18.747 21.236 15.761 1.00 15.00 B C +ATOM 2124 OE1 GLU B 83 19.692 21.925 15.393 1.00 15.00 B O +ATOM 2125 OE2 GLU B 83 18.303 20.297 15.124 1.00 15.00 B O +ATOM 2126 C GLU B 83 19.156 23.708 19.954 1.00 15.00 B C +ATOM 2127 O GLU B 83 19.446 23.005 20.896 1.00 15.00 B O +ATOM 2128 N LEU B 84 19.834 24.791 19.676 1.00 15.00 B N +ATOM 2129 HN LEU B 84 19.588 25.326 18.893 1.00 15.00 B H +ATOM 2130 CA LEU B 84 20.966 25.223 20.523 1.00 15.00 B C +ATOM 2131 CB LEU B 84 21.588 26.445 19.840 1.00 15.00 B C +ATOM 2132 CG LEU B 84 22.725 26.110 18.848 1.00 15.00 B C +ATOM 2133 CD1 LEU B 84 22.733 24.651 18.365 1.00 15.00 B C +ATOM 2134 CD2 LEU B 84 22.539 27.020 17.654 1.00 15.00 B C +ATOM 2135 C LEU B 84 20.582 25.387 22.015 1.00 15.00 B C +ATOM 2136 O LEU B 84 19.632 26.008 22.441 1.00 15.00 B O +ATOM 2137 N GLU B 85 21.427 24.691 22.731 1.00 15.00 B N +ATOM 2138 HN GLU B 85 22.124 24.248 22.205 1.00 15.00 B H +ATOM 2139 CA GLU B 85 21.525 24.453 24.184 1.00 15.00 B C +ATOM 2140 CB GLU B 85 22.141 23.025 24.360 1.00 15.00 B C +ATOM 2141 CG GLU B 85 22.868 22.434 23.118 1.00 15.00 B C +ATOM 2142 CD GLU B 85 24.090 23.197 22.572 1.00 15.00 B C +ATOM 2143 OE1 GLU B 85 24.772 23.914 23.293 1.00 15.00 B O +ATOM 2144 OE2 GLU B 85 24.340 22.985 21.394 1.00 15.00 B O +ATOM 2145 C GLU B 85 22.437 25.489 24.855 1.00 15.00 B C +ATOM 2146 O GLU B 85 22.762 26.544 24.297 1.00 15.00 B O +END diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.psf b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.psf new file mode 100644 index 000000000..9369e3141 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.psf @@ -0,0 +1,16430 @@ +data_cns_mtf + +_cns_mtf.title +; FILENAME="prot-prot_haddock.psf" + Patching histidine 75 to HISD + Patching histidine 90 to HISD + Patching histidine 76 to HISD + Patching histidine 15 to HISE + DATE:01-Oct-2024 16:32:30 created by user: unknown + VERSION:1.3U +; + +loop_ +_cns_mtf_atom.id +_cns_mtf_atom.segment_id +_cns_mtf_atom.residue_id +_cns_mtf_atom.residue_name +_cns_mtf_atom.atom_name +_cns_mtf_atom.chemical_type +_cns_mtf_atom.charge +_cns_mtf_atom.atom_mass +1 'A' '19' 'THR' 'N' 'NH1' -0.570000 14.0070 +2 'A' '19' 'THR' 'HN' 'H' 0.370000 1.00800 +3 'A' '19' 'THR' 'CA' 'CH1E' 0.200000 12.0110 +4 'A' '19' 'THR' 'CB' 'CH1E' 0.265000 12.0110 +5 'A' '19' 'THR' 'OG1' 'OH1' -0.700000 15.9990 +6 'A' '19' 'THR' 'HG1' 'H' 0.435000 1.00800 +7 'A' '19' 'THR' 'CG2' 'CH3E' -0.00000 12.0110 +8 'A' '19' 'THR' 'C' 'C' 0.500000 12.0110 +9 'A' '19' 'THR' 'O' 'O' -0.500000 15.9990 +10 'A' '20' 'ILE' 'N' 'NH1' -0.570000 14.0070 +11 'A' '20' 'ILE' 'HN' 'H' 0.370000 1.00800 +12 'A' '20' 'ILE' 'CA' 'CH1E' 0.200000 12.0110 +13 'A' '20' 'ILE' 'CB' 'CH1E' 0.00000 12.0110 +14 'A' '20' 'ILE' 'CG1' 'CH2E' 0.00000 12.0110 +15 'A' '20' 'ILE' 'CG2' 'CH3E' 0.00000 12.0110 +16 'A' '20' 'ILE' 'CD1' 'CH3E' 0.00000 12.0110 +17 'A' '20' 'ILE' 'C' 'C' 0.500000 12.0110 +18 'A' '20' 'ILE' 'O' 'O' -0.500000 15.9990 +19 'A' '21' 'GLU' 'N' 'NH1' -0.570000 14.0070 +20 'A' '21' 'GLU' 'HN' 'H' 0.370000 1.00800 +21 'A' '21' 'GLU' 'CA' 'CH1E' 0.200000 12.0110 +22 'A' '21' 'GLU' 'CB' 'CH2E' 0.00000 12.0110 +23 'A' '21' 'GLU' 'CG' 'CH2E' -0.100000 12.0110 +24 'A' '21' 'GLU' 'CD' 'C' 0.700000 12.0110 +25 'A' '21' 'GLU' 'OE1' 'OC' -0.800000 15.9990 +26 'A' '21' 'GLU' 'OE2' 'OC' -0.800000 15.9990 +27 'A' '21' 'GLU' 'C' 'C' 0.500000 12.0110 +28 'A' '21' 'GLU' 'O' 'O' -0.500000 15.9990 +29 'A' '22' 'ILE' 'N' 'NH1' -0.570000 14.0070 +30 'A' '22' 'ILE' 'HN' 'H' 0.370000 1.00800 +31 'A' '22' 'ILE' 'CA' 'CH1E' 0.200000 12.0110 +32 'A' '22' 'ILE' 'CB' 'CH1E' 0.00000 12.0110 +33 'A' '22' 'ILE' 'CG1' 'CH2E' 0.00000 12.0110 +34 'A' '22' 'ILE' 'CG2' 'CH3E' 0.00000 12.0110 +35 'A' '22' 'ILE' 'CD1' 'CH3E' 0.00000 12.0110 +36 'A' '22' 'ILE' 'C' 'C' 0.500000 12.0110 +37 'A' '22' 'ILE' 'O' 'O' -0.500000 15.9990 +38 'A' '23' 'ILE' 'N' 'NH1' -0.570000 14.0070 +39 'A' '23' 'ILE' 'HN' 'H' 0.370000 1.00800 +40 'A' '23' 'ILE' 'CA' 'CH1E' 0.200000 12.0110 +41 'A' '23' 'ILE' 'CB' 'CH1E' 0.00000 12.0110 +42 'A' '23' 'ILE' 'CG1' 'CH2E' 0.00000 12.0110 +43 'A' '23' 'ILE' 'CG2' 'CH3E' 0.00000 12.0110 +44 'A' '23' 'ILE' 'CD1' 'CH3E' 0.00000 12.0110 +45 'A' '23' 'ILE' 'C' 'C' 0.500000 12.0110 +46 'A' '23' 'ILE' 'O' 'O' -0.500000 15.9990 +47 'A' '24' 'ALA' 'N' 'NH1' -0.570000 14.0070 +48 'A' '24' 'ALA' 'HN' 'H' 0.370000 1.00800 +49 'A' '24' 'ALA' 'CA' 'CH1E' 0.200000 12.0110 +50 'A' '24' 'ALA' 'CB' 'CH3E' 0.00000 12.0110 +51 'A' '24' 'ALA' 'C' 'C' 0.500000 12.0110 +52 'A' '24' 'ALA' 'O' 'O' -0.500000 15.9990 +53 'A' '25' 'PRO' 'N' 'N' -0.570000 14.0070 +54 'A' '25' 'PRO' 'CA' 'CH1E' 0.285000 12.0110 +55 'A' '25' 'PRO' 'CB' 'CH2E' 0.00000 12.0110 +56 'A' '25' 'PRO' 'CG' 'CH2P' 0.00000 12.0110 +57 'A' '25' 'PRO' 'CD' 'CH2P' 0.285000 12.0110 +58 'A' '25' 'PRO' 'C' 'C' 0.500000 12.0110 +59 'A' '25' 'PRO' 'O' 'O' -0.500000 15.9990 +60 'A' '26' 'LEU' 'N' 'NH1' -0.570000 14.0070 +61 'A' '26' 'LEU' 'HN' 'H' 0.370000 1.00800 +62 'A' '26' 'LEU' 'CA' 'CH1E' 0.200000 12.0110 +63 'A' '26' 'LEU' 'CB' 'CH2E' 0.00000 12.0110 +64 'A' '26' 'LEU' 'CG' 'CH1E' 0.00000 12.0110 +65 'A' '26' 'LEU' 'CD1' 'CH3E' 0.00000 12.0110 +66 'A' '26' 'LEU' 'CD2' 'CH3E' 0.00000 12.0110 +67 'A' '26' 'LEU' 'C' 'C' 0.500000 12.0110 +68 'A' '26' 'LEU' 'O' 'O' -0.500000 15.9990 +69 'A' '27' 'SER' 'N' 'NH1' -0.570000 14.0070 +70 'A' '27' 'SER' 'HN' 'H' 0.370000 1.00800 +71 'A' '27' 'SER' 'CA' 'CH1E' 0.200000 12.0110 +72 'A' '27' 'SER' 'CB' 'CH2E' 0.265000 12.0110 +73 'A' '27' 'SER' 'OG' 'OH1' -0.700000 15.9990 +74 'A' '27' 'SER' 'HG' 'H' 0.435000 1.00800 +75 'A' '27' 'SER' 'C' 'C' 0.500000 12.0110 +76 'A' '27' 'SER' 'O' 'O' -0.500000 15.9990 +77 'A' '28' 'GLY' 'N' 'NH1' -0.570000 14.0070 +78 'A' '28' 'GLY' 'HN' 'H' 0.370000 1.00800 +79 'A' '28' 'GLY' 'CA' 'CH2G' 0.200000 12.0110 +80 'A' '28' 'GLY' 'C' 'C' 0.500000 12.0110 +81 'A' '28' 'GLY' 'O' 'O' -0.500000 15.9990 +82 'A' '29' 'GLU' 'N' 'NH1' -0.570000 14.0070 +83 'A' '29' 'GLU' 'HN' 'H' 0.370000 1.00800 +84 'A' '29' 'GLU' 'CA' 'CH1E' 0.200000 12.0110 +85 'A' '29' 'GLU' 'CB' 'CH2E' 0.00000 12.0110 +86 'A' '29' 'GLU' 'CG' 'CH2E' -0.100000 12.0110 +87 'A' '29' 'GLU' 'CD' 'C' 0.700000 12.0110 +88 'A' '29' 'GLU' 'OE1' 'OC' -0.800000 15.9990 +89 'A' '29' 'GLU' 'OE2' 'OC' -0.800000 15.9990 +90 'A' '29' 'GLU' 'C' 'C' 0.500000 12.0110 +91 'A' '29' 'GLU' 'O' 'O' -0.500000 15.9990 +92 'A' '30' 'ILE' 'N' 'NH1' -0.570000 14.0070 +93 'A' '30' 'ILE' 'HN' 'H' 0.370000 1.00800 +94 'A' '30' 'ILE' 'CA' 'CH1E' 0.200000 12.0110 +95 'A' '30' 'ILE' 'CB' 'CH1E' 0.00000 12.0110 +96 'A' '30' 'ILE' 'CG1' 'CH2E' 0.00000 12.0110 +97 'A' '30' 'ILE' 'CG2' 'CH3E' 0.00000 12.0110 +98 'A' '30' 'ILE' 'CD1' 'CH3E' 0.00000 12.0110 +99 'A' '30' 'ILE' 'C' 'C' 0.500000 12.0110 +100 'A' '30' 'ILE' 'O' 'O' -0.500000 15.9990 +101 'A' '31' 'VAL' 'N' 'NH1' -0.570000 14.0070 +102 'A' '31' 'VAL' 'HN' 'H' 0.370000 1.00800 +103 'A' '31' 'VAL' 'CA' 'CH1E' 0.200000 12.0110 +104 'A' '31' 'VAL' 'CB' 'CH1E' 0.00000 12.0110 +105 'A' '31' 'VAL' 'CG1' 'CH3E' 0.00000 12.0110 +106 'A' '31' 'VAL' 'CG2' 'CH3E' -0.00000 12.0110 +107 'A' '31' 'VAL' 'C' 'C' 0.500000 12.0110 +108 'A' '31' 'VAL' 'O' 'O' -0.500000 15.9990 +109 'A' '32' 'ASN' 'N' 'NH1' -0.570000 14.0070 +110 'A' '32' 'ASN' 'HN' 'H' 0.370000 1.00800 +111 'A' '32' 'ASN' 'CA' 'CH1E' 0.200000 12.0110 +112 'A' '32' 'ASN' 'CB' 'CH2E' -0.00000 12.0110 +113 'A' '32' 'ASN' 'CG' 'C' 0.500000 12.0110 +114 'A' '32' 'ASN' 'OD1' 'O' -0.500000 15.9990 +115 'A' '32' 'ASN' 'ND2' 'NH2' -0.850000 14.0070 +116 'A' '32' 'ASN' 'HD21' 'H' 0.425000 1.00800 +117 'A' '32' 'ASN' 'HD22' 'H' 0.425000 1.00800 +118 'A' '32' 'ASN' 'C' 'C' 0.500000 12.0110 +119 'A' '32' 'ASN' 'O' 'O' 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"py/id": 12 + } + ] +} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/params.cfg b/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/params.cfg new file mode 100644 index 000000000..71a71b803 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/params.cfg @@ -0,0 +1,20 @@ +[prodigy] +cns_exec = "" +ncores = 4 +max_cpus = true +mode = "local" +batch_type = "slurm" +queue = "" +queue_limit = 100 +concat = 1 +self_contained = false +clean = false +offline = false +scoring_mode = "protein" +chains = [ "A", "B",] +ligand_resname = "UNK" +ligand_chain = "B" +distance_cutoff = nan +accessibility_cutoff = 0.05 +temperature = 25.0 +to_pkd = true diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/prodigy.tsv b/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/prodigy.tsv new file mode 100644 index 000000000..febe06959 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/prodigy.tsv @@ -0,0 +1,3 @@ +structure original_name md5 score +prot-prot_haddock.pdb prot-prot None -6.61 +homotrimer_haddock.pdb homotrimer None None diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/homotrimer.pdb b/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/homotrimer.pdb new file mode 100644 index 000000000..e1a9c00fd --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/homotrimer.pdb @@ -0,0 +1,2842 @@ +ATOM 1 N SER A 2 59.687 62.109 75.379 1.00 16.24 A +ATOM 2 CA SER A 2 58.545 61.990 74.424 1.00 15.30 A +ATOM 3 C SER A 2 57.256 61.682 75.199 1.00 13.90 A +ATOM 4 O SER A 2 57.298 61.094 76.306 1.00 15.02 A +ATOM 5 CB SER A 2 58.796 60.983 73.331 1.00 16.11 A +ATOM 6 OG SER A 2 58.666 59.642 73.778 1.00 18.37 A +ATOM 7 N LYS A 3 56.142 62.095 74.598 1.00 12.13 A +ATOM 8 CA LYS A 3 54.855 61.881 75.274 1.00 11.35 A +ATOM 9 C LYS A 3 53.732 61.619 74.285 1.00 8.65 A +ATOM 10 O LYS A 3 53.724 61.974 73.102 1.00 7.83 A +ATOM 11 CB LYS A 3 54.508 63.089 76.165 1.00 13.69 A +ATOM 12 CG LYS A 3 54.208 64.314 75.337 1.00 15.79 A +ATOM 13 CD LYS A 3 54.056 65.631 76.074 1.00 17.79 A +ATOM 14 CE LYS A 3 55.391 66.208 76.498 1.00 18.86 A +ATOM 15 NZ LYS A 3 55.266 67.628 76.966 1.00 20.35 A +ATOM 16 N THR A 4 52.734 60.953 74.837 1.00 7.14 A +ATOM 17 CA THR A 4 51.526 60.662 74.068 1.00 6.44 A +ATOM 18 C THR A 4 50.711 61.943 73.856 1.00 5.57 A +ATOM 19 O THR A 4 50.616 62.800 74.785 1.00 6.47 A +ATOM 20 CB THR A 4 50.619 59.713 74.950 1.00 7.10 A +ATOM 21 OG1 THR A 4 51.320 58.447 75.034 1.00 8.40 A +ATOM 22 CG2 THR A 4 49.209 59.526 74.383 1.00 7.78 A +ATOM 23 N ILE A 5 50.115 62.056 72.684 1.00 4.90 A +ATOM 24 CA ILE A 5 49.139 63.114 72.395 1.00 5.03 A +ATOM 25 C ILE A 5 47.762 62.401 72.500 1.00 5.26 A +ATOM 26 O ILE A 5 47.535 61.375 71.875 1.00 5.95 A +ATOM 27 CB ILE A 5 49.304 63.748 70.997 1.00 5.22 A +ATOM 28 CG1 ILE A 5 50.722 64.326 70.810 1.00 5.41 A +ATOM 29 CG2 ILE A 5 48.204 64.802 70.734 1.00 6.47 A +ATOM 30 CD1 ILE A 5 51.050 64.678 69.334 1.00 4.98 A +ATOM 31 N ALA A 6 46.901 62.990 73.340 1.00 5.80 A +ATOM 32 CA ALA A 6 45.548 62.428 73.548 1.00 7.32 A +ATOM 33 C ALA A 6 44.573 63.599 73.578 1.00 7.57 A +ATOM 34 O ALA A 6 44.680 64.516 74.414 1.00 10.07 A +ATOM 35 CB ALA A 6 45.481 61.583 74.808 1.00 8.24 A +ATOM 36 N THR A 7 43.666 63.612 72.613 1.00 6.19 A +ATOM 37 CA THR A 7 42.676 64.681 72.481 1.00 6.55 A +ATOM 38 C THR A 7 41.286 64.145 72.188 1.00 5.76 A +ATOM 39 O THR A 7 41.146 63.171 71.468 1.00 6.20 A +ATOM 40 CB THR A 7 43.117 65.663 71.330 1.00 7.01 A +ATOM 41 OG1 THR A 7 42.032 66.622 71.214 1.00 7.16 A +ATOM 42 CG2 THR A 7 43.363 65.012 69.980 1.00 7.30 A +ATOM 43 N GLU A 8 40.282 64.754 72.807 1.00 6.37 A +ATOM 44 CA GLU A 8 38.895 64.376 72.568 1.00 6.48 A +ATOM 45 C GLU A 8 38.497 64.803 71.162 1.00 6.14 A +ATOM 46 O GLU A 8 37.460 64.341 70.650 1.00 6.07 A +ATOM 47 CB GLU A 8 37.922 65.033 73.559 1.00 7.91 A +ATOM 48 CG GLU A 8 37.722 66.540 73.490 1.00 9.70 A +ATOM 49 CD GLU A 8 38.814 67.395 74.051 1.00 11.36 A +ATOM 50 OE1 GLU A 8 39.958 66.979 74.261 1.00 12.18 A +ATOM 51 OE2 GLU A 8 38.489 68.603 74.276 1.00 13.35 A +ATOM 52 N ASN A 9 39.286 65.675 70.529 1.00 6.75 A +ATOM 53 CA ASN A 9 38.967 66.220 69.204 1.00 7.05 A +ATOM 54 C ASN A 9 39.238 65.308 68.025 1.00 7.06 A +ATOM 55 O ASN A 9 38.959 65.680 66.872 1.00 6.95 A +ATOM 56 CB ASN A 9 39.590 67.590 69.019 1.00 7.91 A +ATOM 57 CG ASN A 9 39.030 68.573 70.034 1.00 9.05 A +ATOM 58 OD1 ASN A 9 37.816 68.514 70.332 1.00 10.43 A +ATOM 59 ND2 ASN A 9 39.902 69.410 70.545 1.00 9.59 A +ATOM 60 N ALA A 10 39.839 64.140 68.250 1.00 5.82 A +ATOM 61 CA ALA A 10 40.069 63.131 67.198 1.00 5.77 A +ATOM 62 C ALA A 10 39.464 61.835 67.795 1.00 6.13 A +ATOM 63 O ALA A 10 39.310 61.744 69.012 1.00 5.80 A +ATOM 64 CB ALA A 10 41.527 62.935 66.850 1.00 6.12 A +ATOM 65 N PRO A 11 39.127 60.887 66.939 1.00 6.62 A +ATOM 66 CA PRO A 11 38.556 59.626 67.427 1.00 6.86 A +ATOM 67 C PRO A 11 39.432 58.991 68.470 1.00 6.78 A +ATOM 68 O PRO A 11 40.681 58.925 68.299 1.00 6.19 A +ATOM 69 CB PRO A 11 38.483 58.750 66.191 1.00 7.77 A +ATOM 70 CG PRO A 11 38.512 59.680 65.012 1.00 8.11 A +ATOM 71 CD PRO A 11 39.270 60.918 65.475 1.00 7.42 A +ATOM 72 N ALA A 12 38.830 58.469 69.527 1.00 8.21 A +ATOM 73 CA ALA A 12 39.572 57.836 70.624 1.00 9.55 A +ATOM 74 C ALA A 12 40.348 56.629 70.099 1.00 10.63 A +ATOM 75 O ALA A 12 39.905 55.909 69.197 1.00 9.79 A +ATOM 76 CB ALA A 12 38.589 57.344 71.687 1.00 10.50 A +ATOM 77 N ALA A 13 41.520 56.468 70.685 1.00 11.95 A +ATOM 78 CA ALA A 13 42.435 55.363 70.356 1.00 14.35 A +ATOM 79 C ALA A 13 42.006 54.159 71.201 1.00 15.86 A +ATOM 80 O ALA A 13 42.446 54.077 72.361 1.00 17.22 A +ATOM 81 CB ALA A 13 43.882 55.728 70.640 1.00 14.52 A +ATOM 82 N ILE A 14 41.192 53.335 70.571 1.00 16.89 A +ATOM 83 CA ILE A 14 40.701 52.121 71.268 1.00 18.21 A +ATOM 84 C ILE A 14 41.712 50.983 71.151 1.00 18.11 A +ATOM 85 O ILE A 14 42.096 50.420 72.218 1.00 19.37 A +ATOM 86 CB ILE A 14 39.249 51.808 70.805 1.00 19.06 A +ATOM 87 CG1 ILE A 14 38.352 53.063 71.045 1.00 19.75 A +ATOM 88 CG2 ILE A 14 38.616 50.571 71.498 1.00 19.75 A +ATOM 89 CD1 ILE A 14 36.972 52.904 70.339 1.00 20.29 A +ATOM 90 N GLY A 15 42.164 50.671 69.955 1.00 17.28 A +ATOM 91 CA GLY A 15 43.173 49.589 69.783 1.00 15.10 A +ATOM 92 C GLY A 15 44.499 49.929 70.474 1.00 13.16 A +ATOM 93 O GLY A 15 44.655 50.901 71.233 1.00 14.07 A +ATOM 94 N PRO A 16 45.491 49.082 70.180 1.00 11.29 A +ATOM 95 CA PRO A 16 46.834 49.214 70.743 1.00 9.14 A +ATOM 96 C PRO A 16 47.663 50.263 70.025 1.00 8.00 A +ATOM 97 O PRO A 16 48.680 49.940 69.393 1.00 6.68 A +ATOM 98 CB PRO A 16 47.384 47.790 70.627 1.00 9.25 A +ATOM 99 CG PRO A 16 46.821 47.323 69.299 1.00 9.12 A +ATOM 100 CD PRO A 16 45.393 47.874 69.312 1.00 10.61 A +ATOM 101 N TYR A 17 47.238 51.512 70.158 1.00 6.92 A +ATOM 102 CA TYR A 17 47.969 52.643 69.552 1.00 6.14 A +ATOM 103 C TYR A 17 47.559 53.900 70.301 1.00 5.54 A +ATOM 104 O TYR A 17 46.568 53.863 71.069 1.00 7.15 A +ATOM 105 CB TYR A 17 47.653 52.770 68.038 1.00 6.78 A +ATOM 106 CG TYR A 17 46.184 53.035 67.760 1.00 7.73 A +ATOM 107 CD1 TYR A 17 45.725 54.354 67.570 1.00 8.18 A +ATOM 108 CD2 TYR A 17 45.220 52.031 67.736 1.00 8.87 A +ATOM 109 CE1 TYR A 17 44.386 54.645 67.316 1.00 9.51 A +ATOM 110 CE2 TYR A 17 43.868 52.309 67.498 1.00 10.50 A +ATOM 111 CZ TYR A 17 43.463 53.612 67.302 1.00 10.45 A +ATOM 112 OH TYR A 17 42.136 53.906 67.069 1.00 12.81 A +ATOM 113 N VAL A 18 48.285 54.974 70.101 1.00 5.53 A +ATOM 114 CA VAL A 18 47.936 56.302 70.616 1.00 5.01 A +ATOM 115 C VAL A 18 47.657 57.143 69.366 1.00 5.01 A +ATOM 116 O VAL A 18 48.112 56.823 68.264 1.00 5.04 A +ATOM 117 CB VAL A 18 48.995 56.929 71.510 1.00 5.59 A +ATOM 118 CG1 VAL A 18 49.086 56.116 72.797 1.00 6.33 A +ATOM 119 CG2 VAL A 18 50.342 57.091 70.825 1.00 6.00 A +ATOM 120 N GLN A 19 46.945 58.244 69.553 1.00 4.48 A +ATOM 121 CA GLN A 19 46.600 59.142 68.446 1.00 4.00 A +ATOM 122 C GLN A 19 47.834 59.775 67.805 1.00 3.80 A +ATOM 123 O GLN A 19 47.857 60.035 66.598 1.00 3.75 A +ATOM 124 CB GLN A 19 45.663 60.267 68.895 1.00 5.03 A +ATOM 125 CG GLN A 19 44.310 59.743 69.363 1.00 5.44 A +ATOM 126 CD GLN A 19 43.542 60.837 70.048 1.00 5.87 A +ATOM 127 OE1 GLN A 19 44.130 61.623 70.789 1.00 7.44 A +ATOM 128 NE2 GLN A 19 42.220 60.896 69.850 1.00 6.86 A +ATOM 129 N GLY A 20 48.826 60.101 68.629 1.00 4.08 A +ATOM 130 CA GLY A 20 50.054 60.731 68.083 1.00 3.84 A +ATOM 131 C GLY A 20 51.077 60.795 69.194 1.00 3.63 A +ATOM 132 O GLY A 20 50.763 60.515 70.366 1.00 3.92 A +ATOM 133 N VAL A 21 52.293 61.175 68.820 1.00 3.33 A +ATOM 134 CA VAL A 21 53.390 61.313 69.766 1.00 3.95 A +ATOM 135 C VAL A 21 54.047 62.676 69.576 1.00 3.79 A +ATOM 136 O VAL A 21 54.224 63.146 68.449 1.00 4.94 A +ATOM 137 CB VAL A 21 54.401 60.160 69.624 1.00 3.78 A +ATOM 138 CG1 VAL A 21 53.754 58.864 70.091 1.00 4.83 A +ATOM 139 CG2 VAL A 21 54.888 60.047 68.190 1.00 4.51 A +ATOM 140 N ASP A 22 54.402 63.260 70.702 1.00 4.14 A +ATOM 141 CA ASP A 22 55.097 64.566 70.749 1.00 4.70 A +ATOM 142 C ASP A 22 56.528 64.213 71.148 1.00 4.45 A +ATOM 143 O ASP A 22 56.763 63.839 72.315 1.00 5.58 A +ATOM 144 CB ASP A 22 54.398 65.504 71.720 1.00 6.22 A +ATOM 145 CG ASP A 22 55.106 66.810 71.968 1.00 7.08 A +ATOM 146 OD1 ASP A 22 54.461 67.693 72.601 1.00 8.97 A +ATOM 147 OD2 ASP A 22 56.249 66.976 71.563 1.00 7.76 A +ATOM 148 N LEU A 23 57.471 64.305 70.241 1.00 4.71 A +ATOM 149 CA LEU A 23 58.871 63.966 70.471 1.00 5.58 A +ATOM 150 C LEU A 23 59.745 65.149 70.823 1.00 6.38 A +ATOM 151 O LEU A 23 60.979 64.983 70.882 1.00 8.55 A +ATOM 152 CB LEU A 23 59.403 63.270 69.193 1.00 5.54 A +ATOM 153 CG LEU A 23 58.507 62.154 68.674 1.00 6.24 A +ATOM 154 CD1 LEU A 23 59.178 61.512 67.451 1.00 6.77 A +ATOM 155 CD2 LEU A 23 58.259 61.054 69.707 1.00 6.93 A +ATOM 156 N GLY A 24 59.166 66.286 71.039 1.00 6.72 A +ATOM 157 CA GLY A 24 59.920 67.523 71.338 1.00 7.67 A +ATOM 158 C GLY A 24 59.707 68.400 70.084 1.00 7.60 A +ATOM 159 O GLY A 24 58.600 68.942 69.915 1.00 8.31 A +ATOM 160 N ASN A 25 60.704 68.474 69.248 1.00 7.01 A +ATOM 161 CA ASN A 25 60.524 69.301 68.036 1.00 7.87 A +ATOM 162 C ASN A 25 59.570 68.622 67.049 1.00 7.17 A +ATOM 163 O ASN A 25 58.790 69.317 66.371 1.00 7.79 A +ATOM 164 CB ASN A 25 61.872 69.507 67.343 1.00 9.22 A +ATOM 165 CG ASN A 25 61.713 70.393 66.113 1.00 10.32 A +ATOM 166 OD1 ASN A 25 61.175 71.506 66.200 1.00 12.32 A +ATOM 167 ND2 ASN A 25 62.167 69.869 64.967 1.00 11.31 A +ATOM 168 N MET A 26 59.596 67.320 66.912 1.00 6.21 A +ATOM 169 CA MET A 26 58.766 66.599 65.949 1.00 5.60 A +ATOM 170 C MET A 26 57.556 65.937 66.583 1.00 5.14 A +ATOM 171 O MET A 26 57.663 65.301 67.653 1.00 5.60 A +ATOM 172 CB MET A 26 59.657 65.517 65.295 1.00 6.37 A +ATOM 173 CG MET A 26 58.892 64.822 64.201 1.00 7.10 A +ATOM 174 SD MET A 26 59.952 63.718 63.237 1.00 8.83 A +ATOM 175 CE MET A 26 60.817 64.935 62.195 1.00 9.98 A +ATOM 176 N ILE A 27 56.435 66.080 65.904 1.00 4.19 A +ATOM 177 CA ILE A 27 55.172 65.439 66.272 1.00 4.28 A +ATOM 178 C ILE A 27 54.845 64.446 65.142 1.00 3.82 A +ATOM 179 O ILE A 27 54.992 64.828 63.960 1.00 3.92 A +ATOM 180 CB ILE A 27 54.038 66.521 66.370 1.00 6.29 A +ATOM 181 CG1 ILE A 27 54.078 67.247 67.744 1.00 7.15 A +ATOM 182 CG2 ILE A 27 52.630 65.945 66.085 1.00 7.40 A +ATOM 183 CD1 ILE A 27 55.432 67.892 68.089 1.00 7.34 A +ATOM 184 N ILE A 28 54.416 63.256 65.496 1.00 3.50 A +ATOM 185 CA ILE A 28 54.000 62.289 64.494 1.00 3.86 A +ATOM 186 C ILE A 28 52.595 61.811 64.841 1.00 3.50 A +ATOM 187 O ILE A 28 52.349 61.387 66.009 1.00 4.39 A +ATOM 188 CB ILE A 28 54.955 61.051 64.397 1.00 4.84 A +ATOM 189 CG1 ILE A 28 56.417 61.518 64.271 1.00 5.31 A +ATOM 190 CG2 ILE A 28 54.508 60.136 63.234 1.00 5.87 A +ATOM 191 CD1 ILE A 28 57.405 60.336 64.133 1.00 5.89 A +ATOM 192 N THR A 29 51.698 61.836 63.885 1.00 3.96 A +ATOM 193 CA THR A 29 50.363 61.295 64.117 1.00 4.14 A +ATOM 194 C THR A 29 50.241 59.858 63.625 1.00 3.59 A +ATOM 195 O THR A 29 50.957 59.398 62.751 1.00 4.36 A +ATOM 196 CB THR A 29 49.229 62.148 63.402 1.00 4.08 A +ATOM 197 OG1 THR A 29 49.151 61.797 62.003 1.00 3.82 A +ATOM 198 CG2 THR A 29 49.413 63.662 63.547 1.00 4.97 A +ATOM 199 N SER A 30 49.245 59.184 64.195 1.00 3.82 A +ATOM 200 CA SER A 30 48.819 57.896 63.673 1.00 3.64 A +ATOM 201 C SER A 30 48.083 58.225 62.342 1.00 3.76 A +ATOM 202 O SER A 30 47.678 59.377 62.094 1.00 4.49 A +ATOM 203 CB SER A 30 47.782 57.269 64.615 1.00 3.92 A +ATOM 204 OG SER A 30 48.466 56.635 65.679 1.00 4.47 A +ATOM 205 N GLY A 31 47.915 57.202 61.521 1.00 3.83 A +ATOM 206 CA GLY A 31 47.176 57.299 60.254 1.00 4.29 A +ATOM 207 C GLY A 31 45.727 57.583 60.617 1.00 4.32 A +ATOM 208 O GLY A 31 45.108 56.714 61.268 1.00 6.10 A +ATOM 209 N GLN A 32 45.164 58.708 60.248 1.00 3.41 A +ATOM 210 CA GLN A 32 43.789 59.085 60.581 1.00 3.93 A +ATOM 211 C GLN A 32 42.841 58.647 59.469 1.00 3.99 A +ATOM 212 O GLN A 32 43.019 58.943 58.292 1.00 4.71 A +ATOM 213 CB GLN A 32 43.678 60.603 60.781 1.00 4.22 A +ATOM 214 CG GLN A 32 44.494 61.116 61.955 1.00 3.95 A +ATOM 215 CD GLN A 32 44.181 60.387 63.233 1.00 4.74 A +ATOM 216 OE1 GLN A 32 43.025 60.399 63.674 1.00 5.56 A +ATOM 217 NE2 GLN A 32 45.179 59.688 63.775 1.00 4.99 A +ATOM 218 N ILE A 33 41.772 58.014 59.924 1.00 5.20 A +ATOM 219 CA ILE A 33 40.684 57.594 59.037 1.00 5.52 A +ATOM 220 C ILE A 33 39.527 58.558 59.277 1.00 5.61 A +ATOM 221 O ILE A 33 39.471 59.271 60.308 1.00 5.33 A +ATOM 222 CB ILE A 33 40.335 56.109 59.247 1.00 6.50 A +ATOM 223 CG1 ILE A 33 39.958 55.811 60.720 1.00 7.36 A +ATOM 224 CG2 ILE A 33 41.489 55.181 58.775 1.00 7.63 A +ATOM 225 CD1 ILE A 33 39.290 54.422 60.854 1.00 8.30 A +ATOM 226 N PRO A 34 38.606 58.600 58.333 1.00 5.57 A +ATOM 227 CA PRO A 34 37.522 59.576 58.367 1.00 5.47 A +ATOM 228 C PRO A 34 36.371 59.282 59.321 1.00 5.79 A +ATOM 229 O PRO A 34 35.192 59.360 58.907 1.00 7.27 A +ATOM 230 CB PRO A 34 37.030 59.664 56.914 1.00 5.88 A +ATOM 231 CG PRO A 34 37.325 58.276 56.396 1.00 6.23 A +ATOM 232 CD PRO A 34 38.678 57.937 57.019 1.00 5.26 A +ATOM 233 N VAL A 35 36.721 58.985 60.555 1.00 5.68 A +ATOM 234 CA VAL A 35 35.706 58.775 61.601 1.00 6.40 A +ATOM 235 C VAL A 35 35.492 60.117 62.295 1.00 5.88 A +ATOM 236 O VAL A 35 36.425 60.824 62.677 1.00 5.93 A +ATOM 237 CB VAL A 35 36.200 57.731 62.615 1.00 7.54 A +ATOM 238 CG1 VAL A 35 35.300 57.671 63.850 1.00 7.74 A +ATOM 239 CG2 VAL A 35 36.356 56.376 61.976 1.00 7.73 A +ATOM 240 N ASN A 36 34.209 60.449 62.453 1.00 6.56 A +ATOM 241 CA ASN A 36 33.832 61.711 63.134 1.00 7.61 A +ATOM 242 C ASN A 36 34.009 61.509 64.632 1.00 7.47 A +ATOM 243 O ASN A 36 33.398 60.575 65.195 1.00 8.51 A +ATOM 244 CB ASN A 36 32.397 62.016 62.735 1.00 9.42 A +ATOM 245 CG ASN A 36 31.815 63.262 63.346 1.00 11.61 A +ATOM 246 OD1 ASN A 36 31.911 63.471 64.567 1.00 12.84 A +ATOM 247 ND2 ASN A 36 31.143 64.047 62.500 1.00 12.39 A +ATOM 248 N PRO A 37 34.757 62.330 65.329 1.00 7.10 A +ATOM 249 CA PRO A 37 34.975 62.151 66.766 1.00 8.07 A +ATOM 250 C PRO A 37 33.759 62.412 67.622 1.00 8.69 A +ATOM 251 O PRO A 37 33.731 62.001 68.790 1.00 9.39 A +ATOM 252 CB PRO A 37 36.114 63.114 67.097 1.00 8.93 A +ATOM 253 CG PRO A 37 35.942 64.190 66.064 1.00 9.33 A +ATOM 254 CD PRO A 37 35.519 63.459 64.793 1.00 8.45 A +ATOM 255 N LYS A 38 32.797 63.140 67.088 1.00 9.24 A +ATOM 256 CA LYS A 38 31.560 63.446 67.841 1.00 11.17 A +ATOM 257 C LYS A 38 30.604 62.270 67.772 1.00 11.35 A +ATOM 258 O LYS A 38 30.007 61.908 68.821 1.00 12.18 A +ATOM 259 CB LYS A 38 30.905 64.682 67.259 1.00 12.66 A +ATOM 260 CG LYS A 38 29.693 65.260 67.972 1.00 13.74 A +ATOM 261 CD LYS A 38 29.220 66.600 67.360 1.00 14.42 A +ATOM 262 CE LYS A 38 30.156 67.638 67.528 1.00 17.20 A +ATOM 263 NZ LYS A 38 30.401 67.909 68.973 1.00 18.80 A +ATOM 264 N THR A 39 30.410 61.667 66.605 1.00 11.29 A +ATOM 265 CA THR A 39 29.447 60.585 66.426 1.00 11.38 A +ATOM 266 C THR A 39 29.945 59.192 66.161 1.00 11.67 A +ATOM 267 O THR A 39 29.146 58.231 66.283 1.00 12.12 A +ATOM 268 CB THR A 39 28.498 60.967 65.202 1.00 11.46 A +ATOM 269 OG1 THR A 39 29.377 60.899 64.024 1.00 11.47 A +ATOM 270 CG2 THR A 39 27.870 62.342 65.321 1.00 12.27 A +ATOM 271 N GLY A 40 31.191 59.069 65.724 1.00 11.14 A +ATOM 272 CA GLY A 40 31.757 57.763 65.397 1.00 11.25 A +ATOM 273 C GLY A 40 31.414 57.343 63.969 1.00 11.36 A +ATOM 274 O GLY A 40 31.858 56.264 63.543 1.00 12.70 A +ATOM 275 N GLU A 41 30.667 58.149 63.248 1.00 11.11 A +ATOM 276 CA GLU A 41 30.278 57.815 61.871 1.00 11.71 A +ATOM 277 C GLU A 41 31.296 58.245 60.833 1.00 10.19 A +ATOM 278 O GLU A 41 32.099 59.139 61.111 1.00 10.11 A +ATOM 279 CB GLU A 41 28.947 58.517 61.534 1.00 13.86 A +ATOM 280 CG GLU A 41 27.808 57.967 62.414 1.00 16.75 A +ATOM 281 CD GLU A 41 26.469 58.606 62.196 1.00 18.82 A +ATOM 282 OE1 GLU A 41 26.338 59.711 61.693 1.00 19.76 A +ATOM 283 OE2 GLU A 41 25.559 57.848 62.618 1.00 20.70 A +ATOM 284 N VAL A 42 31.202 57.633 59.670 1.00 9.39 A +ATOM 285 CA VAL A 42 32.092 57.933 58.529 1.00 8.66 A +ATOM 286 C VAL A 42 31.207 58.479 57.415 1.00 8.84 A +ATOM 287 O VAL A 42 30.227 57.758 57.073 1.00 8.91 A +ATOM 288 CB VAL A 42 32.799 56.643 58.081 1.00 8.81 A +ATOM 289 CG1 VAL A 42 33.559 56.885 56.777 1.00 8.55 A +ATOM 290 CG2 VAL A 42 33.725 56.120 59.169 1.00 9.11 A +ATOM 291 N PRO A 43 31.514 59.617 56.877 1.00 8.44 A +ATOM 292 CA PRO A 43 30.715 60.210 55.791 1.00 9.28 A +ATOM 293 C PRO A 43 30.918 59.367 54.546 1.00 9.79 A +ATOM 294 O PRO A 43 32.000 58.768 54.342 1.00 9.85 A +ATOM 295 CB PRO A 43 31.207 61.650 55.701 1.00 9.38 A +ATOM 296 CG PRO A 43 32.652 61.567 56.141 1.00 9.11 A +ATOM 297 CD PRO A 43 32.661 60.480 57.216 1.00 8.87 A +ATOM 298 N ALA A 44 29.882 59.303 53.711 1.00 11.00 A +ATOM 299 CA ALA A 44 29.932 58.508 52.480 1.00 11.90 A +ATOM 300 C ALA A 44 30.874 59.042 51.404 1.00 12.03 A +ATOM 301 O ALA A 44 31.691 58.329 50.802 1.00 13.47 A +ATOM 302 CB ALA A 44 28.484 58.433 51.963 1.00 12.50 A +ATOM 303 N ASP A 45 30.762 60.303 51.148 1.00 11.52 A +ATOM 304 CA ASP A 45 31.428 61.135 50.149 1.00 11.81 A +ATOM 305 C ASP A 45 32.946 61.109 50.292 1.00 10.80 A +ATOM 306 O ASP A 45 33.415 61.365 51.424 1.00 9.73 A +ATOM 307 CB ASP A 45 30.749 62.522 50.311 1.00 12.76 A +ATOM 308 CG ASP A 45 31.268 63.505 49.304 1.00 14.25 A +ATOM 309 OD1 ASP A 45 32.157 64.292 49.667 1.00 13.77 A +ATOM 310 OD2 ASP A 45 30.805 63.527 48.132 1.00 15.41 A +ATOM 311 N VAL A 46 33.695 60.863 49.235 1.00 10.67 A +ATOM 312 CA VAL A 46 35.167 60.837 49.368 1.00 9.52 A +ATOM 313 C VAL A 46 35.756 62.188 49.754 1.00 7.84 A +ATOM 314 O VAL A 46 36.743 62.245 50.509 1.00 7.66 A +ATOM 315 CB VAL A 46 35.839 60.208 48.136 1.00 10.26 A +ATOM 316 CG1 VAL A 46 35.681 61.046 46.877 1.00 10.79 A +ATOM 317 CG2 VAL A 46 37.284 59.868 48.431 1.00 10.65 A +ATOM 318 N ALA A 47 35.185 63.265 49.237 1.00 7.55 A +ATOM 319 CA ALA A 47 35.697 64.600 49.612 1.00 7.95 A +ATOM 320 C ALA A 47 35.497 64.795 51.114 1.00 7.45 A +ATOM 321 O ALA A 47 36.408 65.283 51.831 1.00 7.40 A +ATOM 322 CB ALA A 47 35.003 65.692 48.813 1.00 8.33 A +ATOM 323 N ALA A 48 34.327 64.432 51.602 1.00 6.86 A +ATOM 324 CA ALA A 48 34.040 64.567 53.034 1.00 6.14 A +ATOM 325 C ALA A 48 34.976 63.666 53.826 1.00 5.74 A +ATOM 326 O ALA A 48 35.401 64.063 54.919 1.00 5.87 A +ATOM 327 CB ALA A 48 32.576 64.257 53.277 1.00 6.39 A +ATOM 328 N GLN A 49 35.270 62.494 53.331 1.00 5.59 A +ATOM 329 CA GLN A 49 36.209 61.597 54.043 1.00 5.03 A +ATOM 330 C GLN A 49 37.590 62.247 54.116 1.00 4.68 A +ATOM 331 O GLN A 49 38.233 62.234 55.172 1.00 5.23 A +ATOM 332 CB GLN A 49 36.255 60.225 53.385 1.00 5.71 A +ATOM 333 CG GLN A 49 34.994 59.395 53.671 1.00 6.17 A +ATOM 334 CD GLN A 49 35.202 57.921 53.381 1.00 5.93 A +ATOM 335 OE1 GLN A 49 36.340 57.420 53.335 1.00 5.99 A +ATOM 336 NE2 GLN A 49 34.110 57.175 53.220 1.00 6.38 A +ATOM 337 N ALA A 50 38.029 62.786 52.982 1.00 4.71 A +ATOM 338 CA ALA A 50 39.364 63.431 53.010 1.00 4.54 A +ATOM 339 C ALA A 50 39.396 64.554 54.046 1.00 4.94 A +ATOM 340 O ALA A 50 40.349 64.694 54.833 1.00 4.87 A +ATOM 341 CB ALA A 50 39.764 63.973 51.649 1.00 5.66 A +ATOM 342 N ARG A 51 38.327 65.338 54.078 1.00 5.38 A +ATOM 343 CA ARG A 51 38.260 66.439 55.051 1.00 5.49 A +ATOM 344 C ARG A 51 38.200 65.950 56.478 1.00 5.04 A +ATOM 345 O ARG A 51 38.845 66.565 57.349 1.00 6.12 A +ATOM 346 CB ARG A 51 37.136 67.419 54.730 1.00 6.73 A +ATOM 347 CG ARG A 51 37.074 68.640 55.631 1.00 7.56 A +ATOM 348 CD ARG A 51 36.205 69.722 55.064 1.00 8.32 A +ATOM 349 NE ARG A 51 36.735 70.418 53.902 1.00 8.95 A +ATOM 350 CZ ARG A 51 37.601 71.442 53.925 1.00 9.18 A +ATOM 351 NH1 ARG A 51 38.084 71.924 55.070 1.00 8.39 A +ATOM 352 NH2 ARG A 51 37.999 71.993 52.772 1.00 10.81 A +ATOM 353 N GLN A 52 37.460 64.896 56.762 1.00 4.75 A +ATOM 354 CA GLN A 52 37.375 64.365 58.134 1.00 4.61 A +ATOM 355 C GLN A 52 38.755 63.848 58.546 1.00 4.34 A +ATOM 356 O GLN A 52 39.161 64.060 59.715 1.00 4.87 A +ATOM 357 CB GLN A 52 36.296 63.303 58.235 1.00 5.74 A +ATOM 358 CG GLN A 52 36.148 62.806 59.657 1.00 5.80 A +ATOM 359 CD GLN A 52 35.679 63.854 60.622 1.00 6.30 A +ATOM 360 OE1 GLN A 52 34.471 64.133 60.690 1.00 7.97 A +ATOM 361 NE2 GLN A 52 36.576 64.428 61.386 1.00 7.04 A +ATOM 362 N SER A 53 39.438 63.125 57.667 1.00 4.36 A +ATOM 363 CA SER A 53 40.796 62.658 58.016 1.00 4.64 A +ATOM 364 C SER A 53 41.730 63.831 58.319 1.00 4.34 A +ATOM 365 O SER A 53 42.486 63.783 59.298 1.00 4.42 A +ATOM 366 CB SER A 53 41.346 61.801 56.895 1.00 5.03 A +ATOM 367 OG SER A 53 40.874 60.480 56.920 1.00 7.71 A +ATOM 368 N LEU A 54 41.672 64.858 57.494 1.00 4.12 A +ATOM 369 CA LEU A 54 42.501 66.053 57.715 1.00 4.70 A +ATOM 370 C LEU A 54 42.130 66.747 59.020 1.00 3.93 A +ATOM 371 O LEU A 54 43.026 67.222 59.740 1.00 4.71 A +ATOM 372 CB LEU A 54 42.407 66.961 56.508 1.00 5.03 A +ATOM 373 CG LEU A 54 43.166 66.430 55.288 1.00 5.82 A +ATOM 374 CD1 LEU A 54 42.760 67.223 54.045 1.00 5.88 A +ATOM 375 CD2 LEU A 54 44.673 66.492 55.463 1.00 6.70 A +ATOM 376 N ASP A 55 40.853 66.819 59.334 1.00 4.46 A +ATOM 377 CA ASP A 55 40.440 67.461 60.595 1.00 4.76 A +ATOM 378 C ASP A 55 40.976 66.648 61.777 1.00 5.09 A +ATOM 379 O ASP A 55 41.316 67.240 62.801 1.00 4.83 A +ATOM 380 CB ASP A 55 38.926 67.603 60.620 1.00 6.75 A +ATOM 381 CG ASP A 55 38.396 68.831 59.894 1.00 8.66 A +ATOM 382 OD1 ASP A 55 37.229 68.842 59.457 1.00 10.67 A +ATOM 383 OD2 ASP A 55 39.156 69.804 59.813 1.00 10.74 A +ATOM 384 N ASN A 56 40.966 65.338 61.607 1.00 4.45 A +ATOM 385 CA ASN A 56 41.477 64.473 62.713 1.00 3.71 A +ATOM 386 C ASN A 56 42.971 64.745 62.874 1.00 3.25 A +ATOM 387 O ASN A 56 43.473 64.821 64.018 1.00 4.24 A +ATOM 388 CB ASN A 56 41.182 62.994 62.455 1.00 4.47 A +ATOM 389 CG ASN A 56 39.696 62.707 62.655 1.00 4.53 A +ATOM 390 OD1 ASN A 56 38.956 63.521 63.249 1.00 5.62 A +ATOM 391 ND2 ASN A 56 39.213 61.580 62.124 1.00 4.94 A +ATOM 392 N VAL A 57 43.710 64.803 61.766 1.00 4.41 A +ATOM 393 CA VAL A 57 45.156 65.125 61.842 1.00 4.09 A +ATOM 394 C VAL A 57 45.322 66.462 62.535 1.00 3.73 A +ATOM 395 O VAL A 57 46.150 66.644 63.454 1.00 4.05 A +ATOM 396 CB VAL A 57 45.777 65.167 60.449 1.00 4.49 A +ATOM 397 CG1 VAL A 57 47.143 65.858 60.478 1.00 5.66 A +ATOM 398 CG2 VAL A 57 45.886 63.791 59.829 1.00 5.00 A +ATOM 399 N LYS A 58 44.563 67.461 62.121 1.00 3.78 A +ATOM 400 CA LYS A 58 44.626 68.814 62.701 1.00 4.51 A +ATOM 401 C LYS A 58 44.385 68.786 64.200 1.00 4.64 A +ATOM 402 O LYS A 58 45.078 69.453 64.970 1.00 4.91 A +ATOM 403 CB LYS A 58 43.566 69.685 62.023 1.00 5.87 A +ATOM 404 CG LYS A 58 43.368 71.037 62.715 1.00 6.61 A +ATOM 405 CD LYS A 58 42.422 71.911 61.914 1.00 8.95 A +ATOM 406 CE LYS A 58 41.827 73.036 62.736 1.00 9.79 A +ATOM 407 NZ LYS A 58 40.944 73.903 61.926 1.00 10.97 A +ATOM 408 N ALA A 59 43.393 68.027 64.648 1.00 4.57 A +ATOM 409 CA ALA A 59 43.097 67.955 66.089 1.00 4.83 A +ATOM 410 C ALA A 59 44.313 67.483 66.884 1.00 4.63 A +ATOM 411 O ALA A 59 44.584 67.996 67.993 1.00 4.41 A +ATOM 412 CB ALA A 59 41.941 67.000 66.337 1.00 5.64 A +ATOM 413 N ILE A 60 45.015 66.485 66.365 1.00 4.27 A +ATOM 414 CA ILE A 60 46.183 65.916 67.056 1.00 4.66 A +ATOM 415 C ILE A 60 47.337 66.898 67.056 1.00 3.81 A +ATOM 416 O ILE A 60 48.023 67.079 68.071 1.00 4.20 A +ATOM 417 CB ILE A 60 46.509 64.546 66.403 1.00 4.36 A +ATOM 418 CG1 ILE A 60 45.317 63.588 66.623 1.00 4.56 A +ATOM 419 CG2 ILE A 60 47.835 63.966 66.941 1.00 4.23 A +ATOM 420 CD1 ILE A 60 45.375 62.373 65.655 1.00 5.34 A +ATOM 421 N VAL A 61 47.603 67.504 65.896 1.00 3.65 A +ATOM 422 CA VAL A 61 48.677 68.511 65.787 1.00 4.56 A +ATOM 423 C VAL A 61 48.400 69.698 66.702 1.00 4.22 A +ATOM 424 O VAL A 61 49.299 70.160 67.411 1.00 4.43 A +ATOM 425 CB VAL A 61 48.830 68.907 64.309 1.00 4.74 A +ATOM 426 CG1 VAL A 61 49.722 70.122 64.101 1.00 5.69 A +ATOM 427 CG2 VAL A 61 49.318 67.725 63.493 1.00 5.47 A +ATOM 428 N GLU A 62 47.153 70.151 66.723 1.00 4.43 A +ATOM 429 CA GLU A 62 46.812 71.288 67.592 1.00 4.95 A +ATOM 430 C GLU A 62 46.887 70.885 69.052 1.00 5.30 A +ATOM 431 O GLU A 62 47.256 71.723 69.907 1.00 5.38 A +ATOM 432 CB GLU A 62 45.453 71.893 67.274 1.00 5.58 A +ATOM 433 CG GLU A 62 45.458 72.586 65.906 1.00 7.08 A +ATOM 434 CD GLU A 62 44.237 73.352 65.533 1.00 8.46 A +ATOM 435 OE1 GLU A 62 44.288 74.252 64.697 1.00 10.06 A +ATOM 436 OE2 GLU A 62 43.157 73.067 66.109 1.00 10.50 A +ATOM 437 N ALA A 63 46.584 69.650 69.401 1.00 5.02 A +ATOM 438 CA ALA A 63 46.655 69.190 70.802 1.00 4.80 A +ATOM 439 C ALA A 63 48.101 69.229 71.281 1.00 4.67 A +ATOM 440 O ALA A 63 48.351 69.284 72.498 1.00 5.23 A +ATOM 441 CB ALA A 63 46.025 67.832 70.900 1.00 4.87 A +ATOM 442 N ALA A 64 49.063 69.195 70.374 1.00 4.95 A +ATOM 443 CA ALA A 64 50.469 69.277 70.725 1.00 5.12 A +ATOM 444 C ALA A 64 50.966 70.720 70.686 1.00 5.56 A +ATOM 445 O ALA A 64 52.193 70.916 70.844 1.00 6.36 A +ATOM 446 CB ALA A 64 51.305 68.378 69.816 1.00 6.01 A +ATOM 447 N GLY A 65 50.111 71.682 70.458 1.00 5.32 A +ATOM 448 CA GLY A 65 50.514 73.092 70.438 1.00 5.69 A +ATOM 449 C GLY A 65 50.980 73.563 69.073 1.00 5.00 A +ATOM 450 O GLY A 65 51.580 74.662 69.029 1.00 6.60 A +ATOM 451 N LEU A 66 50.731 72.813 68.006 1.00 4.89 A +ATOM 452 CA LEU A 66 51.180 73.201 66.660 1.00 5.10 A +ATOM 453 C LEU A 66 49.989 73.579 65.820 1.00 5.52 A +ATOM 454 O LEU A 66 48.832 73.428 66.215 1.00 6.12 A +ATOM 455 CB LEU A 66 52.009 72.059 66.064 1.00 5.47 A +ATOM 456 CG LEU A 66 53.366 71.886 66.729 1.00 7.05 A +ATOM 457 CD1 LEU A 66 54.150 70.805 65.995 1.00 7.79 A +ATOM 458 CD2 LEU A 66 54.124 73.209 66.813 1.00 8.50 A +ATOM 459 N LYS A 67 50.268 74.007 64.601 1.00 5.84 A +ATOM 460 CA LYS A 67 49.228 74.408 63.637 1.00 6.22 A +ATOM 461 C LYS A 67 49.343 73.532 62.402 1.00 5.40 A +ATOM 462 O LYS A 67 50.377 72.892 62.130 1.00 5.50 A +ATOM 463 CB LYS A 67 49.489 75.855 63.194 1.00 8.08 A +ATOM 464 CG LYS A 67 49.479 76.860 64.348 1.00 10.38 A +ATOM 465 CD LYS A 67 49.838 78.259 63.839 1.00 13.10 A +ATOM 466 CE LYS A 67 49.778 79.272 64.978 1.00 14.74 A +ATOM 467 NZ LYS A 67 49.892 80.648 64.415 1.00 16.76 A +ATOM 468 N VAL A 68 48.260 73.571 61.611 1.00 5.45 A +ATOM 469 CA VAL A 68 48.274 72.874 60.318 1.00 5.05 A +ATOM 470 C VAL A 68 49.501 73.341 59.513 1.00 5.56 A +ATOM 471 O VAL A 68 50.091 72.512 58.804 1.00 5.83 A +ATOM 472 CB VAL A 68 46.958 73.124 59.566 1.00 5.97 A +ATOM 473 CG1 VAL A 68 47.047 72.733 58.097 1.00 6.44 A +ATOM 474 CG2 VAL A 68 45.781 72.484 60.292 1.00 7.15 A +ATOM 475 N GLY A 69 49.861 74.607 59.620 1.00 5.71 A +ATOM 476 CA GLY A 69 51.014 75.148 58.890 1.00 6.22 A +ATOM 477 C GLY A 69 52.347 74.533 59.314 1.00 5.67 A +ATOM 478 O GLY A 69 53.347 74.754 58.601 1.00 6.75 A +ATOM 479 N ASP A 70 52.380 73.824 60.435 1.00 4.83 A +ATOM 480 CA ASP A 70 53.599 73.148 60.912 1.00 5.11 A +ATOM 481 C ASP A 70 53.725 71.723 60.358 1.00 4.14 A +ATOM 482 O ASP A 70 54.733 71.075 60.662 1.00 4.50 A +ATOM 483 CB ASP A 70 53.647 73.177 62.438 1.00 5.29 A +ATOM 484 CG ASP A 70 53.641 74.595 63.006 1.00 6.10 A +ATOM 485 OD1 ASP A 70 52.875 74.820 63.965 1.00 6.91 A +ATOM 486 OD2 ASP A 70 54.367 75.421 62.444 1.00 6.71 A +ATOM 487 N ILE A 71 52.727 71.273 59.653 1.00 4.31 A +ATOM 488 CA ILE A 71 52.803 69.910 59.080 1.00 4.32 A +ATOM 489 C ILE A 71 53.793 69.964 57.903 1.00 3.98 A +ATOM 490 O ILE A 71 53.583 70.796 57.004 1.00 5.01 A +ATOM 491 CB ILE A 71 51.394 69.417 58.633 1.00 4.70 A +ATOM 492 CG1 ILE A 71 50.449 69.260 59.861 1.00 4.36 A +ATOM 493 CG2 ILE A 71 51.552 68.095 57.847 1.00 4.30 A +ATOM 494 CD1 ILE A 71 48.952 69.090 59.494 1.00 4.71 A +ATOM 495 N VAL A 72 54.776 69.082 57.918 1.00 3.47 A +ATOM 496 CA VAL A 72 55.822 69.101 56.889 1.00 3.99 A +ATOM 497 C VAL A 72 55.826 67.872 56.023 1.00 3.90 A +ATOM 498 O VAL A 72 56.434 67.929 54.930 1.00 4.27 A +ATOM 499 CB VAL A 72 57.201 69.355 57.550 1.00 4.41 A +ATOM 500 CG1 VAL A 72 57.263 70.752 58.134 1.00 5.07 A +ATOM 501 CG2 VAL A 72 57.520 68.283 58.575 1.00 5.77 A +ATOM 502 N LYS A 73 55.155 66.779 56.414 1.00 3.52 A +ATOM 503 CA LYS A 73 55.125 65.579 55.571 1.00 4.16 A +ATOM 504 C LYS A 73 53.841 64.797 55.868 1.00 4.31 A +ATOM 505 O LYS A 73 53.541 64.631 57.077 1.00 4.84 A +ATOM 506 CB LYS A 73 56.294 64.647 55.893 1.00 5.02 A +ATOM 507 CG LYS A 73 56.361 63.285 55.194 1.00 5.28 A +ATOM 508 CD LYS A 73 56.411 63.319 53.682 1.00 5.37 A +ATOM 509 CE LYS A 73 56.630 61.976 53.030 1.00 6.08 A +ATOM 510 NZ LYS A 73 55.657 60.916 53.409 1.00 6.35 A +ATOM 511 N THR A 74 53.193 64.350 54.825 1.00 3.73 A +ATOM 512 CA THR A 74 52.052 63.456 55.013 1.00 3.85 A +ATOM 513 C THR A 74 52.262 62.249 54.103 1.00 3.84 A +ATOM 514 O THR A 74 53.017 62.260 53.119 1.00 3.85 A +ATOM 515 CB THR A 74 50.705 64.155 54.626 1.00 4.06 A +ATOM 516 OG1 THR A 74 50.782 64.451 53.208 1.00 4.62 A +ATOM 517 CG2 THR A 74 50.387 65.381 55.461 1.00 4.69 A +ATOM 518 N THR A 75 51.537 61.192 54.460 1.00 3.73 A +ATOM 519 CA THR A 75 51.389 60.053 53.559 1.00 4.09 A +ATOM 520 C THR A 75 49.849 59.881 53.439 1.00 4.02 A +ATOM 521 O THR A 75 49.180 59.787 54.483 1.00 4.60 A +ATOM 522 CB THR A 75 52.052 58.716 53.947 1.00 5.33 A +ATOM 523 OG1 THR A 75 53.481 59.053 53.995 1.00 6.90 A +ATOM 524 CG2 THR A 75 51.782 57.597 52.938 1.00 6.26 A +ATOM 525 N VAL A 76 49.388 59.859 52.221 1.00 3.79 A +ATOM 526 CA VAL A 76 47.970 59.705 51.923 1.00 4.37 A +ATOM 527 C VAL A 76 47.772 58.362 51.232 1.00 4.23 A +ATOM 528 O VAL A 76 48.259 58.120 50.109 1.00 5.09 A +ATOM 529 CB VAL A 76 47.518 60.873 51.017 1.00 5.09 A +ATOM 530 CG1 VAL A 76 46.034 60.718 50.674 1.00 6.10 A +ATOM 531 CG2 VAL A 76 47.745 62.256 51.642 1.00 5.44 A +ATOM 532 N PHE A 77 47.079 57.500 51.943 1.00 3.73 A +ATOM 533 CA PHE A 77 46.755 56.152 51.434 1.00 4.03 A +ATOM 534 C PHE A 77 45.307 56.221 50.948 1.00 3.31 A +ATOM 535 O PHE A 77 44.458 56.607 51.785 1.00 5.04 A +ATOM 536 CB PHE A 77 46.861 55.114 52.535 1.00 3.99 A +ATOM 537 CG PHE A 77 48.187 55.025 53.226 1.00 3.46 A +ATOM 538 CD1 PHE A 77 48.378 55.589 54.494 1.00 4.75 A +ATOM 539 CD2 PHE A 77 49.243 54.338 52.632 1.00 4.57 A +ATOM 540 CE1 PHE A 77 49.580 55.436 55.186 1.00 5.64 A +ATOM 541 CE2 PHE A 77 50.457 54.208 53.314 1.00 5.55 A +ATOM 542 CZ PHE A 77 50.626 54.721 54.585 1.00 5.75 A +ATOM 543 N VAL A 78 45.018 55.872 49.713 1.00 3.70 A +ATOM 544 CA VAL A 78 43.641 55.909 49.221 1.00 4.71 A +ATOM 545 C VAL A 78 43.220 54.528 48.751 1.00 4.55 A +ATOM 546 O VAL A 78 44.038 53.710 48.352 1.00 4.79 A +ATOM 547 CB VAL A 78 43.447 56.948 48.100 1.00 5.00 A +ATOM 548 CG1 VAL A 78 43.745 58.363 48.575 1.00 6.84 A +ATOM 549 CG2 VAL A 78 44.287 56.648 46.861 1.00 5.75 A +ATOM 550 N LYS A 79 41.906 54.334 48.753 1.00 5.21 A +ATOM 551 CA LYS A 79 41.315 53.107 48.222 1.00 5.74 A +ATOM 552 C LYS A 79 41.199 53.200 46.696 1.00 6.17 A +ATOM 553 O LYS A 79 41.240 52.134 46.034 1.00 6.76 A +ATOM 554 CB LYS A 79 39.956 52.842 48.840 1.00 6.81 A +ATOM 555 CG LYS A 79 39.231 51.634 48.264 1.00 8.82 A +ATOM 556 CD LYS A 79 39.989 50.323 48.396 1.00 10.71 A +ATOM 557 CE LYS A 79 39.447 49.209 47.516 1.00 11.66 A +ATOM 558 NZ LYS A 79 39.707 49.470 46.072 1.00 13.37 A +ATOM 559 N ASP A 80 41.078 54.376 46.123 1.00 6.31 A +ATOM 560 CA ASP A 80 40.898 54.487 44.661 1.00 6.74 A +ATOM 561 C ASP A 80 41.474 55.764 44.088 1.00 6.52 A +ATOM 562 O ASP A 80 40.896 56.841 44.340 1.00 7.52 A +ATOM 563 CB ASP A 80 39.382 54.361 44.370 1.00 7.41 A +ATOM 564 CG ASP A 80 39.052 54.297 42.895 1.00 8.15 A +ATOM 565 OD1 ASP A 80 37.864 54.054 42.544 1.00 10.21 A +ATOM 566 OD2 ASP A 80 39.923 54.466 42.034 1.00 8.03 A +ATOM 567 N LEU A 81 42.574 55.668 43.364 1.00 6.91 A +ATOM 568 CA LEU A 81 43.190 56.846 42.760 1.00 8.19 A +ATOM 569 C LEU A 81 42.250 57.501 41.754 1.00 8.43 A +ATOM 570 O LEU A 81 42.540 58.657 41.386 1.00 9.36 A +ATOM 571 CB LEU A 81 44.569 56.573 42.188 1.00 8.43 A +ATOM 572 CG LEU A 81 45.680 56.623 43.238 1.00 8.40 A +ATOM 573 CD1 LEU A 81 46.935 56.024 42.606 1.00 9.27 A +ATOM 574 CD2 LEU A 81 45.909 58.050 43.682 1.00 9.04 A +ATOM 575 N ASN A 82 41.191 56.839 41.326 1.00 8.67 A +ATOM 576 CA ASN A 82 40.271 57.540 40.394 1.00 9.87 A +ATOM 577 C ASN A 82 39.557 58.691 41.113 1.00 10.44 A +ATOM 578 O ASN A 82 39.033 59.592 40.434 1.00 11.63 A +ATOM 579 CB ASN A 82 39.283 56.608 39.715 1.00 10.51 A +ATOM 580 CG ASN A 82 39.992 55.772 38.642 1.00 10.87 A +ATOM 581 OD1 ASN A 82 40.917 56.248 38.003 1.00 11.41 A +ATOM 582 ND2 ASN A 82 39.530 54.538 38.505 1.00 11.83 A +ATOM 583 N ASP A 83 39.542 58.688 42.430 1.00 10.73 A +ATOM 584 CA ASP A 83 38.901 59.787 43.195 1.00 11.58 A +ATOM 585 C ASP A 83 39.956 60.809 43.606 1.00 11.57 A +ATOM 586 O ASP A 83 39.650 61.760 44.366 1.00 11.86 A +ATOM 587 CB ASP A 83 38.174 59.225 44.409 1.00 12.86 A +ATOM 588 CG ASP A 83 36.833 58.600 44.116 1.00 13.31 A +ATOM 589 OD1 ASP A 83 36.447 57.683 44.833 1.00 14.31 A +ATOM 590 OD2 ASP A 83 36.124 59.090 43.183 1.00 15.40 A +ATOM 591 N PHE A 84 41.173 60.688 43.112 1.00 11.64 A +ATOM 592 CA PHE A 84 42.211 61.630 43.566 1.00 12.27 A +ATOM 593 C PHE A 84 42.034 63.088 43.200 1.00 11.14 A +ATOM 594 O PHE A 84 42.522 63.933 43.995 1.00 10.67 A +ATOM 595 CB PHE A 84 43.608 61.082 43.296 1.00 13.85 A +ATOM 596 CG PHE A 84 44.516 61.435 44.457 1.00 15.36 A +ATOM 597 CD1 PHE A 84 45.490 62.419 44.313 1.00 16.41 A +ATOM 598 CD2 PHE A 84 44.347 60.771 45.675 1.00 15.95 A +ATOM 599 CE1 PHE A 84 46.316 62.724 45.396 1.00 17.08 A +ATOM 600 CE2 PHE A 84 45.182 61.074 46.757 1.00 16.89 A +ATOM 601 CZ PHE A 84 46.170 62.051 46.612 1.00 16.95 A +ATOM 602 N ALA A 85 41.392 63.448 42.102 1.00 10.77 A +ATOM 603 CA ALA A 85 41.220 64.879 41.794 1.00 10.60 A +ATOM 604 C ALA A 85 40.407 65.535 42.914 1.00 9.89 A +ATOM 605 O ALA A 85 40.689 66.653 43.346 1.00 9.55 A +ATOM 606 CB ALA A 85 40.575 65.072 40.425 1.00 11.44 A +ATOM 607 N THR A 86 39.403 64.784 43.359 1.00 10.27 A +ATOM 608 CA THR A 86 38.507 65.263 44.420 1.00 10.82 A +ATOM 609 C THR A 86 39.247 65.418 45.740 1.00 9.25 A +ATOM 610 O THR A 86 39.123 66.418 46.473 1.00 8.54 A +ATOM 611 CB THR A 86 37.245 64.317 44.584 1.00 12.16 A +ATOM 612 OG1 THR A 86 36.607 64.271 43.272 1.00 13.99 A +ATOM 613 CG2 THR A 86 36.315 64.815 45.690 1.00 12.79 A +ATOM 614 N VAL A 87 40.011 64.392 46.057 1.00 8.71 A +ATOM 615 CA VAL A 87 40.822 64.395 47.289 1.00 8.40 A +ATOM 616 C VAL A 87 41.809 65.555 47.232 1.00 7.98 A +ATOM 617 O VAL A 87 41.965 66.265 48.236 1.00 8.35 A +ATOM 618 CB VAL A 87 41.540 63.043 47.470 1.00 8.84 A +ATOM 619 CG1 VAL A 87 42.621 63.167 48.539 1.00 9.19 A +ATOM 620 CG2 VAL A 87 40.533 61.950 47.778 1.00 9.80 A +ATOM 621 N ASN A 88 42.472 65.711 46.109 1.00 7.83 A +ATOM 622 CA ASN A 88 43.463 66.775 45.933 1.00 9.07 A +ATOM 623 C ASN A 88 42.851 68.144 46.146 1.00 8.46 A +ATOM 624 O ASN A 88 43.450 69.026 46.768 1.00 7.86 A +ATOM 625 CB ASN A 88 44.145 66.740 44.572 1.00 10.40 A +ATOM 626 CG ASN A 88 45.540 66.169 44.610 1.00 11.76 A +ATOM 627 OD1 ASN A 88 46.210 66.239 45.662 1.00 12.61 A +ATOM 628 ND2 ASN A 88 45.921 65.615 43.454 1.00 13.35 A +ATOM 629 N ALA A 89 41.664 68.340 45.587 1.00 7.67 A +ATOM 630 CA ALA A 89 40.975 69.637 45.742 1.00 7.58 A +ATOM 631 C ALA A 89 40.678 69.934 47.212 1.00 6.88 A +ATOM 632 O ALA A 89 40.867 71.066 47.682 1.00 7.11 A +ATOM 633 CB ALA A 89 39.713 69.635 44.884 1.00 8.02 A +ATOM 634 N THR A 90 40.173 68.916 47.898 1.00 7.04 A +ATOM 635 CA THR A 90 39.858 69.089 49.326 1.00 7.07 A +ATOM 636 C THR A 90 41.132 69.328 50.133 1.00 6.37 A +ATOM 637 O THR A 90 41.163 70.183 51.031 1.00 6.22 A +ATOM 638 CB THR A 90 39.083 67.823 49.853 1.00 7.91 A +ATOM 639 OG1 THR A 90 37.752 67.848 49.254 1.00 10.49 A +ATOM 640 CG2 THR A 90 39.020 67.792 51.378 1.00 9.07 A +ATOM 641 N TYR A 91 42.164 68.549 49.837 1.00 6.16 A +ATOM 642 CA TYR A 91 43.451 68.653 50.539 1.00 5.79 A +ATOM 643 C TYR A 91 44.026 70.048 50.341 1.00 5.81 A +ATOM 644 O TYR A 91 44.488 70.724 51.278 1.00 6.66 A +ATOM 645 CB TYR A 91 44.344 67.546 50.008 1.00 5.88 A +ATOM 646 CG TYR A 91 45.698 67.369 50.645 1.00 5.59 A +ATOM 647 CD1 TYR A 91 45.958 66.295 51.497 1.00 5.96 A +ATOM 648 CD2 TYR A 91 46.730 68.267 50.394 1.00 6.04 A +ATOM 649 CE1 TYR A 91 47.210 66.067 52.070 1.00 5.47 A +ATOM 650 CE2 TYR A 91 47.994 68.093 50.940 1.00 6.05 A +ATOM 651 CZ TYR A 91 48.210 66.985 51.768 1.00 5.90 A +ATOM 652 OH TYR A 91 49.467 66.804 52.315 1.00 5.93 A +ATOM 653 N GLU A 92 44.002 70.502 49.095 1.00 6.05 A +ATOM 654 CA GLU A 92 44.514 71.841 48.771 1.00 6.75 A +ATOM 655 C GLU A 92 43.765 72.917 49.548 1.00 6.71 A +ATOM 656 O GLU A 92 44.350 73.846 50.151 1.00 7.08 A +ATOM 657 CB GLU A 92 44.437 72.138 47.269 1.00 8.59 A +ATOM 658 CG GLU A 92 44.989 73.518 46.875 1.00 11.80 A +ATOM 659 CD GLU A 92 45.544 73.634 45.500 1.00 15.28 A +ATOM 660 OE1 GLU A 92 46.349 74.486 45.106 1.00 18.01 A +ATOM 661 OE2 GLU A 92 45.182 72.757 44.704 1.00 17.25 A +ATOM 662 N ALA A 93 42.434 72.824 49.534 1.00 6.56 A +ATOM 663 CA ALA A 93 41.573 73.786 50.239 1.00 7.09 A +ATOM 664 C ALA A 93 41.900 73.817 51.726 1.00 6.90 A +ATOM 665 O ALA A 93 42.030 74.895 52.313 1.00 7.00 A +ATOM 666 CB ALA A 93 40.092 73.460 50.036 1.00 7.57 A +ATOM 667 N PHE A 94 42.042 72.618 52.302 1.00 6.67 A +ATOM 668 CA PHE A 94 42.332 72.516 53.752 1.00 6.61 A +ATOM 669 C PHE A 94 43.597 73.288 54.131 1.00 5.97 A +ATOM 670 O PHE A 94 43.607 74.054 55.105 1.00 6.59 A +ATOM 671 CB PHE A 94 42.401 71.034 54.101 1.00 7.02 A +ATOM 672 CG PHE A 94 42.599 70.771 55.555 1.00 7.23 A +ATOM 673 CD1 PHE A 94 41.464 70.713 56.358 1.00 8.12 A +ATOM 674 CD2 PHE A 94 43.862 70.605 56.098 1.00 8.71 A +ATOM 675 CE1 PHE A 94 41.545 70.478 57.717 1.00 9.74 A +ATOM 676 CE2 PHE A 94 43.979 70.367 57.485 1.00 9.96 A +ATOM 677 CZ PHE A 94 42.813 70.332 58.243 1.00 9.82 A +ATOM 678 N PHE A 95 44.675 73.086 53.389 1.00 5.98 A +ATOM 679 CA PHE A 95 45.951 73.781 53.651 1.00 6.00 A +ATOM 680 C PHE A 95 45.784 75.281 53.417 1.00 6.18 A +ATOM 681 O PHE A 95 46.266 76.101 54.226 1.00 6.81 A +ATOM 682 CB PHE A 95 47.140 73.124 52.962 1.00 6.51 A +ATOM 683 CG PHE A 95 47.524 71.874 53.714 1.00 6.57 A +ATOM 684 CD1 PHE A 95 47.028 70.622 53.373 1.00 7.43 A +ATOM 685 CD2 PHE A 95 48.341 71.976 54.850 1.00 6.79 A +ATOM 686 CE1 PHE A 95 47.329 69.479 54.111 1.00 7.20 A +ATOM 687 CE2 PHE A 95 48.669 70.841 55.584 1.00 7.08 A +ATOM 688 CZ PHE A 95 48.145 69.594 55.238 1.00 7.03 A +ATOM 689 N THR A 96 45.112 75.622 52.319 1.00 6.49 A +ATOM 690 CA THR A 96 44.897 77.053 52.019 1.00 8.11 A +ATOM 691 C THR A 96 44.112 77.732 53.131 1.00 7.33 A +ATOM 692 O THR A 96 44.429 78.891 53.504 1.00 7.70 A +ATOM 693 CB THR A 96 44.186 77.231 50.627 1.00 9.27 A +ATOM 694 OG1 THR A 96 45.085 76.633 49.670 1.00 11.25 A +ATOM 695 CG2 THR A 96 43.881 78.696 50.311 1.00 9.94 A +ATOM 696 N GLU A 97 43.106 77.060 53.665 1.00 7.31 A +ATOM 697 CA GLU A 97 42.266 77.615 54.743 1.00 8.29 A +ATOM 698 C GLU A 97 43.102 77.942 55.957 1.00 7.86 A +ATOM 699 O GLU A 97 42.748 78.850 56.745 1.00 9.08 A +ATOM 700 CB GLU A 97 41.175 76.606 55.168 1.00 8.63 A +ATOM 701 CG GLU A 97 40.094 76.405 54.068 1.00 9.19 A +ATOM 702 CD GLU A 97 39.441 75.045 54.140 1.00 9.70 A +ATOM 703 OE1 GLU A 97 39.587 74.338 55.128 1.00 10.55 A +ATOM 704 OE2 GLU A 97 38.781 74.714 53.131 1.00 11.38 A +ATOM 705 N HIS A 98 44.220 77.252 56.159 1.00 7.67 A +ATOM 706 CA HIS A 98 45.097 77.458 57.305 1.00 7.40 A +ATOM 707 C HIS A 98 46.321 78.282 56.958 1.00 7.94 A +ATOM 708 O HIS A 98 47.288 78.280 57.751 1.00 8.19 A +ATOM 709 CB HIS A 98 45.506 76.069 57.908 1.00 7.48 A +ATOM 710 CG HIS A 98 44.303 75.377 58.471 1.00 7.83 A +ATOM 711 ND1 HIS A 98 43.472 74.517 57.790 1.00 7.93 A +ATOM 712 CD2 HIS A 98 43.815 75.452 59.750 1.00 8.60 A +ATOM 713 CE1 HIS A 98 42.522 74.117 58.614 1.00 8.30 A +ATOM 714 NE2 HIS A 98 42.697 74.649 59.801 1.00 9.30 A +ATOM 715 N ASN A 99 46.291 78.931 55.806 1.00 8.01 A +ATOM 716 CA ASN A 99 47.423 79.752 55.341 1.00 8.93 A +ATOM 717 C ASN A 99 48.728 78.974 55.499 1.00 7.82 A +ATOM 718 O ASN A 99 49.777 79.517 55.928 1.00 8.81 A +ATOM 719 CB ASN A 99 47.463 81.061 56.144 1.00 10.58 A +ATOM 720 CG ASN A 99 48.447 82.056 55.546 1.00 11.86 A +ATOM 721 OD1 ASN A 99 48.653 82.042 54.320 1.00 13.08 A +ATOM 722 ND2 ASN A 99 49.031 82.877 56.417 1.00 13.49 A +ATOM 723 N ALA A 100 48.690 77.711 55.106 1.00 7.10 A +ATOM 724 CA ALA A 100 49.808 76.792 55.270 1.00 7.43 A +ATOM 725 C ALA A 100 50.563 76.441 54.005 1.00 8.24 A +ATOM 726 O ALA A 100 49.904 76.191 52.988 1.00 9.53 A +ATOM 727 CB ALA A 100 49.262 75.483 55.884 1.00 7.38 A +ATOM 728 N THR A 101 51.880 76.411 54.110 1.00 7.83 A +ATOM 729 CA THR A 101 52.694 75.927 52.985 1.00 8.26 A +ATOM 730 C THR A 101 52.331 74.436 52.883 1.00 7.07 A +ATOM 731 O THR A 101 52.184 73.774 53.936 1.00 7.16 A +ATOM 732 CB THR A 101 54.229 76.107 53.292 1.00 9.39 A +ATOM 733 OG1 THR A 101 54.419 77.548 53.397 1.00 10.96 A +ATOM 734 CG2 THR A 101 55.144 75.476 52.244 1.00 10.68 A +ATOM 735 N PHE A 102 52.245 73.911 51.687 1.00 6.83 A +ATOM 736 CA PHE A 102 51.894 72.488 51.556 1.00 6.82 A +ATOM 737 C PHE A 102 53.025 71.584 52.049 1.00 6.10 A +ATOM 738 O PHE A 102 54.203 71.847 51.781 1.00 6.28 A +ATOM 739 CB PHE A 102 51.600 72.146 50.095 1.00 7.29 A +ATOM 740 CG PHE A 102 50.546 72.979 49.431 1.00 7.87 A +ATOM 741 CD1 PHE A 102 50.799 73.681 48.256 1.00 8.98 A +ATOM 742 CD2 PHE A 102 49.264 73.053 49.997 1.00 7.94 A +ATOM 743 CE1 PHE A 102 49.822 74.451 47.641 1.00 10.13 A +ATOM 744 CE2 PHE A 102 48.256 73.816 49.401 1.00 8.74 A +ATOM 745 CZ PHE A 102 48.548 74.523 48.219 1.00 9.67 A +ATOM 746 N PRO A 103 52.655 70.515 52.750 1.00 6.23 A +ATOM 747 CA PRO A 103 53.723 69.588 53.188 1.00 6.02 A +ATOM 748 C PRO A 103 54.299 68.798 52.008 1.00 4.53 A +ATOM 749 O PRO A 103 53.729 68.719 50.898 1.00 4.36 A +ATOM 750 CB PRO A 103 52.895 68.557 54.011 1.00 7.30 A +ATOM 751 CG PRO A 103 51.613 69.236 54.398 1.00 7.26 A +ATOM 752 CD PRO A 103 51.314 70.155 53.207 1.00 6.81 A +ATOM 753 N ALA A 104 55.432 68.152 52.268 1.00 4.08 A +ATOM 754 CA ALA A 104 55.928 67.093 51.379 1.00 3.99 A +ATOM 755 C ALA A 104 54.866 65.961 51.514 1.00 3.68 A +ATOM 756 O ALA A 104 54.135 65.862 52.531 1.00 4.10 A +ATOM 757 CB ALA A 104 57.278 66.624 51.799 1.00 4.60 A +ATOM 758 N ARG A 105 54.754 65.116 50.488 1.00 4.14 A +ATOM 759 CA ARG A 105 53.701 64.091 50.483 1.00 4.07 A +ATOM 760 C ARG A 105 54.037 62.865 49.676 1.00 3.75 A +ATOM 761 O ARG A 105 54.784 62.974 48.671 1.00 3.67 A +ATOM 762 CB ARG A 105 52.439 64.776 49.844 1.00 5.04 A +ATOM 763 CG ARG A 105 51.168 63.932 49.901 1.00 6.68 A +ATOM 764 CD ARG A 105 49.920 64.669 49.471 1.00 7.36 A +ATOM 765 NE ARG A 105 49.942 64.950 48.059 1.00 9.16 A +ATOM 766 CZ ARG A 105 48.872 65.406 47.372 1.00 9.60 A +ATOM 767 NH1 ARG A 105 48.897 65.570 46.061 1.00 10.15 A +ATOM 768 NH2 ARG A 105 47.767 65.757 48.029 1.00 9.57 A +ATOM 769 N SER A 106 53.519 61.735 50.143 1.00 3.97 A +ATOM 770 CA SER A 106 53.565 60.496 49.356 1.00 4.51 A +ATOM 771 C SER A 106 52.082 60.072 49.212 1.00 4.12 A +ATOM 772 O SER A 106 51.289 60.266 50.144 1.00 4.73 A +ATOM 773 CB SER A 106 54.353 59.374 49.959 1.00 5.49 A +ATOM 774 OG SER A 106 55.710 59.796 49.957 1.00 6.48 A +HETATM 775 N CSP A 107 51.758 59.505 48.054 1.00 4.52 A +HETATM 776 CA CSP A 107 50.378 59.129 47.760 1.00 5.72 A +HETATM 777 CB CSP A 107 49.700 60.089 46.804 0.67 8.42 A +HETATM 779 SG CSP A 107 49.776 61.809 47.227 0.67 12.80 A +HETATM 780 P CSP A 107 51.167 62.354 45.759 0.67 14.01 A +HETATM 781 O1P CSP A 107 52.330 61.495 45.839 0.67 15.06 A +HETATM 782 O2P CSP A 107 50.515 62.084 44.369 0.67 15.90 A +HETATM 783 O3P CSP A 107 51.332 63.867 45.931 0.67 14.77 A +HETATM 784 C CSP A 107 50.355 57.779 47.046 1.00 4.97 A +HETATM 785 O CSP A 107 51.024 57.644 45.986 1.00 4.62 A +ATOM 787 N VAL A 108 49.572 56.859 47.551 1.00 4.59 A +ATOM 788 CA VAL A 108 49.485 55.529 46.918 1.00 4.55 A +ATOM 789 C VAL A 108 48.074 55.005 47.075 1.00 4.55 A +ATOM 790 O VAL A 108 47.373 55.353 48.046 1.00 4.69 A +ATOM 791 CB VAL A 108 50.491 54.549 47.594 1.00 4.96 A +ATOM 792 CG1 VAL A 108 51.949 54.998 47.484 1.00 5.33 A +ATOM 793 CG2 VAL A 108 50.132 54.200 49.027 1.00 6.15 A +ATOM 794 N GLU A 109 47.680 54.097 46.183 1.00 4.88 A +ATOM 795 CA GLU A 109 46.413 53.393 46.293 1.00 4.49 A +ATOM 796 C GLU A 109 46.709 52.038 46.954 1.00 4.13 A +ATOM 797 O GLU A 109 47.528 51.280 46.405 1.00 5.16 A +ATOM 798 CB GLU A 109 45.767 53.124 44.938 1.00 5.33 A +ATOM 799 CG GLU A 109 44.371 52.523 45.089 1.00 5.37 A +ATOM 800 CD GLU A 109 43.764 52.168 43.746 1.00 6.00 A +ATOM 801 OE1 GLU A 109 43.382 51.012 43.552 1.00 7.16 A +ATOM 802 OE2 GLU A 109 43.683 53.105 42.917 1.00 5.73 A +ATOM 803 N VAL A 110 46.081 51.785 48.087 1.00 4.12 A +ATOM 804 CA VAL A 110 46.266 50.496 48.778 1.00 5.16 A +ATOM 805 C VAL A 110 45.106 49.561 48.429 1.00 4.97 A +ATOM 806 O VAL A 110 44.159 49.994 47.748 1.00 5.83 A +ATOM 807 CB VAL A 110 46.324 50.727 50.295 1.00 5.61 A +ATOM 808 CG1 VAL A 110 47.521 51.594 50.678 1.00 6.03 A +ATOM 809 CG2 VAL A 110 45.036 51.320 50.844 1.00 5.94 A +ATOM 810 N ALA A 111 45.198 48.309 48.840 1.00 5.19 A +ATOM 811 CA ALA A 111 44.126 47.352 48.558 1.00 5.46 A +ATOM 812 C ALA A 111 42.900 47.562 49.429 1.00 5.34 A +ATOM 813 O ALA A 111 41.750 47.334 48.964 1.00 6.46 A +ATOM 814 CB ALA A 111 44.653 45.917 48.746 1.00 5.06 A +ATOM 815 N ARG A 112 43.091 47.959 50.685 1.00 5.42 A +ATOM 816 CA ARG A 112 41.972 48.127 51.619 1.00 5.97 A +ATOM 817 C ARG A 112 42.478 48.900 52.817 1.00 5.15 A +ATOM 818 O ARG A 112 43.687 48.874 53.130 1.00 5.33 A +ATOM 819 CB ARG A 112 41.486 46.742 52.068 1.00 5.86 A +ATOM 820 CG ARG A 112 40.113 46.714 52.715 1.00 7.01 A +ATOM 821 CD ARG A 112 39.755 45.315 53.123 1.00 7.87 A +ATOM 822 NE ARG A 112 38.438 45.315 53.754 1.00 9.03 A +ATOM 823 CZ ARG A 112 37.936 44.312 54.495 1.00 9.58 A +ATOM 824 NH1 ARG A 112 36.706 44.464 55.015 1.00 10.53 A +ATOM 825 NH2 ARG A 112 38.619 43.181 54.677 1.00 10.02 A +ATOM 826 N LEU A 113 41.571 49.596 53.475 1.00 5.16 A +ATOM 827 CA LEU A 113 41.860 50.392 54.662 1.00 5.23 A +ATOM 828 C LEU A 113 40.958 49.961 55.800 1.00 5.70 A +ATOM 829 O LEU A 113 39.890 49.350 55.580 1.00 6.10 A +ATOM 830 CB LEU A 113 41.632 51.873 54.335 1.00 5.50 A +ATOM 831 CG LEU A 113 42.649 52.474 53.370 1.00 5.34 A +ATOM 832 CD1 LEU A 113 42.176 53.859 52.921 1.00 5.70 A +ATOM 833 CD2 LEU A 113 44.032 52.557 54.010 1.00 4.99 A +ATOM 834 N PRO A 114 41.361 50.268 57.024 1.00 6.67 A +ATOM 835 CA PRO A 114 40.539 49.934 58.195 1.00 7.38 A +ATOM 836 C PRO A 114 39.124 50.475 57.984 1.00 7.04 A +ATOM 837 O PRO A 114 38.861 51.586 57.489 1.00 7.08 A +ATOM 838 CB PRO A 114 41.239 50.649 59.357 1.00 7.55 A +ATOM 839 CG PRO A 114 42.679 50.756 58.922 1.00 7.89 A +ATOM 840 CD PRO A 114 42.617 50.956 57.405 1.00 7.17 A +ATOM 841 N LYS A 115 38.152 49.650 58.370 1.00 7.96 A +ATOM 842 CA LYS A 115 36.717 49.953 58.299 1.00 9.22 A +ATOM 843 C LYS A 115 36.276 50.209 56.876 1.00 9.21 A +ATOM 844 O LYS A 115 35.203 50.835 56.725 1.00 9.21 A +ATOM 845 CB LYS A 115 36.379 51.173 59.162 1.00 10.55 A +ATOM 846 CG LYS A 115 36.740 50.934 60.632 1.00 12.98 A +ATOM 847 CD LYS A 115 36.179 52.106 61.449 1.00 15.15 A +ATOM 848 CE LYS A 115 36.188 51.791 62.932 1.00 16.92 A +ATOM 849 NZ LYS A 115 34.907 52.176 63.588 1.00 18.34 A +ATOM 850 N ASP A 116 37.020 49.783 55.882 1.00 8.41 A +ATOM 851 CA ASP A 116 36.653 50.010 54.481 1.00 8.14 A +ATOM 852 C ASP A 116 36.537 51.491 54.137 1.00 7.11 A +ATOM 853 O ASP A 116 35.783 51.846 53.192 1.00 8.04 A +ATOM 854 CB ASP A 116 35.408 49.198 54.075 1.00 9.13 A +ATOM 855 CG ASP A 116 35.783 47.712 53.984 1.00 10.16 A +ATOM 856 OD1 ASP A 116 35.295 46.977 54.853 1.00 11.23 A +ATOM 857 OD2 ASP A 116 36.542 47.365 53.069 1.00 10.06 A +ATOM 858 N VAL A 117 37.303 52.340 54.811 1.00 6.39 A +ATOM 859 CA VAL A 117 37.277 53.781 54.470 1.00 5.93 A +ATOM 860 C VAL A 117 37.988 53.972 53.123 1.00 5.45 A +ATOM 861 O VAL A 117 38.671 53.077 52.615 1.00 5.92 A +ATOM 862 CB VAL A 117 37.850 54.629 55.611 1.00 5.41 A +ATOM 863 CG1 VAL A 117 37.045 54.552 56.910 1.00 6.56 A +ATOM 864 CG2 VAL A 117 39.339 54.353 55.801 1.00 4.77 A +ATOM 865 N LYS A 118 37.861 55.159 52.599 1.00 5.60 A +ATOM 866 CA LYS A 118 38.448 55.494 51.309 1.00 5.78 A +ATOM 867 C LYS A 118 39.794 56.190 51.421 1.00 5.20 A +ATOM 868 O LYS A 118 40.449 56.351 50.398 1.00 4.89 A +ATOM 869 CB LYS A 118 37.481 56.401 50.545 1.00 6.48 A +ATOM 870 CG LYS A 118 36.142 55.766 50.197 1.00 8.03 A +ATOM 871 CD LYS A 118 35.093 56.681 49.587 1.00 10.35 A +ATOM 872 CE LYS A 118 33.779 55.939 49.354 1.00 12.02 A +ATOM 873 NZ LYS A 118 32.708 56.770 48.768 1.00 13.89 A +ATOM 874 N ILE A 119 40.201 56.595 52.620 1.00 4.72 A +ATOM 875 CA ILE A 119 41.442 57.347 52.805 1.00 4.45 A +ATOM 876 C ILE A 119 41.948 57.236 54.233 1.00 4.59 A +ATOM 877 O ILE A 119 41.151 57.090 55.158 1.00 4.61 A +ATOM 878 CB ILE A 119 41.166 58.835 52.378 1.00 4.91 A +ATOM 879 CG1 ILE A 119 42.496 59.638 52.307 1.00 4.94 A +ATOM 880 CG2 ILE A 119 40.145 59.557 53.294 1.00 5.42 A +ATOM 881 CD1 ILE A 119 42.276 60.967 51.552 1.00 5.66 A +ATOM 882 N GLU A 120 43.266 57.294 54.361 1.00 4.02 A +ATOM 883 CA GLU A 120 43.938 57.295 55.668 1.00 3.81 A +ATOM 884 C GLU A 120 45.119 58.249 55.491 1.00 3.77 A +ATOM 885 O GLU A 120 45.874 58.112 54.507 1.00 4.01 A +ATOM 886 CB GLU A 120 44.417 55.919 56.069 1.00 4.09 A +ATOM 887 CG GLU A 120 45.120 55.856 57.420 1.00 4.28 A +ATOM 888 CD GLU A 120 45.637 54.500 57.808 1.00 4.49 A +ATOM 889 OE1 GLU A 120 46.641 54.356 58.514 1.00 6.49 A +ATOM 890 OE2 GLU A 120 44.960 53.518 57.364 1.00 5.06 A +ATOM 891 N ILE A 121 45.302 59.173 56.418 1.00 3.35 A +ATOM 892 CA ILE A 121 46.382 60.161 56.304 1.00 3.57 A +ATOM 893 C ILE A 121 47.173 60.255 57.596 1.00 3.38 A +ATOM 894 O ILE A 121 46.614 60.488 58.665 1.00 3.55 A +ATOM 895 CB ILE A 121 45.799 61.584 56.009 1.00 4.18 A +ATOM 896 CG1 ILE A 121 44.888 61.562 54.777 1.00 5.00 A +ATOM 897 CG2 ILE A 121 46.938 62.619 55.858 1.00 5.16 A +ATOM 898 CD1 ILE A 121 44.198 62.912 54.470 1.00 5.62 A +ATOM 899 N GLU A 122 48.487 60.086 57.456 1.00 3.62 A +ATOM 900 CA GLU A 122 49.396 60.249 58.594 1.00 3.82 A +ATOM 901 C GLU A 122 50.201 61.524 58.342 1.00 3.47 A +ATOM 902 O GLU A 122 50.402 61.924 57.176 1.00 3.81 A +ATOM 903 CB GLU A 122 50.309 59.073 58.847 1.00 6.01 A +ATOM 904 CG GLU A 122 51.237 58.774 57.680 1.00 7.17 A +ATOM 905 CD GLU A 122 52.243 57.696 57.886 1.00 8.33 A +ATOM 906 OE1 GLU A 122 53.244 57.674 57.155 1.00 10.86 A +ATOM 907 OE2 GLU A 122 52.050 56.839 58.772 1.00 7.19 A +ATOM 908 N ALA A 123 50.651 62.151 59.418 1.00 4.17 A +ATOM 909 CA ALA A 123 51.377 63.409 59.272 1.00 4.16 A +ATOM 910 C ALA A 123 52.493 63.570 60.271 1.00 3.85 A +ATOM 911 O ALA A 123 52.469 62.978 61.371 1.00 4.05 A +ATOM 912 CB ALA A 123 50.429 64.603 59.479 1.00 5.43 A +ATOM 913 N ILE A 124 53.494 64.325 59.869 1.00 3.64 A +ATOM 914 CA ILE A 124 54.631 64.724 60.674 1.00 4.00 A +ATOM 915 C ILE A 124 54.613 66.259 60.714 1.00 3.37 A +ATOM 916 O ILE A 124 54.497 66.855 59.620 1.00 3.97 A +ATOM 917 CB ILE A 124 56.000 64.242 60.087 1.00 5.41 A +ATOM 918 CG1 ILE A 124 56.068 62.705 60.117 1.00 6.98 A +ATOM 919 CG2 ILE A 124 57.183 64.859 60.874 1.00 6.64 A +ATOM 920 CD1 ILE A 124 57.288 62.159 59.337 1.00 8.60 A +ATOM 921 N ALA A 125 54.752 66.842 61.880 1.00 3.70 A +ATOM 922 CA ALA A 125 54.808 68.301 62.068 1.00 4.32 A +ATOM 923 C ALA A 125 56.028 68.635 62.930 1.00 3.88 A +ATOM 924 O ALA A 125 56.523 67.777 63.665 1.00 4.96 A +ATOM 925 CB ALA A 125 53.501 68.783 62.702 1.00 5.11 A +ATOM 926 N VAL A 126 56.521 69.872 62.787 1.00 4.73 A +ATOM 927 CA VAL A 126 57.683 70.287 63.588 1.00 5.32 A +ATOM 928 C VAL A 126 57.397 71.648 64.218 1.00 5.65 A +ATOM 929 O VAL A 126 56.687 72.479 63.670 1.00 6.01 A +ATOM 930 CB VAL A 126 58.997 70.332 62.778 1.00 6.36 A +ATOM 931 CG1 VAL A 126 59.496 68.943 62.402 1.00 7.37 A +ATOM 932 CG2 VAL A 126 58.899 71.258 61.592 1.00 7.21 A +ATOM 933 N ARG A 127 58.004 71.813 65.384 1.00 5.90 A +ATOM 934 CA ARG A 127 57.867 73.105 66.095 1.00 8.86 A +ATOM 935 C ARG A 127 58.748 74.200 65.483 1.00 10.67 A +ATOM 936 O ARG A 127 58.297 75.374 65.521 1.00 12.25 A +ATOM 937 CB ARG A 127 58.270 73.010 67.564 1.00 8.97 A +ATOM 938 CG ARG A 127 57.429 71.998 68.304 1.00 8.83 A +ATOM 939 CD ARG A 127 57.632 72.173 69.812 1.00 9.65 A +ATOM 940 NE ARG A 127 56.885 71.128 70.494 1.00 8.63 A +ATOM 941 CZ ARG A 127 55.591 71.181 70.713 1.00 8.65 A +ATOM 942 NH1 ARG A 127 54.865 72.258 70.467 1.00 8.88 A +ATOM 943 NH2 ARG A 127 54.968 70.066 71.099 1.00 8.68 A +ATOM 944 N ARG A 128 59.905 73.836 65.001 1.00 12.46 A +ATOM 945 CA ARG A 128 60.872 74.766 64.407 1.00 14.89 A +ATOM 946 C ARG A 128 61.127 74.505 62.918 1.00 16.10 A +ATOM 947 O ARG A 128 61.112 73.288 62.583 1.00 17.58 A +ATOM 948 CB ARG A 128 62.222 74.648 65.151 1.00 15.67 A +ATOM 949 OXT ARG A 128 61.959 75.293 62.395 1.00 17.72 A +ATOM 951 N SER B 2 62.109 75.379 59.687 1.00 16.24 B +ATOM 952 CA SER B 2 61.990 74.424 58.545 1.00 15.30 B +ATOM 953 C SER B 2 61.682 75.199 57.256 1.00 13.90 B +ATOM 954 O SER B 2 61.094 76.306 57.298 1.00 15.02 B +ATOM 955 CB SER B 2 60.983 73.331 58.796 1.00 16.11 B +ATOM 956 OG SER B 2 59.642 73.778 58.666 1.00 18.37 B +ATOM 957 N LYS B 3 62.095 74.598 56.142 1.00 12.13 B +ATOM 958 CA LYS B 3 61.881 75.274 54.855 1.00 11.35 B +ATOM 959 C LYS B 3 61.619 74.285 53.732 1.00 8.65 B +ATOM 960 O LYS B 3 61.974 73.102 53.724 1.00 7.83 B +ATOM 961 CB LYS B 3 63.089 76.165 54.508 1.00 13.69 B +ATOM 962 CG LYS B 3 64.314 75.337 54.208 1.00 15.79 B +ATOM 963 CD LYS B 3 65.631 76.074 54.056 1.00 17.79 B +ATOM 964 CE LYS B 3 66.208 76.498 55.391 1.00 18.86 B +ATOM 965 NZ LYS B 3 67.628 76.966 55.266 1.00 20.35 B +ATOM 966 N THR B 4 60.953 74.837 52.734 1.00 7.14 B +ATOM 967 CA THR B 4 60.662 74.068 51.526 1.00 6.44 B +ATOM 968 C THR B 4 61.943 73.856 50.711 1.00 5.57 B +ATOM 969 O THR B 4 62.800 74.785 50.616 1.00 6.47 B +ATOM 970 CB THR B 4 59.713 74.950 50.619 1.00 7.10 B +ATOM 971 OG1 THR B 4 58.447 75.034 51.320 1.00 8.40 B +ATOM 972 CG2 THR B 4 59.526 74.383 49.209 1.00 7.78 B +ATOM 973 N ILE B 5 62.056 72.684 50.115 1.00 4.90 B +ATOM 974 CA ILE B 5 63.114 72.395 49.139 1.00 5.03 B +ATOM 975 C ILE B 5 62.401 72.500 47.762 1.00 5.26 B +ATOM 976 O ILE B 5 61.375 71.875 47.535 1.00 5.95 B +ATOM 977 CB ILE B 5 63.748 70.997 49.304 1.00 5.22 B +ATOM 978 CG1 ILE B 5 64.326 70.810 50.722 1.00 5.41 B +ATOM 979 CG2 ILE B 5 64.802 70.734 48.204 1.00 6.47 B +ATOM 980 CD1 ILE B 5 64.678 69.334 51.050 1.00 4.98 B +ATOM 981 N ALA B 6 62.990 73.340 46.901 1.00 5.80 B +ATOM 982 CA ALA B 6 62.428 73.548 45.548 1.00 7.32 B +ATOM 983 C ALA B 6 63.599 73.578 44.573 1.00 7.57 B +ATOM 984 O ALA B 6 64.516 74.414 44.680 1.00 10.07 B +ATOM 985 CB ALA B 6 61.583 74.808 45.481 1.00 8.24 B +ATOM 986 N THR B 7 63.612 72.613 43.666 1.00 6.19 B +ATOM 987 CA THR B 7 64.681 72.481 42.676 1.00 6.55 B +ATOM 988 C THR B 7 64.145 72.188 41.286 1.00 5.76 B +ATOM 989 O THR B 7 63.171 71.468 41.146 1.00 6.20 B +ATOM 990 CB THR B 7 65.663 71.330 43.117 1.00 7.01 B +ATOM 991 OG1 THR B 7 66.622 71.214 42.032 1.00 7.16 B +ATOM 992 CG2 THR B 7 65.012 69.980 43.363 1.00 7.30 B +ATOM 993 N GLU B 8 64.754 72.807 40.282 1.00 6.37 B +ATOM 994 CA GLU B 8 64.376 72.568 38.895 1.00 6.48 B +ATOM 995 C GLU B 8 64.803 71.162 38.497 1.00 6.14 B +ATOM 996 O GLU B 8 64.341 70.650 37.460 1.00 6.07 B +ATOM 997 CB GLU B 8 65.033 73.559 37.922 1.00 7.91 B +ATOM 998 CG GLU B 8 66.540 73.490 37.722 1.00 9.70 B +ATOM 999 CD GLU B 8 67.395 74.051 38.814 1.00 11.36 B +ATOM 1000 OE1 GLU B 8 66.979 74.261 39.958 1.00 12.18 B +ATOM 1001 OE2 GLU B 8 68.603 74.276 38.489 1.00 13.35 B +ATOM 1002 N ASN B 9 65.675 70.529 39.286 1.00 6.75 B +ATOM 1003 CA ASN B 9 66.220 69.204 38.967 1.00 7.05 B +ATOM 1004 C ASN B 9 65.308 68.025 39.238 1.00 7.06 B +ATOM 1005 O ASN B 9 65.680 66.872 38.959 1.00 6.95 B +ATOM 1006 CB ASN B 9 67.590 69.019 39.590 1.00 7.91 B +ATOM 1007 CG ASN B 9 68.573 70.034 39.030 1.00 9.05 B +ATOM 1008 OD1 ASN B 9 68.514 70.332 37.816 1.00 10.43 B +ATOM 1009 ND2 ASN B 9 69.410 70.545 39.902 1.00 9.59 B +ATOM 1010 N ALA B 10 64.140 68.250 39.839 1.00 5.82 B +ATOM 1011 CA ALA B 10 63.131 67.198 40.069 1.00 5.77 B +ATOM 1012 C ALA B 10 61.835 67.795 39.464 1.00 6.13 B +ATOM 1013 O ALA B 10 61.744 69.012 39.310 1.00 5.80 B +ATOM 1014 CB ALA B 10 62.935 66.850 41.527 1.00 6.12 B +ATOM 1015 N PRO B 11 60.887 66.939 39.127 1.00 6.62 B +ATOM 1016 CA PRO B 11 59.626 67.427 38.556 1.00 6.86 B +ATOM 1017 C PRO B 11 58.991 68.470 39.432 1.00 6.78 B +ATOM 1018 O PRO B 11 58.925 68.299 40.681 1.00 6.19 B +ATOM 1019 CB PRO B 11 58.750 66.191 38.483 1.00 7.77 B +ATOM 1020 CG PRO B 11 59.680 65.012 38.512 1.00 8.11 B +ATOM 1021 CD PRO B 11 60.918 65.475 39.270 1.00 7.42 B +ATOM 1022 N ALA B 12 58.469 69.527 38.830 1.00 8.21 B +ATOM 1023 CA ALA B 12 57.836 70.624 39.572 1.00 9.55 B +ATOM 1024 C ALA B 12 56.629 70.099 40.348 1.00 10.63 B +ATOM 1025 O ALA B 12 55.909 69.197 39.905 1.00 9.79 B +ATOM 1026 CB ALA B 12 57.344 71.687 38.589 1.00 10.50 B +ATOM 1027 N ALA B 13 56.468 70.685 41.520 1.00 11.95 B +ATOM 1028 CA ALA B 13 55.363 70.356 42.435 1.00 14.35 B +ATOM 1029 C ALA B 13 54.159 71.201 42.006 1.00 15.86 B +ATOM 1030 O ALA B 13 54.077 72.361 42.446 1.00 17.22 B +ATOM 1031 CB ALA B 13 55.728 70.640 43.882 1.00 14.52 B +ATOM 1032 N ILE B 14 53.335 70.571 41.192 1.00 16.89 B +ATOM 1033 CA ILE B 14 52.121 71.268 40.701 1.00 18.21 B +ATOM 1034 C ILE B 14 50.983 71.151 41.712 1.00 18.11 B +ATOM 1035 O ILE B 14 50.420 72.218 42.096 1.00 19.37 B +ATOM 1036 CB ILE B 14 51.808 70.805 39.249 1.00 19.06 B +ATOM 1037 CG1 ILE B 14 53.063 71.045 38.352 1.00 19.75 B +ATOM 1038 CG2 ILE B 14 50.571 71.498 38.616 1.00 19.75 B +ATOM 1039 CD1 ILE B 14 52.904 70.339 36.972 1.00 20.29 B +ATOM 1040 N GLY B 15 50.671 69.955 42.164 1.00 17.28 B +ATOM 1041 CA GLY B 15 49.589 69.783 43.173 1.00 15.10 B +ATOM 1042 C GLY B 15 49.929 70.474 44.499 1.00 13.16 B +ATOM 1043 O GLY B 15 50.901 71.233 44.655 1.00 14.07 B +ATOM 1044 N PRO B 16 49.082 70.180 45.491 1.00 11.29 B +ATOM 1045 CA PRO B 16 49.214 70.743 46.834 1.00 9.14 B +ATOM 1046 C PRO B 16 50.263 70.025 47.663 1.00 8.00 B +ATOM 1047 O PRO B 16 49.940 69.393 48.680 1.00 6.68 B +ATOM 1048 CB PRO B 16 47.790 70.627 47.384 1.00 9.25 B +ATOM 1049 CG PRO B 16 47.323 69.299 46.821 1.00 9.12 B +ATOM 1050 CD PRO B 16 47.874 69.312 45.393 1.00 10.61 B +ATOM 1051 N TYR B 17 51.512 70.158 47.238 1.00 6.92 B +ATOM 1052 CA TYR B 17 52.643 69.552 47.969 1.00 6.14 B +ATOM 1053 C TYR B 17 53.900 70.301 47.559 1.00 5.54 B +ATOM 1054 O TYR B 17 53.863 71.069 46.568 1.00 7.15 B +ATOM 1055 CB TYR B 17 52.770 68.038 47.653 1.00 6.78 B +ATOM 1056 CG TYR B 17 53.035 67.760 46.184 1.00 7.73 B +ATOM 1057 CD1 TYR B 17 54.354 67.570 45.725 1.00 8.18 B +ATOM 1058 CD2 TYR B 17 52.031 67.736 45.220 1.00 8.87 B +ATOM 1059 CE1 TYR B 17 54.645 67.316 44.386 1.00 9.51 B +ATOM 1060 CE2 TYR B 17 52.309 67.498 43.868 1.00 10.50 B +ATOM 1061 CZ TYR B 17 53.612 67.302 43.463 1.00 10.45 B +ATOM 1062 OH TYR B 17 53.906 67.069 42.136 1.00 12.81 B +ATOM 1063 N VAL B 18 54.974 70.101 48.285 1.00 5.53 B +ATOM 1064 CA VAL B 18 56.302 70.616 47.936 1.00 5.01 B +ATOM 1065 C VAL B 18 57.143 69.366 47.657 1.00 5.01 B +ATOM 1066 O VAL B 18 56.823 68.264 48.112 1.00 5.04 B +ATOM 1067 CB VAL B 18 56.929 71.510 48.995 1.00 5.59 B +ATOM 1068 CG1 VAL B 18 56.116 72.797 49.086 1.00 6.33 B +ATOM 1069 CG2 VAL B 18 57.091 70.825 50.342 1.00 6.00 B +ATOM 1070 N GLN B 19 58.244 69.553 46.945 1.00 4.48 B +ATOM 1071 CA GLN B 19 59.142 68.446 46.600 1.00 4.00 B +ATOM 1072 C GLN B 19 59.775 67.805 47.834 1.00 3.80 B +ATOM 1073 O GLN B 19 60.035 66.598 47.857 1.00 3.75 B +ATOM 1074 CB GLN B 19 60.267 68.895 45.663 1.00 5.03 B +ATOM 1075 CG GLN B 19 59.743 69.363 44.310 1.00 5.44 B +ATOM 1076 CD GLN B 19 60.837 70.048 43.542 1.00 5.87 B +ATOM 1077 OE1 GLN B 19 61.623 70.789 44.130 1.00 7.44 B +ATOM 1078 NE2 GLN B 19 60.896 69.850 42.220 1.00 6.86 B +ATOM 1079 N GLY B 20 60.101 68.629 48.826 1.00 4.08 B +ATOM 1080 CA GLY B 20 60.731 68.083 50.054 1.00 3.84 B +ATOM 1081 C GLY B 20 60.795 69.194 51.077 1.00 3.63 B +ATOM 1082 O GLY B 20 60.515 70.366 50.763 1.00 3.92 B +ATOM 1083 N VAL B 21 61.175 68.820 52.293 1.00 3.33 B +ATOM 1084 CA VAL B 21 61.313 69.766 53.390 1.00 3.95 B +ATOM 1085 C VAL B 21 62.676 69.576 54.047 1.00 3.79 B +ATOM 1086 O VAL B 21 63.146 68.449 54.224 1.00 4.94 B +ATOM 1087 CB VAL B 21 60.160 69.624 54.401 1.00 3.78 B +ATOM 1088 CG1 VAL B 21 58.864 70.091 53.754 1.00 4.83 B +ATOM 1089 CG2 VAL B 21 60.047 68.190 54.888 1.00 4.51 B +ATOM 1090 N ASP B 22 63.260 70.702 54.402 1.00 4.14 B +ATOM 1091 CA ASP B 22 64.566 70.749 55.097 1.00 4.70 B +ATOM 1092 C ASP B 22 64.213 71.148 56.528 1.00 4.45 B +ATOM 1093 O ASP B 22 63.839 72.315 56.763 1.00 5.58 B +ATOM 1094 CB ASP B 22 65.504 71.720 54.398 1.00 6.22 B +ATOM 1095 CG ASP B 22 66.810 71.968 55.106 1.00 7.08 B +ATOM 1096 OD1 ASP B 22 67.693 72.601 54.461 1.00 8.97 B +ATOM 1097 OD2 ASP B 22 66.976 71.563 56.249 1.00 7.76 B +ATOM 1098 N LEU B 23 64.305 70.241 57.471 1.00 4.71 B +ATOM 1099 CA LEU B 23 63.966 70.471 58.871 1.00 5.58 B +ATOM 1100 C LEU B 23 65.149 70.823 59.745 1.00 6.38 B +ATOM 1101 O LEU B 23 64.983 70.882 60.979 1.00 8.55 B +ATOM 1102 CB LEU B 23 63.270 69.193 59.403 1.00 5.54 B +ATOM 1103 CG LEU B 23 62.154 68.674 58.507 1.00 6.24 B +ATOM 1104 CD1 LEU B 23 61.512 67.451 59.178 1.00 6.77 B +ATOM 1105 CD2 LEU B 23 61.054 69.707 58.259 1.00 6.93 B +ATOM 1106 N GLY B 24 66.286 71.039 59.166 1.00 6.72 B +ATOM 1107 CA GLY B 24 67.523 71.338 59.920 1.00 7.67 B +ATOM 1108 C GLY B 24 68.400 70.084 59.707 1.00 7.60 B +ATOM 1109 O GLY B 24 68.942 69.915 58.600 1.00 8.31 B +ATOM 1110 N ASN B 25 68.474 69.248 60.704 1.00 7.01 B +ATOM 1111 CA ASN B 25 69.301 68.036 60.524 1.00 7.87 B +ATOM 1112 C ASN B 25 68.622 67.049 59.570 1.00 7.17 B +ATOM 1113 O ASN B 25 69.317 66.371 58.790 1.00 7.79 B +ATOM 1114 CB ASN B 25 69.507 67.343 61.872 1.00 9.22 B +ATOM 1115 CG ASN B 25 70.393 66.113 61.713 1.00 10.32 B +ATOM 1116 OD1 ASN B 25 71.506 66.200 61.175 1.00 12.32 B +ATOM 1117 ND2 ASN B 25 69.869 64.967 62.167 1.00 11.31 B +ATOM 1118 N MET B 26 67.320 66.912 59.596 1.00 6.21 B +ATOM 1119 CA MET B 26 66.599 65.949 58.766 1.00 5.60 B +ATOM 1120 C MET B 26 65.937 66.583 57.556 1.00 5.14 B +ATOM 1121 O MET B 26 65.301 67.653 57.663 1.00 5.60 B +ATOM 1122 CB MET B 26 65.517 65.295 59.657 1.00 6.37 B +ATOM 1123 CG MET B 26 64.822 64.201 58.892 1.00 7.10 B +ATOM 1124 SD MET B 26 63.718 63.237 59.952 1.00 8.83 B +ATOM 1125 CE MET B 26 64.935 62.195 60.817 1.00 9.98 B +ATOM 1126 N ILE B 27 66.080 65.904 56.435 1.00 4.19 B +ATOM 1127 CA ILE B 27 65.439 66.272 55.172 1.00 4.28 B +ATOM 1128 C ILE B 27 64.446 65.142 54.845 1.00 3.82 B +ATOM 1129 O ILE B 27 64.828 63.960 54.992 1.00 3.92 B +ATOM 1130 CB ILE B 27 66.521 66.370 54.038 1.00 6.29 B +ATOM 1131 CG1 ILE B 27 67.247 67.744 54.078 1.00 7.15 B +ATOM 1132 CG2 ILE B 27 65.945 66.085 52.630 1.00 7.40 B +ATOM 1133 CD1 ILE B 27 67.892 68.089 55.432 1.00 7.34 B +ATOM 1134 N ILE B 28 63.256 65.496 54.416 1.00 3.50 B +ATOM 1135 CA ILE B 28 62.289 64.494 54.000 1.00 3.86 B +ATOM 1136 C ILE B 28 61.811 64.841 52.595 1.00 3.50 B +ATOM 1137 O ILE B 28 61.387 66.009 52.349 1.00 4.39 B +ATOM 1138 CB ILE B 28 61.051 64.397 54.955 1.00 4.84 B +ATOM 1139 CG1 ILE B 28 61.518 64.271 56.417 1.00 5.31 B +ATOM 1140 CG2 ILE B 28 60.136 63.234 54.508 1.00 5.87 B +ATOM 1141 CD1 ILE B 28 60.336 64.133 57.405 1.00 5.89 B +ATOM 1142 N THR B 29 61.836 63.885 51.698 1.00 3.96 B +ATOM 1143 CA THR B 29 61.295 64.117 50.363 1.00 4.14 B +ATOM 1144 C THR B 29 59.858 63.625 50.241 1.00 3.59 B +ATOM 1145 O THR B 29 59.398 62.751 50.957 1.00 4.36 B +ATOM 1146 CB THR B 29 62.148 63.402 49.229 1.00 4.08 B +ATOM 1147 OG1 THR B 29 61.797 62.003 49.151 1.00 3.82 B +ATOM 1148 CG2 THR B 29 63.662 63.547 49.413 1.00 4.97 B +ATOM 1149 N SER B 30 59.184 64.195 49.245 1.00 3.82 B +ATOM 1150 CA SER B 30 57.896 63.673 48.819 1.00 3.64 B +ATOM 1151 C SER B 30 58.225 62.342 48.083 1.00 3.76 B +ATOM 1152 O SER B 30 59.377 62.094 47.678 1.00 4.49 B +ATOM 1153 CB SER B 30 57.269 64.615 47.782 1.00 3.92 B +ATOM 1154 OG SER B 30 56.635 65.679 48.466 1.00 4.47 B +ATOM 1155 N GLY B 31 57.202 61.521 47.915 1.00 3.83 B +ATOM 1156 CA GLY B 31 57.299 60.254 47.176 1.00 4.29 B +ATOM 1157 C GLY B 31 57.583 60.617 45.727 1.00 4.32 B +ATOM 1158 O GLY B 31 56.714 61.268 45.108 1.00 6.10 B +ATOM 1159 N GLN B 32 58.708 60.248 45.164 1.00 3.41 B +ATOM 1160 CA GLN B 32 59.085 60.581 43.789 1.00 3.93 B +ATOM 1161 C GLN B 32 58.647 59.469 42.841 1.00 3.99 B +ATOM 1162 O GLN B 32 58.943 58.292 43.019 1.00 4.71 B +ATOM 1163 CB GLN B 32 60.603 60.781 43.678 1.00 4.22 B +ATOM 1164 CG GLN B 32 61.116 61.955 44.494 1.00 3.95 B +ATOM 1165 CD GLN B 32 60.387 63.233 44.181 1.00 4.74 B +ATOM 1166 OE1 GLN B 32 60.399 63.674 43.025 1.00 5.56 B +ATOM 1167 NE2 GLN B 32 59.688 63.775 45.179 1.00 4.99 B +ATOM 1168 N ILE B 33 58.014 59.924 41.772 1.00 5.20 B +ATOM 1169 CA ILE B 33 57.594 59.037 40.684 1.00 5.52 B +ATOM 1170 C ILE B 33 58.558 59.277 39.527 1.00 5.61 B +ATOM 1171 O ILE B 33 59.271 60.308 39.471 1.00 5.33 B +ATOM 1172 CB ILE B 33 56.109 59.247 40.335 1.00 6.50 B +ATOM 1173 CG1 ILE B 33 55.811 60.720 39.958 1.00 7.36 B +ATOM 1174 CG2 ILE B 33 55.181 58.775 41.489 1.00 7.63 B +ATOM 1175 CD1 ILE B 33 54.422 60.854 39.290 1.00 8.30 B +ATOM 1176 N PRO B 34 58.600 58.333 38.606 1.00 5.57 B +ATOM 1177 CA PRO B 34 59.576 58.367 37.522 1.00 5.47 B +ATOM 1178 C PRO B 34 59.282 59.321 36.371 1.00 5.79 B +ATOM 1179 O PRO B 34 59.360 58.907 35.192 1.00 7.27 B +ATOM 1180 CB PRO B 34 59.664 56.914 37.030 1.00 5.88 B +ATOM 1181 CG PRO B 34 58.276 56.396 37.325 1.00 6.23 B +ATOM 1182 CD PRO B 34 57.937 57.019 38.678 1.00 5.26 B +ATOM 1183 N VAL B 35 58.985 60.555 36.721 1.00 5.68 B +ATOM 1184 CA VAL B 35 58.775 61.601 35.706 1.00 6.40 B +ATOM 1185 C VAL B 35 60.117 62.295 35.492 1.00 5.88 B +ATOM 1186 O VAL B 35 60.824 62.677 36.425 1.00 5.93 B +ATOM 1187 CB VAL B 35 57.731 62.615 36.200 1.00 7.54 B +ATOM 1188 CG1 VAL B 35 57.671 63.850 35.300 1.00 7.74 B +ATOM 1189 CG2 VAL B 35 56.376 61.976 36.356 1.00 7.73 B +ATOM 1190 N ASN B 36 60.449 62.453 34.209 1.00 6.56 B +ATOM 1191 CA ASN B 36 61.711 63.134 33.832 1.00 7.61 B +ATOM 1192 C ASN B 36 61.509 64.632 34.009 1.00 7.47 B +ATOM 1193 O ASN B 36 60.575 65.195 33.398 1.00 8.51 B +ATOM 1194 CB ASN B 36 62.016 62.735 32.397 1.00 9.42 B +ATOM 1195 CG ASN B 36 63.262 63.346 31.815 1.00 11.61 B +ATOM 1196 OD1 ASN B 36 63.471 64.567 31.911 1.00 12.84 B +ATOM 1197 ND2 ASN B 36 64.047 62.500 31.143 1.00 12.39 B +ATOM 1198 N PRO B 37 62.330 65.329 34.757 1.00 7.10 B +ATOM 1199 CA PRO B 37 62.151 66.766 34.975 1.00 8.07 B +ATOM 1200 C PRO B 37 62.412 67.622 33.759 1.00 8.69 B +ATOM 1201 O PRO B 37 62.001 68.790 33.731 1.00 9.39 B +ATOM 1202 CB PRO B 37 63.114 67.097 36.114 1.00 8.93 B +ATOM 1203 CG PRO B 37 64.190 66.064 35.942 1.00 9.33 B +ATOM 1204 CD PRO B 37 63.459 64.793 35.519 1.00 8.45 B +ATOM 1205 N LYS B 38 63.140 67.088 32.797 1.00 9.24 B +ATOM 1206 CA LYS B 38 63.446 67.841 31.560 1.00 11.17 B +ATOM 1207 C LYS B 38 62.270 67.772 30.604 1.00 11.35 B +ATOM 1208 O LYS B 38 61.908 68.821 30.007 1.00 12.18 B +ATOM 1209 CB LYS B 38 64.682 67.259 30.905 1.00 12.66 B +ATOM 1210 CG LYS B 38 65.260 67.972 29.693 1.00 13.74 B +ATOM 1211 CD LYS B 38 66.600 67.360 29.220 1.00 14.42 B +ATOM 1212 CE LYS B 38 67.638 67.528 30.156 1.00 17.20 B +ATOM 1213 NZ LYS B 38 67.909 68.973 30.401 1.00 18.80 B +ATOM 1214 N THR B 39 61.667 66.605 30.410 1.00 11.29 B +ATOM 1215 CA THR B 39 60.585 66.426 29.447 1.00 11.38 B +ATOM 1216 C THR B 39 59.192 66.161 29.945 1.00 11.67 B +ATOM 1217 O THR B 39 58.231 66.283 29.146 1.00 12.12 B +ATOM 1218 CB THR B 39 60.967 65.202 28.498 1.00 11.46 B +ATOM 1219 OG1 THR B 39 60.899 64.024 29.377 1.00 11.47 B +ATOM 1220 CG2 THR B 39 62.342 65.321 27.870 1.00 12.27 B +ATOM 1221 N GLY B 40 59.069 65.724 31.191 1.00 11.14 B +ATOM 1222 CA GLY B 40 57.763 65.397 31.757 1.00 11.25 B +ATOM 1223 C GLY B 40 57.343 63.969 31.414 1.00 11.36 B +ATOM 1224 O GLY B 40 56.264 63.543 31.858 1.00 12.70 B +ATOM 1225 N GLU B 41 58.149 63.248 30.667 1.00 11.11 B +ATOM 1226 CA GLU B 41 57.815 61.871 30.278 1.00 11.71 B +ATOM 1227 C GLU B 41 58.245 60.833 31.296 1.00 10.19 B +ATOM 1228 O GLU B 41 59.139 61.111 32.099 1.00 10.11 B +ATOM 1229 CB GLU B 41 58.517 61.534 28.947 1.00 13.86 B +ATOM 1230 CG GLU B 41 57.967 62.414 27.808 1.00 16.75 B +ATOM 1231 CD GLU B 41 58.606 62.196 26.469 1.00 18.82 B +ATOM 1232 OE1 GLU B 41 59.711 61.693 26.338 1.00 19.76 B +ATOM 1233 OE2 GLU B 41 57.848 62.618 25.559 1.00 20.70 B +ATOM 1234 N VAL B 42 57.633 59.670 31.202 1.00 9.39 B +ATOM 1235 CA VAL B 42 57.933 58.529 32.092 1.00 8.66 B +ATOM 1236 C VAL B 42 58.479 57.415 31.207 1.00 8.84 B +ATOM 1237 O VAL B 42 57.758 57.073 30.227 1.00 8.91 B +ATOM 1238 CB VAL B 42 56.643 58.081 32.799 1.00 8.81 B +ATOM 1239 CG1 VAL B 42 56.885 56.777 33.559 1.00 8.55 B +ATOM 1240 CG2 VAL B 42 56.120 59.169 33.725 1.00 9.11 B +ATOM 1241 N PRO B 43 59.617 56.877 31.514 1.00 8.44 B +ATOM 1242 CA PRO B 43 60.210 55.791 30.715 1.00 9.28 B +ATOM 1243 C PRO B 43 59.367 54.546 30.918 1.00 9.79 B +ATOM 1244 O PRO B 43 58.768 54.342 32.000 1.00 9.85 B +ATOM 1245 CB PRO B 43 61.650 55.701 31.207 1.00 9.38 B +ATOM 1246 CG PRO B 43 61.567 56.141 32.652 1.00 9.11 B +ATOM 1247 CD PRO B 43 60.480 57.216 32.661 1.00 8.87 B +ATOM 1248 N ALA B 44 59.303 53.711 29.882 1.00 11.00 B +ATOM 1249 CA ALA B 44 58.508 52.480 29.932 1.00 11.90 B +ATOM 1250 C ALA B 44 59.042 51.404 30.874 1.00 12.03 B +ATOM 1251 O ALA B 44 58.329 50.802 31.691 1.00 13.47 B +ATOM 1252 CB ALA B 44 58.433 51.963 28.484 1.00 12.50 B +ATOM 1253 N ASP B 45 60.303 51.148 30.762 1.00 11.52 B +ATOM 1254 CA ASP B 45 61.135 50.149 31.428 1.00 11.81 B +ATOM 1255 C ASP B 45 61.109 50.292 32.946 1.00 10.80 B +ATOM 1256 O ASP B 45 61.365 51.424 33.415 1.00 9.73 B +ATOM 1257 CB ASP B 45 62.522 50.311 30.749 1.00 12.76 B +ATOM 1258 CG ASP B 45 63.505 49.304 31.268 1.00 14.25 B +ATOM 1259 OD1 ASP B 45 64.292 49.667 32.157 1.00 13.77 B +ATOM 1260 OD2 ASP B 45 63.527 48.132 30.805 1.00 15.41 B +ATOM 1261 N VAL B 46 60.863 49.235 33.695 1.00 10.67 B +ATOM 1262 CA VAL B 46 60.837 49.368 35.167 1.00 9.52 B +ATOM 1263 C VAL B 46 62.188 49.754 35.756 1.00 7.84 B +ATOM 1264 O VAL B 46 62.245 50.509 36.743 1.00 7.66 B +ATOM 1265 CB VAL B 46 60.208 48.136 35.839 1.00 10.26 B +ATOM 1266 CG1 VAL B 46 61.046 46.877 35.681 1.00 10.79 B +ATOM 1267 CG2 VAL B 46 59.868 48.431 37.284 1.00 10.65 B +ATOM 1268 N ALA B 47 63.265 49.237 35.185 1.00 7.55 B +ATOM 1269 CA ALA B 47 64.600 49.612 35.697 1.00 7.95 B +ATOM 1270 C ALA B 47 64.795 51.114 35.497 1.00 7.45 B +ATOM 1271 O ALA B 47 65.283 51.831 36.408 1.00 7.40 B +ATOM 1272 CB ALA B 47 65.692 48.813 35.003 1.00 8.33 B +ATOM 1273 N ALA B 48 64.432 51.602 34.327 1.00 6.86 B +ATOM 1274 CA ALA B 48 64.567 53.034 34.040 1.00 6.14 B +ATOM 1275 C ALA B 48 63.666 53.826 34.976 1.00 5.74 B +ATOM 1276 O ALA B 48 64.063 54.919 35.401 1.00 5.87 B +ATOM 1277 CB ALA B 48 64.257 53.277 32.576 1.00 6.39 B +ATOM 1278 N GLN B 49 62.494 53.331 35.270 1.00 5.59 B +ATOM 1279 CA GLN B 49 61.597 54.043 36.209 1.00 5.03 B +ATOM 1280 C GLN B 49 62.247 54.116 37.590 1.00 4.68 B +ATOM 1281 O GLN B 49 62.234 55.172 38.233 1.00 5.23 B +ATOM 1282 CB GLN B 49 60.225 53.385 36.255 1.00 5.71 B +ATOM 1283 CG GLN B 49 59.395 53.671 34.994 1.00 6.17 B +ATOM 1284 CD GLN B 49 57.921 53.381 35.202 1.00 5.93 B +ATOM 1285 OE1 GLN B 49 57.420 53.335 36.340 1.00 5.99 B +ATOM 1286 NE2 GLN B 49 57.175 53.220 34.110 1.00 6.38 B +ATOM 1287 N ALA B 50 62.786 52.982 38.029 1.00 4.71 B +ATOM 1288 CA ALA B 50 63.431 53.010 39.364 1.00 4.54 B +ATOM 1289 C ALA B 50 64.554 54.046 39.396 1.00 4.94 B +ATOM 1290 O ALA B 50 64.694 54.833 40.349 1.00 4.87 B +ATOM 1291 CB ALA B 50 63.973 51.649 39.764 1.00 5.66 B +ATOM 1292 N ARG B 51 65.338 54.078 38.327 1.00 5.38 B +ATOM 1293 CA ARG B 51 66.439 55.051 38.260 1.00 5.49 B +ATOM 1294 C ARG B 51 65.950 56.478 38.200 1.00 5.04 B +ATOM 1295 O ARG B 51 66.565 57.349 38.845 1.00 6.12 B +ATOM 1296 CB ARG B 51 67.419 54.730 37.136 1.00 6.73 B +ATOM 1297 CG ARG B 51 68.640 55.631 37.074 1.00 7.56 B +ATOM 1298 CD ARG B 51 69.722 55.064 36.205 1.00 8.32 B +ATOM 1299 NE ARG B 51 70.418 53.902 36.735 1.00 8.95 B +ATOM 1300 CZ ARG B 51 71.442 53.925 37.601 1.00 9.18 B +ATOM 1301 NH1 ARG B 51 71.924 55.070 38.084 1.00 8.39 B +ATOM 1302 NH2 ARG B 51 71.993 52.772 37.999 1.00 10.81 B +ATOM 1303 N GLN B 52 64.896 56.762 37.460 1.00 4.75 B +ATOM 1304 CA GLN B 52 64.365 58.134 37.375 1.00 4.61 B +ATOM 1305 C GLN B 52 63.848 58.546 38.755 1.00 4.34 B +ATOM 1306 O GLN B 52 64.060 59.715 39.161 1.00 4.87 B +ATOM 1307 CB GLN B 52 63.303 58.235 36.296 1.00 5.74 B +ATOM 1308 CG GLN B 52 62.806 59.657 36.148 1.00 5.80 B +ATOM 1309 CD GLN B 52 63.854 60.622 35.679 1.00 6.30 B +ATOM 1310 OE1 GLN B 52 64.133 60.690 34.471 1.00 7.97 B +ATOM 1311 NE2 GLN B 52 64.428 61.386 36.576 1.00 7.04 B +ATOM 1312 N SER B 53 63.125 57.667 39.438 1.00 4.36 B +ATOM 1313 CA SER B 53 62.658 58.016 40.796 1.00 4.64 B +ATOM 1314 C SER B 53 63.831 58.319 41.730 1.00 4.34 B +ATOM 1315 O SER B 53 63.783 59.298 42.486 1.00 4.42 B +ATOM 1316 CB SER B 53 61.801 56.895 41.346 1.00 5.03 B +ATOM 1317 OG SER B 53 60.480 56.920 40.874 1.00 7.71 B +ATOM 1318 N LEU B 54 64.858 57.494 41.672 1.00 4.12 B +ATOM 1319 CA LEU B 54 66.053 57.715 42.501 1.00 4.70 B +ATOM 1320 C LEU B 54 66.747 59.020 42.130 1.00 3.93 B +ATOM 1321 O LEU B 54 67.222 59.740 43.026 1.00 4.71 B +ATOM 1322 CB LEU B 54 66.961 56.508 42.407 1.00 5.03 B +ATOM 1323 CG LEU B 54 66.430 55.288 43.166 1.00 5.82 B +ATOM 1324 CD1 LEU B 54 67.223 54.045 42.760 1.00 5.88 B +ATOM 1325 CD2 LEU B 54 66.492 55.463 44.673 1.00 6.70 B +ATOM 1326 N ASP B 55 66.819 59.334 40.853 1.00 4.46 B +ATOM 1327 CA ASP B 55 67.461 60.595 40.440 1.00 4.76 B +ATOM 1328 C ASP B 55 66.648 61.777 40.976 1.00 5.09 B +ATOM 1329 O ASP B 55 67.240 62.801 41.316 1.00 4.83 B +ATOM 1330 CB ASP B 55 67.603 60.620 38.926 1.00 6.75 B +ATOM 1331 CG ASP B 55 68.831 59.894 38.396 1.00 8.66 B +ATOM 1332 OD1 ASP B 55 68.842 59.457 37.229 1.00 10.67 B +ATOM 1333 OD2 ASP B 55 69.804 59.813 39.156 1.00 10.74 B +ATOM 1334 N ASN B 56 65.338 61.607 40.966 1.00 4.45 B +ATOM 1335 CA ASN B 56 64.473 62.713 41.477 1.00 3.71 B +ATOM 1336 C ASN B 56 64.745 62.874 42.971 1.00 3.25 B +ATOM 1337 O ASN B 56 64.821 64.018 43.473 1.00 4.24 B +ATOM 1338 CB ASN B 56 62.994 62.455 41.182 1.00 4.47 B +ATOM 1339 CG ASN B 56 62.707 62.655 39.696 1.00 4.53 B +ATOM 1340 OD1 ASN B 56 63.521 63.249 38.956 1.00 5.62 B +ATOM 1341 ND2 ASN B 56 61.580 62.124 39.213 1.00 4.94 B +ATOM 1342 N VAL B 57 64.803 61.766 43.710 1.00 4.41 B +ATOM 1343 CA VAL B 57 65.125 61.842 45.156 1.00 4.09 B +ATOM 1344 C VAL B 57 66.462 62.535 45.322 1.00 3.73 B +ATOM 1345 O VAL B 57 66.644 63.454 46.150 1.00 4.05 B +ATOM 1346 CB VAL B 57 65.167 60.449 45.777 1.00 4.49 B +ATOM 1347 CG1 VAL B 57 65.858 60.478 47.143 1.00 5.66 B +ATOM 1348 CG2 VAL B 57 63.791 59.829 45.886 1.00 5.00 B +ATOM 1349 N LYS B 58 67.461 62.121 44.563 1.00 3.78 B +ATOM 1350 CA LYS B 58 68.814 62.701 44.626 1.00 4.51 B +ATOM 1351 C LYS B 58 68.786 64.200 44.385 1.00 4.64 B +ATOM 1352 O LYS B 58 69.453 64.970 45.078 1.00 4.91 B +ATOM 1353 CB LYS B 58 69.685 62.023 43.566 1.00 5.87 B +ATOM 1354 CG LYS B 58 71.037 62.715 43.368 1.00 6.61 B +ATOM 1355 CD LYS B 58 71.911 61.914 42.422 1.00 8.95 B +ATOM 1356 CE LYS B 58 73.036 62.736 41.827 1.00 9.79 B +ATOM 1357 NZ LYS B 58 73.903 61.926 40.944 1.00 10.97 B +ATOM 1358 N ALA B 59 68.027 64.648 43.393 1.00 4.57 B +ATOM 1359 CA ALA B 59 67.955 66.089 43.097 1.00 4.83 B +ATOM 1360 C ALA B 59 67.483 66.884 44.313 1.00 4.63 B +ATOM 1361 O ALA B 59 67.996 67.993 44.584 1.00 4.41 B +ATOM 1362 CB ALA B 59 67.000 66.337 41.941 1.00 5.64 B +ATOM 1363 N ILE B 60 66.485 66.365 45.015 1.00 4.27 B +ATOM 1364 CA ILE B 60 65.916 67.056 46.183 1.00 4.66 B +ATOM 1365 C ILE B 60 66.898 67.056 47.337 1.00 3.81 B +ATOM 1366 O ILE B 60 67.079 68.071 48.023 1.00 4.20 B +ATOM 1367 CB ILE B 60 64.546 66.403 46.509 1.00 4.36 B +ATOM 1368 CG1 ILE B 60 63.588 66.623 45.317 1.00 4.56 B +ATOM 1369 CG2 ILE B 60 63.966 66.941 47.835 1.00 4.23 B +ATOM 1370 CD1 ILE B 60 62.373 65.655 45.375 1.00 5.34 B +ATOM 1371 N VAL B 61 67.504 65.896 47.603 1.00 3.65 B +ATOM 1372 CA VAL B 61 68.511 65.787 48.677 1.00 4.56 B +ATOM 1373 C VAL B 61 69.698 66.702 48.400 1.00 4.22 B +ATOM 1374 O VAL B 61 70.160 67.411 49.299 1.00 4.43 B +ATOM 1375 CB VAL B 61 68.907 64.309 48.830 1.00 4.74 B +ATOM 1376 CG1 VAL B 61 70.122 64.101 49.722 1.00 5.69 B +ATOM 1377 CG2 VAL B 61 67.725 63.493 49.318 1.00 5.47 B +ATOM 1378 N GLU B 62 70.151 66.723 47.153 1.00 4.43 B +ATOM 1379 CA GLU B 62 71.288 67.592 46.812 1.00 4.95 B +ATOM 1380 C GLU B 62 70.885 69.052 46.887 1.00 5.30 B +ATOM 1381 O GLU B 62 71.723 69.907 47.256 1.00 5.38 B +ATOM 1382 CB GLU B 62 71.893 67.274 45.453 1.00 5.58 B +ATOM 1383 CG GLU B 62 72.586 65.906 45.458 1.00 7.08 B +ATOM 1384 CD GLU B 62 73.352 65.533 44.237 1.00 8.46 B +ATOM 1385 OE1 GLU B 62 74.252 64.697 44.288 1.00 10.06 B +ATOM 1386 OE2 GLU B 62 73.067 66.109 43.157 1.00 10.50 B +ATOM 1387 N ALA B 63 69.650 69.401 46.584 1.00 5.02 B +ATOM 1388 CA ALA B 63 69.190 70.802 46.655 1.00 4.80 B +ATOM 1389 C ALA B 63 69.229 71.281 48.101 1.00 4.67 B +ATOM 1390 O ALA B 63 69.284 72.498 48.351 1.00 5.23 B +ATOM 1391 CB ALA B 63 67.832 70.900 46.025 1.00 4.87 B +ATOM 1392 N ALA B 64 69.195 70.374 49.063 1.00 4.95 B +ATOM 1393 CA ALA B 64 69.277 70.725 50.469 1.00 5.12 B +ATOM 1394 C ALA B 64 70.720 70.686 50.966 1.00 5.56 B +ATOM 1395 O ALA B 64 70.916 70.844 52.193 1.00 6.36 B +ATOM 1396 CB ALA B 64 68.378 69.816 51.305 1.00 6.01 B +ATOM 1397 N GLY B 65 71.682 70.458 50.111 1.00 5.32 B +ATOM 1398 CA GLY B 65 73.092 70.438 50.514 1.00 5.69 B +ATOM 1399 C GLY B 65 73.563 69.073 50.980 1.00 5.00 B +ATOM 1400 O GLY B 65 74.662 69.029 51.580 1.00 6.60 B +ATOM 1401 N LEU B 66 72.813 68.006 50.731 1.00 4.89 B +ATOM 1402 CA LEU B 66 73.201 66.660 51.180 1.00 5.10 B +ATOM 1403 C LEU B 66 73.579 65.820 49.989 1.00 5.52 B +ATOM 1404 O LEU B 66 73.428 66.215 48.832 1.00 6.12 B +ATOM 1405 CB LEU B 66 72.059 66.064 52.009 1.00 5.47 B +ATOM 1406 CG LEU B 66 71.886 66.729 53.366 1.00 7.05 B +ATOM 1407 CD1 LEU B 66 70.805 65.995 54.150 1.00 7.79 B +ATOM 1408 CD2 LEU B 66 73.209 66.813 54.124 1.00 8.50 B +ATOM 1409 N LYS B 67 74.007 64.601 50.268 1.00 5.84 B +ATOM 1410 CA LYS B 67 74.408 63.637 49.228 1.00 6.22 B +ATOM 1411 C LYS B 67 73.532 62.402 49.343 1.00 5.40 B +ATOM 1412 O LYS B 67 72.892 62.130 50.377 1.00 5.50 B +ATOM 1413 CB LYS B 67 75.855 63.194 49.489 1.00 8.08 B +ATOM 1414 CG LYS B 67 76.860 64.348 49.479 1.00 10.38 B +ATOM 1415 CD LYS B 67 78.259 63.839 49.838 1.00 13.10 B +ATOM 1416 CE LYS B 67 79.272 64.978 49.778 1.00 14.74 B +ATOM 1417 NZ LYS B 67 80.648 64.415 49.892 1.00 16.76 B +ATOM 1418 N VAL B 68 73.571 61.611 48.260 1.00 5.45 B +ATOM 1419 CA VAL B 68 72.874 60.318 48.274 1.00 5.05 B +ATOM 1420 C VAL B 68 73.341 59.513 49.501 1.00 5.56 B +ATOM 1421 O VAL B 68 72.512 58.804 50.091 1.00 5.83 B +ATOM 1422 CB VAL B 68 73.124 59.566 46.958 1.00 5.97 B +ATOM 1423 CG1 VAL B 68 72.733 58.097 47.047 1.00 6.44 B +ATOM 1424 CG2 VAL B 68 72.484 60.292 45.781 1.00 7.15 B +ATOM 1425 N GLY B 69 74.607 59.620 49.861 1.00 5.71 B +ATOM 1426 CA GLY B 69 75.148 58.890 51.014 1.00 6.22 B +ATOM 1427 C GLY B 69 74.533 59.314 52.347 1.00 5.67 B +ATOM 1428 O GLY B 69 74.754 58.601 53.347 1.00 6.75 B +ATOM 1429 N ASP B 70 73.824 60.435 52.380 1.00 4.83 B +ATOM 1430 CA ASP B 70 73.148 60.912 53.599 1.00 5.11 B +ATOM 1431 C ASP B 70 71.723 60.358 53.725 1.00 4.14 B +ATOM 1432 O ASP B 70 71.075 60.662 54.733 1.00 4.50 B +ATOM 1433 CB ASP B 70 73.177 62.438 53.647 1.00 5.29 B +ATOM 1434 CG ASP B 70 74.595 63.006 53.641 1.00 6.10 B +ATOM 1435 OD1 ASP B 70 74.820 63.965 52.875 1.00 6.91 B +ATOM 1436 OD2 ASP B 70 75.421 62.444 54.367 1.00 6.71 B +ATOM 1437 N ILE B 71 71.273 59.653 52.727 1.00 4.31 B +ATOM 1438 CA ILE B 71 69.910 59.080 52.803 1.00 4.32 B +ATOM 1439 C ILE B 71 69.964 57.903 53.793 1.00 3.98 B +ATOM 1440 O ILE B 71 70.796 57.004 53.583 1.00 5.01 B +ATOM 1441 CB ILE B 71 69.417 58.633 51.394 1.00 4.70 B +ATOM 1442 CG1 ILE B 71 69.260 59.861 50.449 1.00 4.36 B +ATOM 1443 CG2 ILE B 71 68.095 57.847 51.552 1.00 4.30 B +ATOM 1444 CD1 ILE B 71 69.090 59.494 48.952 1.00 4.71 B +ATOM 1445 N VAL B 72 69.082 57.918 54.776 1.00 3.47 B +ATOM 1446 CA VAL B 72 69.101 56.889 55.822 1.00 3.99 B +ATOM 1447 C VAL B 72 67.872 56.023 55.826 1.00 3.90 B +ATOM 1448 O VAL B 72 67.929 54.930 56.434 1.00 4.27 B +ATOM 1449 CB VAL B 72 69.355 57.550 57.201 1.00 4.41 B +ATOM 1450 CG1 VAL B 72 70.752 58.134 57.263 1.00 5.07 B +ATOM 1451 CG2 VAL B 72 68.283 58.575 57.520 1.00 5.77 B +ATOM 1452 N LYS B 73 66.779 56.414 55.155 1.00 3.52 B +ATOM 1453 CA LYS B 73 65.579 55.571 55.125 1.00 4.16 B +ATOM 1454 C LYS B 73 64.797 55.868 53.841 1.00 4.31 B +ATOM 1455 O LYS B 73 64.631 57.077 53.541 1.00 4.84 B +ATOM 1456 CB LYS B 73 64.647 55.893 56.294 1.00 5.02 B +ATOM 1457 CG LYS B 73 63.285 55.194 56.361 1.00 5.28 B +ATOM 1458 CD LYS B 73 63.319 53.682 56.411 1.00 5.37 B +ATOM 1459 CE LYS B 73 61.976 53.030 56.630 1.00 6.08 B +ATOM 1460 NZ LYS B 73 60.916 53.409 55.657 1.00 6.35 B +ATOM 1461 N THR B 74 64.350 54.825 53.193 1.00 3.73 B +ATOM 1462 CA THR B 74 63.456 55.013 52.052 1.00 3.85 B +ATOM 1463 C THR B 74 62.249 54.103 52.262 1.00 3.84 B +ATOM 1464 O THR B 74 62.260 53.119 53.017 1.00 3.85 B +ATOM 1465 CB THR B 74 64.155 54.626 50.705 1.00 4.06 B +ATOM 1466 OG1 THR B 74 64.451 53.208 50.782 1.00 4.62 B +ATOM 1467 CG2 THR B 74 65.381 55.461 50.387 1.00 4.69 B +ATOM 1468 N THR B 75 61.192 54.460 51.537 1.00 3.73 B +ATOM 1469 CA THR B 75 60.053 53.559 51.389 1.00 4.09 B +ATOM 1470 C THR B 75 59.881 53.439 49.849 1.00 4.02 B +ATOM 1471 O THR B 75 59.787 54.483 49.180 1.00 4.60 B +ATOM 1472 CB THR B 75 58.716 53.947 52.052 1.00 5.33 B +ATOM 1473 OG1 THR B 75 59.053 53.995 53.481 1.00 6.90 B +ATOM 1474 CG2 THR B 75 57.597 52.938 51.782 1.00 6.26 B +ATOM 1475 N VAL B 76 59.859 52.221 49.388 1.00 3.79 B +ATOM 1476 CA VAL B 76 59.705 51.923 47.970 1.00 4.37 B +ATOM 1477 C VAL B 76 58.362 51.232 47.772 1.00 4.23 B +ATOM 1478 O VAL B 76 58.120 50.109 48.259 1.00 5.09 B +ATOM 1479 CB VAL B 76 60.873 51.017 47.518 1.00 5.09 B +ATOM 1480 CG1 VAL B 76 60.718 50.674 46.034 1.00 6.10 B +ATOM 1481 CG2 VAL B 76 62.256 51.642 47.745 1.00 5.44 B +ATOM 1482 N PHE B 77 57.500 51.943 47.079 1.00 3.73 B +ATOM 1483 CA PHE B 77 56.152 51.434 46.755 1.00 4.03 B +ATOM 1484 C PHE B 77 56.221 50.948 45.307 1.00 3.31 B +ATOM 1485 O PHE B 77 56.607 51.785 44.458 1.00 5.04 B +ATOM 1486 CB PHE B 77 55.114 52.535 46.861 1.00 3.99 B +ATOM 1487 CG PHE B 77 55.025 53.226 48.187 1.00 3.46 B +ATOM 1488 CD1 PHE B 77 55.589 54.494 48.378 1.00 4.75 B +ATOM 1489 CD2 PHE B 77 54.338 52.632 49.243 1.00 4.57 B +ATOM 1490 CE1 PHE B 77 55.436 55.186 49.580 1.00 5.64 B +ATOM 1491 CE2 PHE B 77 54.208 53.314 50.457 1.00 5.55 B +ATOM 1492 CZ PHE B 77 54.721 54.585 50.626 1.00 5.75 B +ATOM 1493 N VAL B 78 55.872 49.713 45.018 1.00 3.70 B +ATOM 1494 CA VAL B 78 55.909 49.221 43.641 1.00 4.71 B +ATOM 1495 C VAL B 78 54.528 48.751 43.220 1.00 4.55 B +ATOM 1496 O VAL B 78 53.710 48.352 44.038 1.00 4.79 B +ATOM 1497 CB VAL B 78 56.948 48.100 43.447 1.00 5.00 B +ATOM 1498 CG1 VAL B 78 58.363 48.575 43.745 1.00 6.84 B +ATOM 1499 CG2 VAL B 78 56.648 46.861 44.287 1.00 5.75 B +ATOM 1500 N LYS B 79 54.334 48.753 41.906 1.00 5.21 B +ATOM 1501 CA LYS B 79 53.107 48.222 41.315 1.00 5.74 B +ATOM 1502 C LYS B 79 53.200 46.696 41.199 1.00 6.17 B +ATOM 1503 O LYS B 79 52.134 46.034 41.240 1.00 6.76 B +ATOM 1504 CB LYS B 79 52.842 48.840 39.956 1.00 6.81 B +ATOM 1505 CG LYS B 79 51.634 48.264 39.231 1.00 8.82 B +ATOM 1506 CD LYS B 79 50.323 48.396 39.989 1.00 10.71 B +ATOM 1507 CE LYS B 79 49.209 47.516 39.447 1.00 11.66 B +ATOM 1508 NZ LYS B 79 49.470 46.072 39.707 1.00 13.37 B +ATOM 1509 N ASP B 80 54.376 46.123 41.078 1.00 6.31 B +ATOM 1510 CA ASP B 80 54.487 44.661 40.898 1.00 6.74 B +ATOM 1511 C ASP B 80 55.764 44.088 41.474 1.00 6.52 B +ATOM 1512 O ASP B 80 56.841 44.340 40.896 1.00 7.52 B +ATOM 1513 CB ASP B 80 54.361 44.370 39.382 1.00 7.41 B +ATOM 1514 CG ASP B 80 54.297 42.895 39.052 1.00 8.15 B +ATOM 1515 OD1 ASP B 80 54.054 42.544 37.864 1.00 10.21 B +ATOM 1516 OD2 ASP B 80 54.466 42.034 39.923 1.00 8.03 B +ATOM 1517 N LEU B 81 55.668 43.364 42.574 1.00 6.91 B +ATOM 1518 CA LEU B 81 56.846 42.760 43.190 1.00 8.19 B +ATOM 1519 C LEU B 81 57.501 41.754 42.250 1.00 8.43 B +ATOM 1520 O LEU B 81 58.657 41.386 42.540 1.00 9.36 B +ATOM 1521 CB LEU B 81 56.573 42.188 44.569 1.00 8.43 B +ATOM 1522 CG LEU B 81 56.623 43.238 45.680 1.00 8.40 B +ATOM 1523 CD1 LEU B 81 56.024 42.606 46.935 1.00 9.27 B +ATOM 1524 CD2 LEU B 81 58.050 43.682 45.909 1.00 9.04 B +ATOM 1525 N ASN B 82 56.839 41.326 41.191 1.00 8.67 B +ATOM 1526 CA ASN B 82 57.540 40.394 40.271 1.00 9.87 B +ATOM 1527 C ASN B 82 58.691 41.113 39.557 1.00 10.44 B +ATOM 1528 O ASN B 82 59.592 40.434 39.033 1.00 11.63 B +ATOM 1529 CB ASN B 82 56.608 39.715 39.283 1.00 10.51 B +ATOM 1530 CG ASN B 82 55.772 38.642 39.992 1.00 10.87 B +ATOM 1531 OD1 ASN B 82 56.248 38.003 40.917 1.00 11.41 B +ATOM 1532 ND2 ASN B 82 54.538 38.505 39.530 1.00 11.83 B +ATOM 1533 N ASP B 83 58.688 42.430 39.542 1.00 10.73 B +ATOM 1534 CA ASP B 83 59.787 43.195 38.901 1.00 11.58 B +ATOM 1535 C ASP B 83 60.809 43.606 39.956 1.00 11.57 B +ATOM 1536 O ASP B 83 61.760 44.366 39.650 1.00 11.86 B +ATOM 1537 CB ASP B 83 59.225 44.409 38.174 1.00 12.86 B +ATOM 1538 CG ASP B 83 58.600 44.116 36.833 1.00 13.31 B +ATOM 1539 OD1 ASP B 83 57.683 44.833 36.447 1.00 14.31 B +ATOM 1540 OD2 ASP B 83 59.090 43.183 36.124 1.00 15.40 B +ATOM 1541 N PHE B 84 60.688 43.112 41.173 1.00 11.64 B +ATOM 1542 CA PHE B 84 61.630 43.566 42.211 1.00 12.27 B +ATOM 1543 C PHE B 84 63.088 43.200 42.034 1.00 11.14 B +ATOM 1544 O PHE B 84 63.933 43.995 42.522 1.00 10.67 B +ATOM 1545 CB PHE B 84 61.082 43.296 43.608 1.00 13.85 B +ATOM 1546 CG PHE B 84 61.435 44.457 44.516 1.00 15.36 B +ATOM 1547 CD1 PHE B 84 62.419 44.313 45.490 1.00 16.41 B +ATOM 1548 CD2 PHE B 84 60.771 45.675 44.347 1.00 15.95 B +ATOM 1549 CE1 PHE B 84 62.724 45.396 46.316 1.00 17.08 B +ATOM 1550 CE2 PHE B 84 61.074 46.757 45.182 1.00 16.89 B +ATOM 1551 CZ PHE B 84 62.051 46.612 46.170 1.00 16.95 B +ATOM 1552 N ALA B 85 63.448 42.102 41.392 1.00 10.77 B +ATOM 1553 CA ALA B 85 64.879 41.794 41.220 1.00 10.60 B +ATOM 1554 C ALA B 85 65.535 42.914 40.407 1.00 9.89 B +ATOM 1555 O ALA B 85 66.653 43.346 40.689 1.00 9.55 B +ATOM 1556 CB ALA B 85 65.072 40.425 40.575 1.00 11.44 B +ATOM 1557 N THR B 86 64.784 43.359 39.403 1.00 10.27 B +ATOM 1558 CA THR B 86 65.263 44.420 38.507 1.00 10.82 B +ATOM 1559 C THR B 86 65.418 45.740 39.247 1.00 9.25 B +ATOM 1560 O THR B 86 66.418 46.473 39.123 1.00 8.54 B +ATOM 1561 CB THR B 86 64.317 44.584 37.245 1.00 12.16 B +ATOM 1562 OG1 THR B 86 64.271 43.272 36.607 1.00 13.99 B +ATOM 1563 CG2 THR B 86 64.815 45.690 36.315 1.00 12.79 B +ATOM 1564 N VAL B 87 64.392 46.057 40.011 1.00 8.71 B +ATOM 1565 CA VAL B 87 64.395 47.289 40.822 1.00 8.40 B +ATOM 1566 C VAL B 87 65.555 47.232 41.809 1.00 7.98 B +ATOM 1567 O VAL B 87 66.265 48.236 41.965 1.00 8.35 B +ATOM 1568 CB VAL B 87 63.043 47.470 41.540 1.00 8.84 B +ATOM 1569 CG1 VAL B 87 63.167 48.539 42.621 1.00 9.19 B +ATOM 1570 CG2 VAL B 87 61.950 47.778 40.533 1.00 9.80 B +ATOM 1571 N ASN B 88 65.711 46.109 42.472 1.00 7.83 B +ATOM 1572 CA ASN B 88 66.775 45.933 43.463 1.00 9.07 B +ATOM 1573 C ASN B 88 68.144 46.146 42.851 1.00 8.46 B +ATOM 1574 O ASN B 88 69.026 46.768 43.450 1.00 7.86 B +ATOM 1575 CB ASN B 88 66.740 44.572 44.145 1.00 10.40 B +ATOM 1576 CG ASN B 88 66.169 44.610 45.540 1.00 11.76 B +ATOM 1577 OD1 ASN B 88 66.239 45.662 46.210 1.00 12.61 B +ATOM 1578 ND2 ASN B 88 65.615 43.454 45.921 1.00 13.35 B +ATOM 1579 N ALA B 89 68.340 45.587 41.664 1.00 7.67 B +ATOM 1580 CA ALA B 89 69.637 45.742 40.975 1.00 7.58 B +ATOM 1581 C ALA B 89 69.934 47.212 40.678 1.00 6.88 B +ATOM 1582 O ALA B 89 71.066 47.682 40.867 1.00 7.11 B +ATOM 1583 CB ALA B 89 69.635 44.884 39.713 1.00 8.02 B +ATOM 1584 N THR B 90 68.916 47.898 40.173 1.00 7.04 B +ATOM 1585 CA THR B 90 69.089 49.326 39.858 1.00 7.07 B +ATOM 1586 C THR B 90 69.328 50.133 41.132 1.00 6.37 B +ATOM 1587 O THR B 90 70.183 51.031 41.163 1.00 6.22 B +ATOM 1588 CB THR B 90 67.823 49.853 39.083 1.00 7.91 B +ATOM 1589 OG1 THR B 90 67.848 49.254 37.752 1.00 10.49 B +ATOM 1590 CG2 THR B 90 67.792 51.378 39.020 1.00 9.07 B +ATOM 1591 N TYR B 91 68.549 49.837 42.164 1.00 6.16 B +ATOM 1592 CA TYR B 91 68.653 50.539 43.451 1.00 5.79 B +ATOM 1593 C TYR B 91 70.048 50.341 44.026 1.00 5.81 B +ATOM 1594 O TYR B 91 70.724 51.278 44.488 1.00 6.66 B +ATOM 1595 CB TYR B 91 67.546 50.008 44.344 1.00 5.88 B +ATOM 1596 CG TYR B 91 67.369 50.645 45.698 1.00 5.59 B +ATOM 1597 CD1 TYR B 91 66.295 51.497 45.958 1.00 5.96 B +ATOM 1598 CD2 TYR B 91 68.267 50.394 46.730 1.00 6.04 B +ATOM 1599 CE1 TYR B 91 66.067 52.070 47.210 1.00 5.47 B +ATOM 1600 CE2 TYR B 91 68.093 50.940 47.994 1.00 6.05 B +ATOM 1601 CZ TYR B 91 66.985 51.768 48.210 1.00 5.90 B +ATOM 1602 OH TYR B 91 66.804 52.315 49.467 1.00 5.93 B +ATOM 1603 N GLU B 92 70.502 49.095 44.002 1.00 6.05 B +ATOM 1604 CA GLU B 92 71.841 48.771 44.514 1.00 6.75 B +ATOM 1605 C GLU B 92 72.917 49.548 43.765 1.00 6.71 B +ATOM 1606 O GLU B 92 73.846 50.151 44.350 1.00 7.08 B +ATOM 1607 CB GLU B 92 72.138 47.269 44.437 1.00 8.59 B +ATOM 1608 CG GLU B 92 73.518 46.875 44.989 1.00 11.80 B +ATOM 1609 CD GLU B 92 73.634 45.500 45.544 1.00 15.28 B +ATOM 1610 OE1 GLU B 92 74.486 45.106 46.349 1.00 18.01 B +ATOM 1611 OE2 GLU B 92 72.757 44.704 45.182 1.00 17.25 B +ATOM 1612 N ALA B 93 72.824 49.534 42.434 1.00 6.56 B +ATOM 1613 CA ALA B 93 73.786 50.239 41.573 1.00 7.09 B +ATOM 1614 C ALA B 93 73.817 51.726 41.900 1.00 6.90 B +ATOM 1615 O ALA B 93 74.895 52.313 42.030 1.00 7.00 B +ATOM 1616 CB ALA B 93 73.460 50.036 40.092 1.00 7.57 B +ATOM 1617 N PHE B 94 72.618 52.302 42.042 1.00 6.67 B +ATOM 1618 CA PHE B 94 72.516 53.752 42.332 1.00 6.61 B +ATOM 1619 C PHE B 94 73.288 54.131 43.597 1.00 5.97 B +ATOM 1620 O PHE B 94 74.054 55.105 43.607 1.00 6.59 B +ATOM 1621 CB PHE B 94 71.034 54.101 42.401 1.00 7.02 B +ATOM 1622 CG PHE B 94 70.771 55.555 42.599 1.00 7.23 B +ATOM 1623 CD1 PHE B 94 70.713 56.358 41.464 1.00 8.12 B +ATOM 1624 CD2 PHE B 94 70.605 56.098 43.862 1.00 8.71 B +ATOM 1625 CE1 PHE B 94 70.478 57.717 41.545 1.00 9.74 B +ATOM 1626 CE2 PHE B 94 70.367 57.485 43.979 1.00 9.96 B +ATOM 1627 CZ PHE B 94 70.332 58.243 42.813 1.00 9.82 B +ATOM 1628 N PHE B 95 73.086 53.389 44.675 1.00 5.98 B +ATOM 1629 CA PHE B 95 73.781 53.651 45.951 1.00 6.00 B +ATOM 1630 C PHE B 95 75.281 53.417 45.784 1.00 6.18 B +ATOM 1631 O PHE B 95 76.101 54.226 46.266 1.00 6.81 B +ATOM 1632 CB PHE B 95 73.124 52.962 47.140 1.00 6.51 B +ATOM 1633 CG PHE B 95 71.874 53.714 47.524 1.00 6.57 B +ATOM 1634 CD1 PHE B 95 70.622 53.373 47.028 1.00 7.43 B +ATOM 1635 CD2 PHE B 95 71.976 54.850 48.341 1.00 6.79 B +ATOM 1636 CE1 PHE B 95 69.479 54.111 47.329 1.00 7.20 B +ATOM 1637 CE2 PHE B 95 70.841 55.584 48.669 1.00 7.08 B +ATOM 1638 CZ PHE B 95 69.594 55.238 48.145 1.00 7.03 B +ATOM 1639 N THR B 96 75.622 52.319 45.112 1.00 6.49 B +ATOM 1640 CA THR B 96 77.053 52.019 44.897 1.00 8.11 B +ATOM 1641 C THR B 96 77.732 53.131 44.112 1.00 7.33 B +ATOM 1642 O THR B 96 78.891 53.504 44.429 1.00 7.70 B +ATOM 1643 CB THR B 96 77.231 50.627 44.186 1.00 9.27 B +ATOM 1644 OG1 THR B 96 76.633 49.670 45.085 1.00 11.25 B +ATOM 1645 CG2 THR B 96 78.696 50.311 43.881 1.00 9.94 B +ATOM 1646 N GLU B 97 77.060 53.665 43.106 1.00 7.31 B +ATOM 1647 CA GLU B 97 77.615 54.743 42.266 1.00 8.29 B +ATOM 1648 C GLU B 97 77.942 55.957 43.102 1.00 7.86 B +ATOM 1649 O GLU B 97 78.850 56.745 42.748 1.00 9.08 B +ATOM 1650 CB GLU B 97 76.606 55.168 41.175 1.00 8.63 B +ATOM 1651 CG GLU B 97 76.405 54.068 40.094 1.00 9.19 B +ATOM 1652 CD GLU B 97 75.045 54.140 39.441 1.00 9.70 B +ATOM 1653 OE1 GLU B 97 74.338 55.128 39.587 1.00 10.55 B +ATOM 1654 OE2 GLU B 97 74.714 53.131 38.781 1.00 11.38 B +ATOM 1655 N HIS B 98 77.252 56.159 44.220 1.00 7.67 B +ATOM 1656 CA HIS B 98 77.458 57.305 45.097 1.00 7.40 B +ATOM 1657 C HIS B 98 78.282 56.958 46.321 1.00 7.94 B +ATOM 1658 O HIS B 98 78.280 57.751 47.288 1.00 8.19 B +ATOM 1659 CB HIS B 98 76.069 57.908 45.506 1.00 7.48 B +ATOM 1660 CG HIS B 98 75.377 58.471 44.303 1.00 7.83 B +ATOM 1661 ND1 HIS B 98 74.517 57.790 43.472 1.00 7.93 B +ATOM 1662 CD2 HIS B 98 75.452 59.750 43.815 1.00 8.60 B +ATOM 1663 CE1 HIS B 98 74.117 58.614 42.522 1.00 8.30 B +ATOM 1664 NE2 HIS B 98 74.649 59.801 42.697 1.00 9.30 B +ATOM 1665 N ASN B 99 78.931 55.806 46.291 1.00 8.01 B +ATOM 1666 CA ASN B 99 79.752 55.341 47.423 1.00 8.93 B +ATOM 1667 C ASN B 99 78.974 55.499 48.728 1.00 7.82 B +ATOM 1668 O ASN B 99 79.517 55.928 49.777 1.00 8.81 B +ATOM 1669 CB ASN B 99 81.061 56.144 47.463 1.00 10.58 B +ATOM 1670 CG ASN B 99 82.056 55.546 48.447 1.00 11.86 B +ATOM 1671 OD1 ASN B 99 82.042 54.320 48.653 1.00 13.08 B +ATOM 1672 ND2 ASN B 99 82.877 56.417 49.031 1.00 13.49 B +ATOM 1673 N ALA B 100 77.711 55.106 48.690 1.00 7.10 B +ATOM 1674 CA ALA B 100 76.792 55.270 49.808 1.00 7.43 B +ATOM 1675 C ALA B 100 76.441 54.005 50.563 1.00 8.24 B +ATOM 1676 O ALA B 100 76.191 52.988 49.904 1.00 9.53 B +ATOM 1677 CB ALA B 100 75.483 55.884 49.262 1.00 7.38 B +ATOM 1678 N THR B 101 76.411 54.110 51.880 1.00 7.83 B +ATOM 1679 CA THR B 101 75.927 52.985 52.694 1.00 8.26 B +ATOM 1680 C THR B 101 74.436 52.883 52.331 1.00 7.07 B +ATOM 1681 O THR B 101 73.774 53.936 52.184 1.00 7.16 B +ATOM 1682 CB THR B 101 76.107 53.292 54.229 1.00 9.39 B +ATOM 1683 OG1 THR B 101 77.548 53.397 54.419 1.00 10.96 B +ATOM 1684 CG2 THR B 101 75.476 52.244 55.144 1.00 10.68 B +ATOM 1685 N PHE B 102 73.911 51.687 52.245 1.00 6.83 B +ATOM 1686 CA PHE B 102 72.488 51.556 51.894 1.00 6.82 B +ATOM 1687 C PHE B 102 71.584 52.049 53.025 1.00 6.10 B +ATOM 1688 O PHE B 102 71.847 51.781 54.203 1.00 6.28 B +ATOM 1689 CB PHE B 102 72.146 50.095 51.600 1.00 7.29 B +ATOM 1690 CG PHE B 102 72.979 49.431 50.546 1.00 7.87 B +ATOM 1691 CD1 PHE B 102 73.681 48.256 50.799 1.00 8.98 B +ATOM 1692 CD2 PHE B 102 73.053 49.997 49.264 1.00 7.94 B +ATOM 1693 CE1 PHE B 102 74.451 47.641 49.822 1.00 10.13 B +ATOM 1694 CE2 PHE B 102 73.816 49.401 48.256 1.00 8.74 B +ATOM 1695 CZ PHE B 102 74.523 48.219 48.548 1.00 9.67 B +ATOM 1696 N PRO B 103 70.515 52.750 52.655 1.00 6.23 B +ATOM 1697 CA PRO B 103 69.588 53.188 53.723 1.00 6.02 B +ATOM 1698 C PRO B 103 68.798 52.008 54.299 1.00 4.53 B +ATOM 1699 O PRO B 103 68.719 50.898 53.729 1.00 4.36 B +ATOM 1700 CB PRO B 103 68.557 54.011 52.895 1.00 7.30 B +ATOM 1701 CG PRO B 103 69.236 54.398 51.613 1.00 7.26 B +ATOM 1702 CD PRO B 103 70.155 53.207 51.314 1.00 6.81 B +ATOM 1703 N ALA B 104 68.152 52.268 55.432 1.00 4.08 B +ATOM 1704 CA ALA B 104 67.093 51.379 55.928 1.00 3.99 B +ATOM 1705 C ALA B 104 65.961 51.514 54.866 1.00 3.68 B +ATOM 1706 O ALA B 104 65.862 52.531 54.135 1.00 4.10 B +ATOM 1707 CB ALA B 104 66.624 51.799 57.278 1.00 4.60 B +ATOM 1708 N ARG B 105 65.116 50.488 54.754 1.00 4.14 B +ATOM 1709 CA ARG B 105 64.091 50.483 53.701 1.00 4.07 B +ATOM 1710 C ARG B 105 62.865 49.676 54.037 1.00 3.75 B +ATOM 1711 O ARG B 105 62.974 48.671 54.784 1.00 3.67 B +ATOM 1712 CB ARG B 105 64.776 49.844 52.439 1.00 5.04 B +ATOM 1713 CG ARG B 105 63.932 49.901 51.168 1.00 6.68 B +ATOM 1714 CD ARG B 105 64.669 49.471 49.920 1.00 7.36 B +ATOM 1715 NE ARG B 105 64.950 48.059 49.942 1.00 9.16 B +ATOM 1716 CZ ARG B 105 65.406 47.372 48.872 1.00 9.60 B +ATOM 1717 NH1 ARG B 105 65.570 46.061 48.897 1.00 10.15 B +ATOM 1718 NH2 ARG B 105 65.757 48.029 47.767 1.00 9.57 B +ATOM 1719 N SER B 106 61.735 50.143 53.519 1.00 3.97 B +ATOM 1720 CA SER B 106 60.496 49.356 53.565 1.00 4.51 B +ATOM 1721 C SER B 106 60.072 49.212 52.082 1.00 4.12 B +ATOM 1722 O SER B 106 60.266 50.144 51.289 1.00 4.73 B +ATOM 1723 CB SER B 106 59.374 49.959 54.353 1.00 5.49 B +ATOM 1724 OG SER B 106 59.796 49.957 55.710 1.00 6.48 B +HETATM 1725 N CSP B 107 59.505 48.054 51.758 1.00 4.52 B +HETATM 1726 CA CSP B 107 59.129 47.760 50.378 1.00 5.72 B +HETATM 1727 CB CSP B 107 60.089 46.804 49.700 0.67 8.42 B +HETATM 1729 SG CSP B 107 61.809 47.227 49.776 0.67 12.80 B +HETATM 1730 P CSP B 107 62.354 45.759 51.167 0.67 14.01 B +HETATM 1731 O1P CSP B 107 61.495 45.839 52.330 0.67 15.06 B +HETATM 1732 O2P CSP B 107 62.084 44.369 50.515 0.67 15.90 B +HETATM 1733 O3P CSP B 107 63.867 45.931 51.332 0.67 14.77 B +HETATM 1734 C CSP B 107 57.779 47.046 50.355 1.00 4.97 B +HETATM 1735 O CSP B 107 57.644 45.986 51.024 1.00 4.62 B +ATOM 1737 N VAL B 108 56.859 47.551 49.572 1.00 4.59 B +ATOM 1738 CA VAL B 108 55.529 46.918 49.485 1.00 4.55 B +ATOM 1739 C VAL B 108 55.005 47.075 48.074 1.00 4.55 B +ATOM 1740 O VAL B 108 55.353 48.046 47.373 1.00 4.69 B +ATOM 1741 CB VAL B 108 54.549 47.594 50.491 1.00 4.96 B +ATOM 1742 CG1 VAL B 108 54.998 47.484 51.949 1.00 5.33 B +ATOM 1743 CG2 VAL B 108 54.200 49.027 50.132 1.00 6.15 B +ATOM 1744 N GLU B 109 54.097 46.183 47.680 1.00 4.88 B +ATOM 1745 CA GLU B 109 53.393 46.293 46.413 1.00 4.49 B +ATOM 1746 C GLU B 109 52.038 46.954 46.709 1.00 4.13 B +ATOM 1747 O GLU B 109 51.280 46.405 47.528 1.00 5.16 B +ATOM 1748 CB GLU B 109 53.124 44.938 45.767 1.00 5.33 B +ATOM 1749 CG GLU B 109 52.523 45.089 44.371 1.00 5.37 B +ATOM 1750 CD GLU B 109 52.168 43.746 43.764 1.00 6.00 B +ATOM 1751 OE1 GLU B 109 51.012 43.552 43.382 1.00 7.16 B +ATOM 1752 OE2 GLU B 109 53.105 42.917 43.683 1.00 5.73 B +ATOM 1753 N VAL B 110 51.785 48.087 46.081 1.00 4.12 B +ATOM 1754 CA VAL B 110 50.496 48.778 46.266 1.00 5.16 B +ATOM 1755 C VAL B 110 49.561 48.429 45.106 1.00 4.97 B +ATOM 1756 O VAL B 110 49.994 47.748 44.159 1.00 5.83 B +ATOM 1757 CB VAL B 110 50.727 50.295 46.324 1.00 5.61 B +ATOM 1758 CG1 VAL B 110 51.594 50.678 47.521 1.00 6.03 B +ATOM 1759 CG2 VAL B 110 51.320 50.844 45.036 1.00 5.94 B +ATOM 1760 N ALA B 111 48.309 48.840 45.198 1.00 5.19 B +ATOM 1761 CA ALA B 111 47.352 48.558 44.126 1.00 5.46 B +ATOM 1762 C ALA B 111 47.562 49.429 42.900 1.00 5.34 B +ATOM 1763 O ALA B 111 47.334 48.964 41.750 1.00 6.46 B +ATOM 1764 CB ALA B 111 45.917 48.746 44.653 1.00 5.06 B +ATOM 1765 N ARG B 112 47.959 50.685 43.091 1.00 5.42 B +ATOM 1766 CA ARG B 112 48.127 51.619 41.972 1.00 5.97 B +ATOM 1767 C ARG B 112 48.900 52.817 42.478 1.00 5.15 B +ATOM 1768 O ARG B 112 48.874 53.130 43.687 1.00 5.33 B +ATOM 1769 CB ARG B 112 46.742 52.068 41.486 1.00 5.86 B +ATOM 1770 CG ARG B 112 46.714 52.715 40.113 1.00 7.01 B +ATOM 1771 CD ARG B 112 45.315 53.123 39.755 1.00 7.87 B +ATOM 1772 NE ARG B 112 45.315 53.754 38.438 1.00 9.03 B +ATOM 1773 CZ ARG B 112 44.312 54.495 37.936 1.00 9.58 B +ATOM 1774 NH1 ARG B 112 44.464 55.015 36.706 1.00 10.53 B +ATOM 1775 NH2 ARG B 112 43.181 54.677 38.619 1.00 10.02 B +ATOM 1776 N LEU B 113 49.596 53.475 41.571 1.00 5.16 B +ATOM 1777 CA LEU B 113 50.392 54.662 41.860 1.00 5.23 B +ATOM 1778 C LEU B 113 49.961 55.800 40.958 1.00 5.70 B +ATOM 1779 O LEU B 113 49.350 55.580 39.890 1.00 6.10 B +ATOM 1780 CB LEU B 113 51.873 54.335 41.632 1.00 5.50 B +ATOM 1781 CG LEU B 113 52.474 53.370 42.649 1.00 5.34 B +ATOM 1782 CD1 LEU B 113 53.859 52.921 42.176 1.00 5.70 B +ATOM 1783 CD2 LEU B 113 52.557 54.010 44.032 1.00 4.99 B +ATOM 1784 N PRO B 114 50.268 57.024 41.361 1.00 6.67 B +ATOM 1785 CA PRO B 114 49.934 58.195 40.539 1.00 7.38 B +ATOM 1786 C PRO B 114 50.475 57.984 39.124 1.00 7.04 B +ATOM 1787 O PRO B 114 51.586 57.489 38.861 1.00 7.08 B +ATOM 1788 CB PRO B 114 50.649 59.357 41.239 1.00 7.55 B +ATOM 1789 CG PRO B 114 50.756 58.922 42.679 1.00 7.89 B +ATOM 1790 CD PRO B 114 50.956 57.405 42.617 1.00 7.17 B +ATOM 1791 N LYS B 115 49.650 58.370 38.152 1.00 7.96 B +ATOM 1792 CA LYS B 115 49.953 58.299 36.717 1.00 9.22 B +ATOM 1793 C LYS B 115 50.209 56.876 36.276 1.00 9.21 B +ATOM 1794 O LYS B 115 50.835 56.725 35.203 1.00 9.21 B +ATOM 1795 CB LYS B 115 51.173 59.162 36.379 1.00 10.55 B +ATOM 1796 CG LYS B 115 50.934 60.632 36.740 1.00 12.98 B +ATOM 1797 CD LYS B 115 52.106 61.449 36.179 1.00 15.15 B +ATOM 1798 CE LYS B 115 51.791 62.932 36.188 1.00 16.92 B +ATOM 1799 NZ LYS B 115 52.176 63.588 34.907 1.00 18.34 B +ATOM 1800 N ASP B 116 49.783 55.882 37.020 1.00 8.41 B +ATOM 1801 CA ASP B 116 50.010 54.481 36.653 1.00 8.14 B +ATOM 1802 C ASP B 116 51.491 54.137 36.537 1.00 7.11 B +ATOM 1803 O ASP B 116 51.846 53.192 35.783 1.00 8.04 B +ATOM 1804 CB ASP B 116 49.198 54.075 35.408 1.00 9.13 B +ATOM 1805 CG ASP B 116 47.712 53.984 35.783 1.00 10.16 B +ATOM 1806 OD1 ASP B 116 46.977 54.853 35.295 1.00 11.23 B +ATOM 1807 OD2 ASP B 116 47.365 53.069 36.542 1.00 10.06 B +ATOM 1808 N VAL B 117 52.340 54.811 37.303 1.00 6.39 B +ATOM 1809 CA VAL B 117 53.781 54.470 37.277 1.00 5.93 B +ATOM 1810 C VAL B 117 53.972 53.123 37.988 1.00 5.45 B +ATOM 1811 O VAL B 117 53.077 52.615 38.671 1.00 5.92 B +ATOM 1812 CB VAL B 117 54.629 55.611 37.850 1.00 5.41 B +ATOM 1813 CG1 VAL B 117 54.552 56.910 37.045 1.00 6.56 B +ATOM 1814 CG2 VAL B 117 54.353 55.801 39.339 1.00 4.77 B +ATOM 1815 N LYS B 118 55.159 52.599 37.861 1.00 5.60 B +ATOM 1816 CA LYS B 118 55.494 51.309 38.448 1.00 5.78 B +ATOM 1817 C LYS B 118 56.190 51.421 39.794 1.00 5.20 B +ATOM 1818 O LYS B 118 56.351 50.398 40.449 1.00 4.89 B +ATOM 1819 CB LYS B 118 56.401 50.545 37.481 1.00 6.48 B +ATOM 1820 CG LYS B 118 55.766 50.197 36.142 1.00 8.03 B +ATOM 1821 CD LYS B 118 56.681 49.587 35.093 1.00 10.35 B +ATOM 1822 CE LYS B 118 55.939 49.354 33.779 1.00 12.02 B +ATOM 1823 NZ LYS B 118 56.770 48.768 32.708 1.00 13.89 B +ATOM 1824 N ILE B 119 56.595 52.620 40.201 1.00 4.72 B +ATOM 1825 CA ILE B 119 57.347 52.805 41.442 1.00 4.45 B +ATOM 1826 C ILE B 119 57.236 54.233 41.948 1.00 4.59 B +ATOM 1827 O ILE B 119 57.090 55.158 41.151 1.00 4.61 B +ATOM 1828 CB ILE B 119 58.835 52.378 41.166 1.00 4.91 B +ATOM 1829 CG1 ILE B 119 59.638 52.307 42.496 1.00 4.94 B +ATOM 1830 CG2 ILE B 119 59.557 53.294 40.145 1.00 5.42 B +ATOM 1831 CD1 ILE B 119 60.967 51.552 42.276 1.00 5.66 B +ATOM 1832 N GLU B 120 57.294 54.361 43.266 1.00 4.02 B +ATOM 1833 CA GLU B 120 57.295 55.668 43.938 1.00 3.81 B +ATOM 1834 C GLU B 120 58.249 55.491 45.119 1.00 3.77 B +ATOM 1835 O GLU B 120 58.112 54.507 45.874 1.00 4.01 B +ATOM 1836 CB GLU B 120 55.919 56.069 44.417 1.00 4.09 B +ATOM 1837 CG GLU B 120 55.856 57.420 45.120 1.00 4.28 B +ATOM 1838 CD GLU B 120 54.500 57.808 45.637 1.00 4.49 B +ATOM 1839 OE1 GLU B 120 54.356 58.514 46.641 1.00 6.49 B +ATOM 1840 OE2 GLU B 120 53.518 57.364 44.960 1.00 5.06 B +ATOM 1841 N ILE B 121 59.173 56.418 45.302 1.00 3.35 B +ATOM 1842 CA ILE B 121 60.161 56.304 46.382 1.00 3.57 B +ATOM 1843 C ILE B 121 60.255 57.596 47.173 1.00 3.38 B +ATOM 1844 O ILE B 121 60.488 58.665 46.614 1.00 3.55 B +ATOM 1845 CB ILE B 121 61.584 56.009 45.799 1.00 4.18 B +ATOM 1846 CG1 ILE B 121 61.562 54.777 44.888 1.00 5.00 B +ATOM 1847 CG2 ILE B 121 62.619 55.858 46.938 1.00 5.16 B +ATOM 1848 CD1 ILE B 121 62.912 54.470 44.198 1.00 5.62 B +ATOM 1849 N GLU B 122 60.086 57.456 48.487 1.00 3.62 B +ATOM 1850 CA GLU B 122 60.249 58.594 49.396 1.00 3.82 B +ATOM 1851 C GLU B 122 61.524 58.342 50.201 1.00 3.47 B +ATOM 1852 O GLU B 122 61.924 57.176 50.402 1.00 3.81 B +ATOM 1853 CB GLU B 122 59.073 58.847 50.309 1.00 6.01 B +ATOM 1854 CG GLU B 122 58.774 57.680 51.237 1.00 7.17 B +ATOM 1855 CD GLU B 122 57.696 57.886 52.243 1.00 8.33 B +ATOM 1856 OE1 GLU B 122 57.674 57.155 53.244 1.00 10.86 B +ATOM 1857 OE2 GLU B 122 56.839 58.772 52.050 1.00 7.19 B +ATOM 1858 N ALA B 123 62.151 59.418 50.651 1.00 4.17 B +ATOM 1859 CA ALA B 123 63.409 59.272 51.377 1.00 4.16 B +ATOM 1860 C ALA B 123 63.570 60.271 52.493 1.00 3.85 B +ATOM 1861 O ALA B 123 62.978 61.371 52.469 1.00 4.05 B +ATOM 1862 CB ALA B 123 64.603 59.479 50.429 1.00 5.43 B +ATOM 1863 N ILE B 124 64.325 59.869 53.494 1.00 3.64 B +ATOM 1864 CA ILE B 124 64.724 60.674 54.631 1.00 4.00 B +ATOM 1865 C ILE B 124 66.259 60.714 54.613 1.00 3.37 B +ATOM 1866 O ILE B 124 66.855 59.620 54.497 1.00 3.97 B +ATOM 1867 CB ILE B 124 64.242 60.087 56.000 1.00 5.41 B +ATOM 1868 CG1 ILE B 124 62.705 60.117 56.068 1.00 6.98 B +ATOM 1869 CG2 ILE B 124 64.859 60.874 57.183 1.00 6.64 B +ATOM 1870 CD1 ILE B 124 62.159 59.337 57.288 1.00 8.60 B +ATOM 1871 N ALA B 125 66.842 61.880 54.752 1.00 3.70 B +ATOM 1872 CA ALA B 125 68.301 62.068 54.808 1.00 4.32 B +ATOM 1873 C ALA B 125 68.635 62.930 56.028 1.00 3.88 B +ATOM 1874 O ALA B 125 67.777 63.665 56.523 1.00 4.96 B +ATOM 1875 CB ALA B 125 68.783 62.702 53.501 1.00 5.11 B +ATOM 1876 N VAL B 126 69.872 62.787 56.521 1.00 4.73 B +ATOM 1877 CA VAL B 126 70.287 63.588 57.683 1.00 5.32 B +ATOM 1878 C VAL B 126 71.648 64.218 57.397 1.00 5.65 B +ATOM 1879 O VAL B 126 72.479 63.670 56.687 1.00 6.01 B +ATOM 1880 CB VAL B 126 70.332 62.778 58.997 1.00 6.36 B +ATOM 1881 CG1 VAL B 126 68.943 62.402 59.496 1.00 7.37 B +ATOM 1882 CG2 VAL B 126 71.258 61.592 58.899 1.00 7.21 B +ATOM 1883 N ARG B 127 71.813 65.384 58.004 1.00 5.90 B +ATOM 1884 CA ARG B 127 73.105 66.095 57.867 1.00 8.86 B +ATOM 1885 C ARG B 127 74.200 65.483 58.748 1.00 10.67 B +ATOM 1886 O ARG B 127 75.374 65.521 58.297 1.00 12.25 B +ATOM 1887 CB ARG B 127 73.010 67.564 58.270 1.00 8.97 B +ATOM 1888 CG ARG B 127 71.998 68.304 57.429 1.00 8.83 B +ATOM 1889 CD ARG B 127 72.173 69.812 57.632 1.00 9.65 B +ATOM 1890 NE ARG B 127 71.128 70.494 56.885 1.00 8.63 B +ATOM 1891 CZ ARG B 127 71.181 70.713 55.591 1.00 8.65 B +ATOM 1892 NH1 ARG B 127 72.258 70.467 54.865 1.00 8.88 B +ATOM 1893 NH2 ARG B 127 70.066 71.099 54.968 1.00 8.68 B +ATOM 1894 N ARG B 128 73.836 65.001 59.905 1.00 12.46 B +ATOM 1895 CA ARG B 128 74.766 64.407 60.872 1.00 14.89 B +ATOM 1896 C ARG B 128 74.505 62.918 61.127 1.00 16.10 B +ATOM 1897 O ARG B 128 73.288 62.583 61.112 1.00 17.58 B +ATOM 1898 CB ARG B 128 74.648 65.151 62.222 1.00 15.67 B +ATOM 1899 OXT ARG B 128 75.293 62.395 61.959 1.00 17.72 B +ATOM 1901 N SER C 2 75.379 59.687 62.109 1.00 16.24 C +ATOM 1902 CA SER C 2 74.424 58.545 61.990 1.00 15.30 C +ATOM 1903 C SER C 2 75.199 57.256 61.682 1.00 13.90 C +ATOM 1904 O SER C 2 76.306 57.298 61.094 1.00 15.02 C +ATOM 1905 CB SER C 2 73.331 58.796 60.983 1.00 16.11 C +ATOM 1906 OG SER C 2 73.778 58.666 59.642 1.00 18.37 C +ATOM 1907 N LYS C 3 74.598 56.142 62.095 1.00 12.13 C +ATOM 1908 CA LYS C 3 75.274 54.855 61.881 1.00 11.35 C +ATOM 1909 C LYS C 3 74.285 53.732 61.619 1.00 8.65 C +ATOM 1910 O LYS C 3 73.102 53.724 61.974 1.00 7.83 C +ATOM 1911 CB LYS C 3 76.165 54.508 63.089 1.00 13.69 C +ATOM 1912 CG LYS C 3 75.337 54.208 64.314 1.00 15.79 C +ATOM 1913 CD LYS C 3 76.074 54.056 65.631 1.00 17.79 C +ATOM 1914 CE LYS C 3 76.498 55.391 66.208 1.00 18.86 C +ATOM 1915 NZ LYS C 3 76.966 55.266 67.628 1.00 20.35 C +ATOM 1916 N THR C 4 74.837 52.734 60.953 1.00 7.14 C +ATOM 1917 CA THR C 4 74.068 51.526 60.662 1.00 6.44 C +ATOM 1918 C THR C 4 73.856 50.711 61.943 1.00 5.57 C +ATOM 1919 O THR C 4 74.785 50.616 62.800 1.00 6.47 C +ATOM 1920 CB THR C 4 74.950 50.619 59.713 1.00 7.10 C +ATOM 1921 OG1 THR C 4 75.034 51.320 58.447 1.00 8.40 C +ATOM 1922 CG2 THR C 4 74.383 49.209 59.526 1.00 7.78 C +ATOM 1923 N ILE C 5 72.684 50.115 62.056 1.00 4.90 C +ATOM 1924 CA ILE C 5 72.395 49.139 63.114 1.00 5.03 C +ATOM 1925 C ILE C 5 72.500 47.762 62.401 1.00 5.26 C +ATOM 1926 O ILE C 5 71.875 47.535 61.375 1.00 5.95 C +ATOM 1927 CB ILE C 5 70.997 49.304 63.748 1.00 5.22 C +ATOM 1928 CG1 ILE C 5 70.810 50.722 64.326 1.00 5.41 C +ATOM 1929 CG2 ILE C 5 70.734 48.204 64.802 1.00 6.47 C +ATOM 1930 CD1 ILE C 5 69.334 51.050 64.678 1.00 4.98 C +ATOM 1931 N ALA C 6 73.340 46.901 62.990 1.00 5.80 C +ATOM 1932 CA ALA C 6 73.548 45.548 62.428 1.00 7.32 C +ATOM 1933 C ALA C 6 73.578 44.573 63.599 1.00 7.57 C +ATOM 1934 O ALA C 6 74.414 44.680 64.516 1.00 10.07 C +ATOM 1935 CB ALA C 6 74.808 45.481 61.583 1.00 8.24 C +ATOM 1936 N THR C 7 72.613 43.666 63.612 1.00 6.19 C +ATOM 1937 CA THR C 7 72.481 42.676 64.681 1.00 6.55 C +ATOM 1938 C THR C 7 72.188 41.286 64.145 1.00 5.76 C +ATOM 1939 O THR C 7 71.468 41.146 63.171 1.00 6.20 C +ATOM 1940 CB THR C 7 71.330 43.117 65.663 1.00 7.01 C +ATOM 1941 OG1 THR C 7 71.214 42.032 66.622 1.00 7.16 C +ATOM 1942 CG2 THR C 7 69.980 43.363 65.012 1.00 7.30 C +ATOM 1943 N GLU C 8 72.807 40.282 64.754 1.00 6.37 C +ATOM 1944 CA GLU C 8 72.568 38.895 64.376 1.00 6.48 C +ATOM 1945 C GLU C 8 71.162 38.497 64.803 1.00 6.14 C +ATOM 1946 O GLU C 8 70.650 37.460 64.341 1.00 6.07 C +ATOM 1947 CB GLU C 8 73.559 37.922 65.033 1.00 7.91 C +ATOM 1948 CG GLU C 8 73.490 37.722 66.540 1.00 9.70 C +ATOM 1949 CD GLU C 8 74.051 38.814 67.395 1.00 11.36 C +ATOM 1950 OE1 GLU C 8 74.261 39.958 66.979 1.00 12.18 C +ATOM 1951 OE2 GLU C 8 74.276 38.489 68.603 1.00 13.35 C +ATOM 1952 N ASN C 9 70.529 39.286 65.675 1.00 6.75 C +ATOM 1953 CA ASN C 9 69.204 38.967 66.220 1.00 7.05 C +ATOM 1954 C ASN C 9 68.025 39.238 65.308 1.00 7.06 C +ATOM 1955 O ASN C 9 66.872 38.959 65.680 1.00 6.95 C +ATOM 1956 CB ASN C 9 69.019 39.590 67.590 1.00 7.91 C +ATOM 1957 CG ASN C 9 70.034 39.030 68.573 1.00 9.05 C +ATOM 1958 OD1 ASN C 9 70.332 37.816 68.514 1.00 10.43 C +ATOM 1959 ND2 ASN C 9 70.545 39.902 69.410 1.00 9.59 C +ATOM 1960 N ALA C 10 68.250 39.839 64.140 1.00 5.82 C +ATOM 1961 CA ALA C 10 67.198 40.069 63.131 1.00 5.77 C +ATOM 1962 C ALA C 10 67.795 39.464 61.835 1.00 6.13 C +ATOM 1963 O ALA C 10 69.012 39.310 61.744 1.00 5.80 C +ATOM 1964 CB ALA C 10 66.850 41.527 62.935 1.00 6.12 C +ATOM 1965 N PRO C 11 66.939 39.127 60.887 1.00 6.62 C +ATOM 1966 CA PRO C 11 67.427 38.556 59.626 1.00 6.86 C +ATOM 1967 C PRO C 11 68.470 39.432 58.991 1.00 6.78 C +ATOM 1968 O PRO C 11 68.299 40.681 58.925 1.00 6.19 C +ATOM 1969 CB PRO C 11 66.191 38.483 58.750 1.00 7.77 C +ATOM 1970 CG PRO C 11 65.012 38.512 59.680 1.00 8.11 C +ATOM 1971 CD PRO C 11 65.475 39.270 60.918 1.00 7.42 C +ATOM 1972 N ALA C 12 69.527 38.830 58.469 1.00 8.21 C +ATOM 1973 CA ALA C 12 70.624 39.572 57.836 1.00 9.55 C +ATOM 1974 C ALA C 12 70.099 40.348 56.629 1.00 10.63 C +ATOM 1975 O ALA C 12 69.197 39.905 55.909 1.00 9.79 C +ATOM 1976 CB ALA C 12 71.687 38.589 57.344 1.00 10.50 C +ATOM 1977 N ALA C 13 70.685 41.520 56.468 1.00 11.95 C +ATOM 1978 CA ALA C 13 70.356 42.435 55.363 1.00 14.35 C +ATOM 1979 C ALA C 13 71.201 42.006 54.159 1.00 15.86 C +ATOM 1980 O ALA C 13 72.361 42.446 54.077 1.00 17.22 C +ATOM 1981 CB ALA C 13 70.640 43.882 55.728 1.00 14.52 C +ATOM 1982 N ILE C 14 70.571 41.192 53.335 1.00 16.89 C +ATOM 1983 CA ILE C 14 71.268 40.701 52.121 1.00 18.21 C +ATOM 1984 C ILE C 14 71.151 41.712 50.983 1.00 18.11 C +ATOM 1985 O ILE C 14 72.218 42.096 50.420 1.00 19.37 C +ATOM 1986 CB ILE C 14 70.805 39.249 51.808 1.00 19.06 C +ATOM 1987 CG1 ILE C 14 71.045 38.352 53.063 1.00 19.75 C +ATOM 1988 CG2 ILE C 14 71.498 38.616 50.571 1.00 19.75 C +ATOM 1989 CD1 ILE C 14 70.339 36.972 52.904 1.00 20.29 C +ATOM 1990 N GLY C 15 69.955 42.164 50.671 1.00 17.28 C +ATOM 1991 CA GLY C 15 69.783 43.173 49.589 1.00 15.10 C +ATOM 1992 C GLY C 15 70.474 44.499 49.929 1.00 13.16 C +ATOM 1993 O GLY C 15 71.233 44.655 50.901 1.00 14.07 C +ATOM 1994 N PRO C 16 70.180 45.491 49.082 1.00 11.29 C +ATOM 1995 CA PRO C 16 70.743 46.834 49.214 1.00 9.14 C +ATOM 1996 C PRO C 16 70.025 47.663 50.263 1.00 8.00 C +ATOM 1997 O PRO C 16 69.393 48.680 49.940 1.00 6.68 C +ATOM 1998 CB PRO C 16 70.627 47.384 47.790 1.00 9.25 C +ATOM 1999 CG PRO C 16 69.299 46.821 47.323 1.00 9.12 C +ATOM 2000 CD PRO C 16 69.312 45.393 47.874 1.00 10.61 C +ATOM 2001 N TYR C 17 70.158 47.238 51.512 1.00 6.92 C +ATOM 2002 CA TYR C 17 69.552 47.969 52.643 1.00 6.14 C +ATOM 2003 C TYR C 17 70.301 47.559 53.900 1.00 5.54 C +ATOM 2004 O TYR C 17 71.069 46.568 53.863 1.00 7.15 C +ATOM 2005 CB TYR C 17 68.038 47.653 52.770 1.00 6.78 C +ATOM 2006 CG TYR C 17 67.760 46.184 53.035 1.00 7.73 C +ATOM 2007 CD1 TYR C 17 67.570 45.725 54.354 1.00 8.18 C +ATOM 2008 CD2 TYR C 17 67.736 45.220 52.031 1.00 8.87 C +ATOM 2009 CE1 TYR C 17 67.316 44.386 54.645 1.00 9.51 C +ATOM 2010 CE2 TYR C 17 67.498 43.868 52.309 1.00 10.50 C +ATOM 2011 CZ TYR C 17 67.302 43.463 53.612 1.00 10.45 C +ATOM 2012 OH TYR C 17 67.069 42.136 53.906 1.00 12.81 C +ATOM 2013 N VAL C 18 70.101 48.285 54.974 1.00 5.53 C +ATOM 2014 CA VAL C 18 70.616 47.936 56.302 1.00 5.01 C +ATOM 2015 C VAL C 18 69.366 47.657 57.143 1.00 5.01 C +ATOM 2016 O VAL C 18 68.264 48.112 56.823 1.00 5.04 C +ATOM 2017 CB VAL C 18 71.510 48.995 56.929 1.00 5.59 C +ATOM 2018 CG1 VAL C 18 72.797 49.086 56.116 1.00 6.33 C +ATOM 2019 CG2 VAL C 18 70.825 50.342 57.091 1.00 6.00 C +ATOM 2020 N GLN C 19 69.553 46.945 58.244 1.00 4.48 C +ATOM 2021 CA GLN C 19 68.446 46.600 59.142 1.00 4.00 C +ATOM 2022 C GLN C 19 67.805 47.834 59.775 1.00 3.80 C +ATOM 2023 O GLN C 19 66.598 47.857 60.035 1.00 3.75 C +ATOM 2024 CB GLN C 19 68.895 45.663 60.267 1.00 5.03 C +ATOM 2025 CG GLN C 19 69.363 44.310 59.743 1.00 5.44 C +ATOM 2026 CD GLN C 19 70.048 43.542 60.837 1.00 5.87 C +ATOM 2027 OE1 GLN C 19 70.789 44.130 61.623 1.00 7.44 C +ATOM 2028 NE2 GLN C 19 69.850 42.220 60.896 1.00 6.86 C +ATOM 2029 N GLY C 20 68.629 48.826 60.101 1.00 4.08 C +ATOM 2030 CA GLY C 20 68.083 50.054 60.731 1.00 3.84 C +ATOM 2031 C GLY C 20 69.194 51.077 60.795 1.00 3.63 C +ATOM 2032 O GLY C 20 70.366 50.763 60.515 1.00 3.92 C +ATOM 2033 N VAL C 21 68.820 52.293 61.175 1.00 3.33 C +ATOM 2034 CA VAL C 21 69.766 53.390 61.313 1.00 3.95 C +ATOM 2035 C VAL C 21 69.576 54.047 62.676 1.00 3.79 C +ATOM 2036 O VAL C 21 68.449 54.224 63.146 1.00 4.94 C +ATOM 2037 CB VAL C 21 69.624 54.401 60.160 1.00 3.78 C +ATOM 2038 CG1 VAL C 21 70.091 53.754 58.864 1.00 4.83 C +ATOM 2039 CG2 VAL C 21 68.190 54.888 60.047 1.00 4.51 C +ATOM 2040 N ASP C 22 70.702 54.402 63.260 1.00 4.14 C +ATOM 2041 CA ASP C 22 70.749 55.097 64.566 1.00 4.70 C +ATOM 2042 C ASP C 22 71.148 56.528 64.213 1.00 4.45 C +ATOM 2043 O ASP C 22 72.315 56.763 63.839 1.00 5.58 C +ATOM 2044 CB ASP C 22 71.720 54.398 65.504 1.00 6.22 C +ATOM 2045 CG ASP C 22 71.968 55.106 66.810 1.00 7.08 C +ATOM 2046 OD1 ASP C 22 72.601 54.461 67.693 1.00 8.97 C +ATOM 2047 OD2 ASP C 22 71.563 56.249 66.976 1.00 7.76 C +ATOM 2048 N LEU C 23 70.241 57.471 64.305 1.00 4.71 C +ATOM 2049 CA LEU C 23 70.471 58.871 63.966 1.00 5.58 C +ATOM 2050 C LEU C 23 70.823 59.745 65.149 1.00 6.38 C +ATOM 2051 O LEU C 23 70.882 60.979 64.983 1.00 8.55 C +ATOM 2052 CB LEU C 23 69.193 59.403 63.270 1.00 5.54 C +ATOM 2053 CG LEU C 23 68.674 58.507 62.154 1.00 6.24 C +ATOM 2054 CD1 LEU C 23 67.451 59.178 61.512 1.00 6.77 C +ATOM 2055 CD2 LEU C 23 69.707 58.259 61.054 1.00 6.93 C +ATOM 2056 N GLY C 24 71.039 59.166 66.286 1.00 6.72 C +ATOM 2057 CA GLY C 24 71.338 59.920 67.523 1.00 7.67 C +ATOM 2058 C GLY C 24 70.084 59.707 68.400 1.00 7.60 C +ATOM 2059 O GLY C 24 69.915 58.600 68.942 1.00 8.31 C +ATOM 2060 N ASN C 25 69.248 60.704 68.474 1.00 7.01 C +ATOM 2061 CA ASN C 25 68.036 60.524 69.301 1.00 7.87 C +ATOM 2062 C ASN C 25 67.049 59.570 68.622 1.00 7.17 C +ATOM 2063 O ASN C 25 66.371 58.790 69.317 1.00 7.79 C +ATOM 2064 CB ASN C 25 67.343 61.872 69.507 1.00 9.22 C +ATOM 2065 CG ASN C 25 66.113 61.713 70.393 1.00 10.32 C +ATOM 2066 OD1 ASN C 25 66.200 61.175 71.506 1.00 12.32 C +ATOM 2067 ND2 ASN C 25 64.967 62.167 69.869 1.00 11.31 C +ATOM 2068 N MET C 26 66.912 59.596 67.320 1.00 6.21 C +ATOM 2069 CA MET C 26 65.949 58.766 66.599 1.00 5.60 C +ATOM 2070 C MET C 26 66.583 57.556 65.937 1.00 5.14 C +ATOM 2071 O MET C 26 67.653 57.663 65.301 1.00 5.60 C +ATOM 2072 CB MET C 26 65.295 59.657 65.517 1.00 6.37 C +ATOM 2073 CG MET C 26 64.201 58.892 64.822 1.00 7.10 C +ATOM 2074 SD MET C 26 63.237 59.952 63.718 1.00 8.83 C +ATOM 2075 CE MET C 26 62.195 60.817 64.935 1.00 9.98 C +ATOM 2076 N ILE C 27 65.904 56.435 66.080 1.00 4.19 C +ATOM 2077 CA ILE C 27 66.272 55.172 65.439 1.00 4.28 C +ATOM 2078 C ILE C 27 65.142 54.845 64.446 1.00 3.82 C +ATOM 2079 O ILE C 27 63.960 54.992 64.828 1.00 3.92 C +ATOM 2080 CB ILE C 27 66.370 54.038 66.521 1.00 6.29 C +ATOM 2081 CG1 ILE C 27 67.744 54.078 67.247 1.00 7.15 C +ATOM 2082 CG2 ILE C 27 66.085 52.630 65.945 1.00 7.40 C +ATOM 2083 CD1 ILE C 27 68.089 55.432 67.892 1.00 7.34 C +ATOM 2084 N ILE C 28 65.496 54.416 63.256 1.00 3.50 C +ATOM 2085 CA ILE C 28 64.494 54.000 62.289 1.00 3.86 C +ATOM 2086 C ILE C 28 64.841 52.595 61.811 1.00 3.50 C +ATOM 2087 O ILE C 28 66.009 52.349 61.387 1.00 4.39 C +ATOM 2088 CB ILE C 28 64.397 54.955 61.051 1.00 4.84 C +ATOM 2089 CG1 ILE C 28 64.271 56.417 61.518 1.00 5.31 C +ATOM 2090 CG2 ILE C 28 63.234 54.508 60.136 1.00 5.87 C +ATOM 2091 CD1 ILE C 28 64.133 57.405 60.336 1.00 5.89 C +ATOM 2092 N THR C 29 63.885 51.698 61.836 1.00 3.96 C +ATOM 2093 CA THR C 29 64.117 50.363 61.295 1.00 4.14 C +ATOM 2094 C THR C 29 63.625 50.241 59.858 1.00 3.59 C +ATOM 2095 O THR C 29 62.751 50.957 59.398 1.00 4.36 C +ATOM 2096 CB THR C 29 63.402 49.229 62.148 1.00 4.08 C +ATOM 2097 OG1 THR C 29 62.003 49.151 61.797 1.00 3.82 C +ATOM 2098 CG2 THR C 29 63.547 49.413 63.662 1.00 4.97 C +ATOM 2099 N SER C 30 64.195 49.245 59.184 1.00 3.82 C +ATOM 2100 CA SER C 30 63.673 48.819 57.896 1.00 3.64 C +ATOM 2101 C SER C 30 62.342 48.083 58.225 1.00 3.76 C +ATOM 2102 O SER C 30 62.094 47.678 59.377 1.00 4.49 C +ATOM 2103 CB SER C 30 64.615 47.782 57.269 1.00 3.92 C +ATOM 2104 OG SER C 30 65.679 48.466 56.635 1.00 4.47 C +ATOM 2105 N GLY C 31 61.521 47.915 57.202 1.00 3.83 C +ATOM 2106 CA GLY C 31 60.254 47.176 57.299 1.00 4.29 C +ATOM 2107 C GLY C 31 60.617 45.727 57.583 1.00 4.32 C +ATOM 2108 O GLY C 31 61.268 45.108 56.714 1.00 6.10 C +ATOM 2109 N GLN C 32 60.248 45.164 58.708 1.00 3.41 C +ATOM 2110 CA GLN C 32 60.581 43.789 59.085 1.00 3.93 C +ATOM 2111 C GLN C 32 59.469 42.841 58.647 1.00 3.99 C +ATOM 2112 O GLN C 32 58.292 43.019 58.943 1.00 4.71 C +ATOM 2113 CB GLN C 32 60.781 43.678 60.603 1.00 4.22 C +ATOM 2114 CG GLN C 32 61.955 44.494 61.116 1.00 3.95 C +ATOM 2115 CD GLN C 32 63.233 44.181 60.387 1.00 4.74 C +ATOM 2116 OE1 GLN C 32 63.674 43.025 60.399 1.00 5.56 C +ATOM 2117 NE2 GLN C 32 63.775 45.179 59.688 1.00 4.99 C +ATOM 2118 N ILE C 33 59.924 41.772 58.014 1.00 5.20 C +ATOM 2119 CA ILE C 33 59.037 40.684 57.594 1.00 5.52 C +ATOM 2120 C ILE C 33 59.277 39.527 58.558 1.00 5.61 C +ATOM 2121 O ILE C 33 60.308 39.471 59.271 1.00 5.33 C +ATOM 2122 CB ILE C 33 59.247 40.335 56.109 1.00 6.50 C +ATOM 2123 CG1 ILE C 33 60.720 39.958 55.811 1.00 7.36 C +ATOM 2124 CG2 ILE C 33 58.775 41.489 55.181 1.00 7.63 C +ATOM 2125 CD1 ILE C 33 60.854 39.290 54.422 1.00 8.30 C +ATOM 2126 N PRO C 34 58.333 38.606 58.600 1.00 5.57 C +ATOM 2127 CA PRO C 34 58.367 37.522 59.576 1.00 5.47 C +ATOM 2128 C PRO C 34 59.321 36.371 59.282 1.00 5.79 C +ATOM 2129 O PRO C 34 58.907 35.192 59.360 1.00 7.27 C +ATOM 2130 CB PRO C 34 56.914 37.030 59.664 1.00 5.88 C +ATOM 2131 CG PRO C 34 56.396 37.325 58.276 1.00 6.23 C +ATOM 2132 CD PRO C 34 57.019 38.678 57.937 1.00 5.26 C +ATOM 2133 N VAL C 35 60.555 36.721 58.985 1.00 5.68 C +ATOM 2134 CA VAL C 35 61.601 35.706 58.775 1.00 6.40 C +ATOM 2135 C VAL C 35 62.295 35.492 60.117 1.00 5.88 C +ATOM 2136 O VAL C 35 62.677 36.425 60.824 1.00 5.93 C +ATOM 2137 CB VAL C 35 62.615 36.200 57.731 1.00 7.54 C +ATOM 2138 CG1 VAL C 35 63.850 35.300 57.671 1.00 7.74 C +ATOM 2139 CG2 VAL C 35 61.976 36.356 56.376 1.00 7.73 C +ATOM 2140 N ASN C 36 62.453 34.209 60.449 1.00 6.56 C +ATOM 2141 CA ASN C 36 63.134 33.832 61.711 1.00 7.61 C +ATOM 2142 C ASN C 36 64.632 34.009 61.509 1.00 7.47 C +ATOM 2143 O ASN C 36 65.195 33.398 60.575 1.00 8.51 C +ATOM 2144 CB ASN C 36 62.735 32.397 62.016 1.00 9.42 C +ATOM 2145 CG ASN C 36 63.346 31.815 63.262 1.00 11.61 C +ATOM 2146 OD1 ASN C 36 64.567 31.911 63.471 1.00 12.84 C +ATOM 2147 ND2 ASN C 36 62.500 31.143 64.047 1.00 12.39 C +ATOM 2148 N PRO C 37 65.329 34.757 62.330 1.00 7.10 C +ATOM 2149 CA PRO C 37 66.766 34.975 62.151 1.00 8.07 C +ATOM 2150 C PRO C 37 67.622 33.759 62.412 1.00 8.69 C +ATOM 2151 O PRO C 37 68.790 33.731 62.001 1.00 9.39 C +ATOM 2152 CB PRO C 37 67.097 36.114 63.114 1.00 8.93 C +ATOM 2153 CG PRO C 37 66.064 35.942 64.190 1.00 9.33 C +ATOM 2154 CD PRO C 37 64.793 35.519 63.459 1.00 8.45 C +ATOM 2155 N LYS C 38 67.088 32.797 63.140 1.00 9.24 C +ATOM 2156 CA LYS C 38 67.841 31.560 63.446 1.00 11.17 C +ATOM 2157 C LYS C 38 67.772 30.604 62.270 1.00 11.35 C +ATOM 2158 O LYS C 38 68.821 30.007 61.908 1.00 12.18 C +ATOM 2159 CB LYS C 38 67.259 30.905 64.682 1.00 12.66 C +ATOM 2160 CG LYS C 38 67.972 29.693 65.260 1.00 13.74 C +ATOM 2161 CD LYS C 38 67.360 29.220 66.600 1.00 14.42 C +ATOM 2162 CE LYS C 38 67.528 30.156 67.638 1.00 17.20 C +ATOM 2163 NZ LYS C 38 68.973 30.401 67.909 1.00 18.80 C +ATOM 2164 N THR C 39 66.605 30.410 61.667 1.00 11.29 C +ATOM 2165 CA THR C 39 66.426 29.447 60.585 1.00 11.38 C +ATOM 2166 C THR C 39 66.161 29.945 59.192 1.00 11.67 C +ATOM 2167 O THR C 39 66.283 29.146 58.231 1.00 12.12 C +ATOM 2168 CB THR C 39 65.202 28.498 60.967 1.00 11.46 C +ATOM 2169 OG1 THR C 39 64.024 29.377 60.899 1.00 11.47 C +ATOM 2170 CG2 THR C 39 65.321 27.870 62.342 1.00 12.27 C +ATOM 2171 N GLY C 40 65.724 31.191 59.069 1.00 11.14 C +ATOM 2172 CA GLY C 40 65.397 31.757 57.763 1.00 11.25 C +ATOM 2173 C GLY C 40 63.969 31.414 57.343 1.00 11.36 C +ATOM 2174 O GLY C 40 63.543 31.858 56.264 1.00 12.70 C +ATOM 2175 N GLU C 41 63.248 30.667 58.149 1.00 11.11 C +ATOM 2176 CA GLU C 41 61.871 30.278 57.815 1.00 11.71 C +ATOM 2177 C GLU C 41 60.833 31.296 58.245 1.00 10.19 C +ATOM 2178 O GLU C 41 61.111 32.099 59.139 1.00 10.11 C +ATOM 2179 CB GLU C 41 61.534 28.947 58.517 1.00 13.86 C +ATOM 2180 CG GLU C 41 62.414 27.808 57.967 1.00 16.75 C +ATOM 2181 CD GLU C 41 62.196 26.469 58.606 1.00 18.82 C +ATOM 2182 OE1 GLU C 41 61.693 26.338 59.711 1.00 19.76 C +ATOM 2183 OE2 GLU C 41 62.618 25.559 57.848 1.00 20.70 C +ATOM 2184 N VAL C 42 59.670 31.202 57.633 1.00 9.39 C +ATOM 2185 CA VAL C 42 58.529 32.092 57.933 1.00 8.66 C +ATOM 2186 C VAL C 42 57.415 31.207 58.479 1.00 8.84 C +ATOM 2187 O VAL C 42 57.073 30.227 57.758 1.00 8.91 C +ATOM 2188 CB VAL C 42 58.081 32.799 56.643 1.00 8.81 C +ATOM 2189 CG1 VAL C 42 56.777 33.559 56.885 1.00 8.55 C +ATOM 2190 CG2 VAL C 42 59.169 33.725 56.120 1.00 9.11 C +ATOM 2191 N PRO C 43 56.877 31.514 59.617 1.00 8.44 C +ATOM 2192 CA PRO C 43 55.791 30.715 60.210 1.00 9.28 C +ATOM 2193 C PRO C 43 54.546 30.918 59.367 1.00 9.79 C +ATOM 2194 O PRO C 43 54.342 32.000 58.768 1.00 9.85 C +ATOM 2195 CB PRO C 43 55.701 31.207 61.650 1.00 9.38 C +ATOM 2196 CG PRO C 43 56.141 32.652 61.567 1.00 9.11 C +ATOM 2197 CD PRO C 43 57.216 32.661 60.480 1.00 8.87 C +ATOM 2198 N ALA C 44 53.711 29.882 59.303 1.00 11.00 C +ATOM 2199 CA ALA C 44 52.480 29.932 58.508 1.00 11.90 C +ATOM 2200 C ALA C 44 51.404 30.874 59.042 1.00 12.03 C +ATOM 2201 O ALA C 44 50.802 31.691 58.329 1.00 13.47 C +ATOM 2202 CB ALA C 44 51.963 28.484 58.433 1.00 12.50 C +ATOM 2203 N ASP C 45 51.148 30.762 60.303 1.00 11.52 C +ATOM 2204 CA ASP C 45 50.149 31.428 61.135 1.00 11.81 C +ATOM 2205 C ASP C 45 50.292 32.946 61.109 1.00 10.80 C +ATOM 2206 O ASP C 45 51.424 33.415 61.365 1.00 9.73 C +ATOM 2207 CB ASP C 45 50.311 30.749 62.522 1.00 12.76 C +ATOM 2208 CG ASP C 45 49.304 31.268 63.505 1.00 14.25 C +ATOM 2209 OD1 ASP C 45 49.667 32.157 64.292 1.00 13.77 C +ATOM 2210 OD2 ASP C 45 48.132 30.805 63.527 1.00 15.41 C +ATOM 2211 N VAL C 46 49.235 33.695 60.863 1.00 10.67 C +ATOM 2212 CA VAL C 46 49.368 35.167 60.837 1.00 9.52 C +ATOM 2213 C VAL C 46 49.754 35.756 62.188 1.00 7.84 C +ATOM 2214 O VAL C 46 50.509 36.743 62.245 1.00 7.66 C +ATOM 2215 CB VAL C 46 48.136 35.839 60.208 1.00 10.26 C +ATOM 2216 CG1 VAL C 46 46.877 35.681 61.046 1.00 10.79 C +ATOM 2217 CG2 VAL C 46 48.431 37.284 59.868 1.00 10.65 C +ATOM 2218 N ALA C 47 49.237 35.185 63.265 1.00 7.55 C +ATOM 2219 CA ALA C 47 49.612 35.697 64.600 1.00 7.95 C +ATOM 2220 C ALA C 47 51.114 35.497 64.795 1.00 7.45 C +ATOM 2221 O ALA C 47 51.831 36.408 65.283 1.00 7.40 C +ATOM 2222 CB ALA C 47 48.813 35.003 65.692 1.00 8.33 C +ATOM 2223 N ALA C 48 51.602 34.327 64.432 1.00 6.86 C +ATOM 2224 CA ALA C 48 53.034 34.040 64.567 1.00 6.14 C +ATOM 2225 C ALA C 48 53.826 34.976 63.666 1.00 5.74 C +ATOM 2226 O ALA C 48 54.919 35.401 64.063 1.00 5.87 C +ATOM 2227 CB ALA C 48 53.277 32.576 64.257 1.00 6.39 C +ATOM 2228 N GLN C 49 53.331 35.270 62.494 1.00 5.59 C +ATOM 2229 CA GLN C 49 54.043 36.209 61.597 1.00 5.03 C +ATOM 2230 C GLN C 49 54.116 37.590 62.247 1.00 4.68 C +ATOM 2231 O GLN C 49 55.172 38.233 62.234 1.00 5.23 C +ATOM 2232 CB GLN C 49 53.385 36.255 60.225 1.00 5.71 C +ATOM 2233 CG GLN C 49 53.671 34.994 59.395 1.00 6.17 C +ATOM 2234 CD GLN C 49 53.381 35.202 57.921 1.00 5.93 C +ATOM 2235 OE1 GLN C 49 53.335 36.340 57.420 1.00 5.99 C +ATOM 2236 NE2 GLN C 49 53.220 34.110 57.175 1.00 6.38 C +ATOM 2237 N ALA C 50 52.982 38.029 62.786 1.00 4.71 C +ATOM 2238 CA ALA C 50 53.010 39.364 63.431 1.00 4.54 C +ATOM 2239 C ALA C 50 54.046 39.396 64.554 1.00 4.94 C +ATOM 2240 O ALA C 50 54.833 40.349 64.694 1.00 4.87 C +ATOM 2241 CB ALA C 50 51.649 39.764 63.973 1.00 5.66 C +ATOM 2242 N ARG C 51 54.078 38.327 65.338 1.00 5.38 C +ATOM 2243 CA ARG C 51 55.051 38.260 66.439 1.00 5.49 C +ATOM 2244 C ARG C 51 56.478 38.200 65.950 1.00 5.04 C +ATOM 2245 O ARG C 51 57.349 38.845 66.565 1.00 6.12 C +ATOM 2246 CB ARG C 51 54.730 37.136 67.419 1.00 6.73 C +ATOM 2247 CG ARG C 51 55.631 37.074 68.640 1.00 7.56 C +ATOM 2248 CD ARG C 51 55.064 36.205 69.722 1.00 8.32 C +ATOM 2249 NE ARG C 51 53.902 36.735 70.418 1.00 8.95 C +ATOM 2250 CZ ARG C 51 53.925 37.601 71.442 1.00 9.18 C +ATOM 2251 NH1 ARG C 51 55.070 38.084 71.924 1.00 8.39 C +ATOM 2252 NH2 ARG C 51 52.772 37.999 71.993 1.00 10.81 C +ATOM 2253 N GLN C 52 56.762 37.460 64.896 1.00 4.75 C +ATOM 2254 CA GLN C 52 58.134 37.375 64.365 1.00 4.61 C +ATOM 2255 C GLN C 52 58.546 38.755 63.848 1.00 4.34 C +ATOM 2256 O GLN C 52 59.715 39.161 64.060 1.00 4.87 C +ATOM 2257 CB GLN C 52 58.235 36.296 63.303 1.00 5.74 C +ATOM 2258 CG GLN C 52 59.657 36.148 62.806 1.00 5.80 C +ATOM 2259 CD GLN C 52 60.622 35.679 63.854 1.00 6.30 C +ATOM 2260 OE1 GLN C 52 60.690 34.471 64.133 1.00 7.97 C +ATOM 2261 NE2 GLN C 52 61.386 36.576 64.428 1.00 7.04 C +ATOM 2262 N SER C 53 57.667 39.438 63.125 1.00 4.36 C +ATOM 2263 CA SER C 53 58.016 40.796 62.658 1.00 4.64 C +ATOM 2264 C SER C 53 58.319 41.730 63.831 1.00 4.34 C +ATOM 2265 O SER C 53 59.298 42.486 63.783 1.00 4.42 C +ATOM 2266 CB SER C 53 56.895 41.346 61.801 1.00 5.03 C +ATOM 2267 OG SER C 53 56.920 40.874 60.480 1.00 7.71 C +ATOM 2268 N LEU C 54 57.494 41.672 64.858 1.00 4.12 C +ATOM 2269 CA LEU C 54 57.715 42.501 66.053 1.00 4.70 C +ATOM 2270 C LEU C 54 59.020 42.130 66.747 1.00 3.93 C +ATOM 2271 O LEU C 54 59.740 43.026 67.222 1.00 4.71 C +ATOM 2272 CB LEU C 54 56.508 42.407 66.961 1.00 5.03 C +ATOM 2273 CG LEU C 54 55.288 43.166 66.430 1.00 5.82 C +ATOM 2274 CD1 LEU C 54 54.045 42.760 67.223 1.00 5.88 C +ATOM 2275 CD2 LEU C 54 55.463 44.673 66.492 1.00 6.70 C +ATOM 2276 N ASP C 55 59.334 40.853 66.819 1.00 4.46 C +ATOM 2277 CA ASP C 55 60.595 40.440 67.461 1.00 4.76 C +ATOM 2278 C ASP C 55 61.777 40.976 66.648 1.00 5.09 C +ATOM 2279 O ASP C 55 62.801 41.316 67.240 1.00 4.83 C +ATOM 2280 CB ASP C 55 60.620 38.926 67.603 1.00 6.75 C +ATOM 2281 CG ASP C 55 59.894 38.396 68.831 1.00 8.66 C +ATOM 2282 OD1 ASP C 55 59.457 37.229 68.842 1.00 10.67 C +ATOM 2283 OD2 ASP C 55 59.813 39.156 69.804 1.00 10.74 C +ATOM 2284 N ASN C 56 61.607 40.966 65.338 1.00 4.45 C +ATOM 2285 CA ASN C 56 62.713 41.477 64.473 1.00 3.71 C +ATOM 2286 C ASN C 56 62.874 42.971 64.745 1.00 3.25 C +ATOM 2287 O ASN C 56 64.018 43.473 64.821 1.00 4.24 C +ATOM 2288 CB ASN C 56 62.455 41.182 62.994 1.00 4.47 C +ATOM 2289 CG ASN C 56 62.655 39.696 62.707 1.00 4.53 C +ATOM 2290 OD1 ASN C 56 63.249 38.956 63.521 1.00 5.62 C +ATOM 2291 ND2 ASN C 56 62.124 39.213 61.580 1.00 4.94 C +ATOM 2292 N VAL C 57 61.766 43.710 64.803 1.00 4.41 C +ATOM 2293 CA VAL C 57 61.842 45.156 65.125 1.00 4.09 C +ATOM 2294 C VAL C 57 62.535 45.322 66.462 1.00 3.73 C +ATOM 2295 O VAL C 57 63.454 46.150 66.644 1.00 4.05 C +ATOM 2296 CB VAL C 57 60.449 45.777 65.167 1.00 4.49 C +ATOM 2297 CG1 VAL C 57 60.478 47.143 65.858 1.00 5.66 C +ATOM 2298 CG2 VAL C 57 59.829 45.886 63.791 1.00 5.00 C +ATOM 2299 N LYS C 58 62.121 44.563 67.461 1.00 3.78 C +ATOM 2300 CA LYS C 58 62.701 44.626 68.814 1.00 4.51 C +ATOM 2301 C LYS C 58 64.200 44.385 68.786 1.00 4.64 C +ATOM 2302 O LYS C 58 64.970 45.078 69.453 1.00 4.91 C +ATOM 2303 CB LYS C 58 62.023 43.566 69.685 1.00 5.87 C +ATOM 2304 CG LYS C 58 62.715 43.368 71.037 1.00 6.61 C +ATOM 2305 CD LYS C 58 61.914 42.422 71.911 1.00 8.95 C +ATOM 2306 CE LYS C 58 62.736 41.827 73.036 1.00 9.79 C +ATOM 2307 NZ LYS C 58 61.926 40.944 73.903 1.00 10.97 C +ATOM 2308 N ALA C 59 64.648 43.393 68.027 1.00 4.57 C +ATOM 2309 CA ALA C 59 66.089 43.097 67.955 1.00 4.83 C +ATOM 2310 C ALA C 59 66.884 44.313 67.483 1.00 4.63 C +ATOM 2311 O ALA C 59 67.993 44.584 67.996 1.00 4.41 C +ATOM 2312 CB ALA C 59 66.337 41.941 67.000 1.00 5.64 C +ATOM 2313 N ILE C 60 66.365 45.015 66.485 1.00 4.27 C +ATOM 2314 CA ILE C 60 67.056 46.183 65.916 1.00 4.66 C +ATOM 2315 C ILE C 60 67.056 47.337 66.898 1.00 3.81 C +ATOM 2316 O ILE C 60 68.071 48.023 67.079 1.00 4.20 C +ATOM 2317 CB ILE C 60 66.403 46.509 64.546 1.00 4.36 C +ATOM 2318 CG1 ILE C 60 66.623 45.317 63.588 1.00 4.56 C +ATOM 2319 CG2 ILE C 60 66.941 47.835 63.966 1.00 4.23 C +ATOM 2320 CD1 ILE C 60 65.655 45.375 62.373 1.00 5.34 C +ATOM 2321 N VAL C 61 65.896 47.603 67.504 1.00 3.65 C +ATOM 2322 CA VAL C 61 65.787 48.677 68.511 1.00 4.56 C +ATOM 2323 C VAL C 61 66.702 48.400 69.698 1.00 4.22 C +ATOM 2324 O VAL C 61 67.411 49.299 70.160 1.00 4.43 C +ATOM 2325 CB VAL C 61 64.309 48.830 68.907 1.00 4.74 C +ATOM 2326 CG1 VAL C 61 64.101 49.722 70.122 1.00 5.69 C +ATOM 2327 CG2 VAL C 61 63.493 49.318 67.725 1.00 5.47 C +ATOM 2328 N GLU C 62 66.723 47.153 70.151 1.00 4.43 C +ATOM 2329 CA GLU C 62 67.592 46.812 71.288 1.00 4.95 C +ATOM 2330 C GLU C 62 69.052 46.887 70.885 1.00 5.30 C +ATOM 2331 O GLU C 62 69.907 47.256 71.723 1.00 5.38 C +ATOM 2332 CB GLU C 62 67.274 45.453 71.893 1.00 5.58 C +ATOM 2333 CG GLU C 62 65.906 45.458 72.586 1.00 7.08 C +ATOM 2334 CD GLU C 62 65.533 44.237 73.352 1.00 8.46 C +ATOM 2335 OE1 GLU C 62 64.697 44.288 74.252 1.00 10.06 C +ATOM 2336 OE2 GLU C 62 66.109 43.157 73.067 1.00 10.50 C +ATOM 2337 N ALA C 63 69.401 46.584 69.650 1.00 5.02 C +ATOM 2338 CA ALA C 63 70.802 46.655 69.190 1.00 4.80 C +ATOM 2339 C ALA C 63 71.281 48.101 69.229 1.00 4.67 C +ATOM 2340 O ALA C 63 72.498 48.351 69.284 1.00 5.23 C +ATOM 2341 CB ALA C 63 70.900 46.025 67.832 1.00 4.87 C +ATOM 2342 N ALA C 64 70.374 49.063 69.195 1.00 4.95 C +ATOM 2343 CA ALA C 64 70.725 50.469 69.277 1.00 5.12 C +ATOM 2344 C ALA C 64 70.686 50.966 70.720 1.00 5.56 C +ATOM 2345 O ALA C 64 70.844 52.193 70.916 1.00 6.36 C +ATOM 2346 CB ALA C 64 69.816 51.305 68.378 1.00 6.01 C +ATOM 2347 N GLY C 65 70.458 50.111 71.682 1.00 5.32 C +ATOM 2348 CA GLY C 65 70.438 50.514 73.092 1.00 5.69 C +ATOM 2349 C GLY C 65 69.073 50.980 73.563 1.00 5.00 C +ATOM 2350 O GLY C 65 69.029 51.580 74.662 1.00 6.60 C +ATOM 2351 N LEU C 66 68.006 50.731 72.813 1.00 4.89 C +ATOM 2352 CA LEU C 66 66.660 51.180 73.201 1.00 5.10 C +ATOM 2353 C LEU C 66 65.820 49.989 73.579 1.00 5.52 C +ATOM 2354 O LEU C 66 66.215 48.832 73.428 1.00 6.12 C +ATOM 2355 CB LEU C 66 66.064 52.009 72.059 1.00 5.47 C +ATOM 2356 CG LEU C 66 66.729 53.366 71.886 1.00 7.05 C +ATOM 2357 CD1 LEU C 66 65.995 54.150 70.805 1.00 7.79 C +ATOM 2358 CD2 LEU C 66 66.813 54.124 73.209 1.00 8.50 C +ATOM 2359 N LYS C 67 64.601 50.268 74.007 1.00 5.84 C +ATOM 2360 CA LYS C 67 63.637 49.228 74.408 1.00 6.22 C +ATOM 2361 C LYS C 67 62.402 49.343 73.532 1.00 5.40 C +ATOM 2362 O LYS C 67 62.130 50.377 72.892 1.00 5.50 C +ATOM 2363 CB LYS C 67 63.194 49.489 75.855 1.00 8.08 C +ATOM 2364 CG LYS C 67 64.348 49.479 76.860 1.00 10.38 C +ATOM 2365 CD LYS C 67 63.839 49.838 78.259 1.00 13.10 C +ATOM 2366 CE LYS C 67 64.978 49.778 79.272 1.00 14.74 C +ATOM 2367 NZ LYS C 67 64.415 49.892 80.648 1.00 16.76 C +ATOM 2368 N VAL C 68 61.611 48.260 73.571 1.00 5.45 C +ATOM 2369 CA VAL C 68 60.318 48.274 72.874 1.00 5.05 C +ATOM 2370 C VAL C 68 59.513 49.501 73.341 1.00 5.56 C +ATOM 2371 O VAL C 68 58.804 50.091 72.512 1.00 5.83 C +ATOM 2372 CB VAL C 68 59.566 46.958 73.124 1.00 5.97 C +ATOM 2373 CG1 VAL C 68 58.097 47.047 72.733 1.00 6.44 C +ATOM 2374 CG2 VAL C 68 60.292 45.781 72.484 1.00 7.15 C +ATOM 2375 N GLY C 69 59.620 49.861 74.607 1.00 5.71 C +ATOM 2376 CA GLY C 69 58.890 51.014 75.148 1.00 6.22 C +ATOM 2377 C GLY C 69 59.314 52.347 74.533 1.00 5.67 C +ATOM 2378 O GLY C 69 58.601 53.347 74.754 1.00 6.75 C +ATOM 2379 N ASP C 70 60.435 52.380 73.824 1.00 4.83 C +ATOM 2380 CA ASP C 70 60.912 53.599 73.148 1.00 5.11 C +ATOM 2381 C ASP C 70 60.358 53.725 71.723 1.00 4.14 C +ATOM 2382 O ASP C 70 60.662 54.733 71.075 1.00 4.50 C +ATOM 2383 CB ASP C 70 62.438 53.647 73.177 1.00 5.29 C +ATOM 2384 CG ASP C 70 63.006 53.641 74.595 1.00 6.10 C +ATOM 2385 OD1 ASP C 70 63.965 52.875 74.820 1.00 6.91 C +ATOM 2386 OD2 ASP C 70 62.444 54.367 75.421 1.00 6.71 C +ATOM 2387 N ILE C 71 59.653 52.727 71.273 1.00 4.31 C +ATOM 2388 CA ILE C 71 59.080 52.803 69.910 1.00 4.32 C +ATOM 2389 C ILE C 71 57.903 53.793 69.964 1.00 3.98 C +ATOM 2390 O ILE C 71 57.004 53.583 70.796 1.00 5.01 C +ATOM 2391 CB ILE C 71 58.633 51.394 69.417 1.00 4.70 C +ATOM 2392 CG1 ILE C 71 59.861 50.449 69.260 1.00 4.36 C +ATOM 2393 CG2 ILE C 71 57.847 51.552 68.095 1.00 4.30 C +ATOM 2394 CD1 ILE C 71 59.494 48.952 69.090 1.00 4.71 C +ATOM 2395 N VAL C 72 57.918 54.776 69.082 1.00 3.47 C +ATOM 2396 CA VAL C 72 56.889 55.822 69.101 1.00 3.99 C +ATOM 2397 C VAL C 72 56.023 55.826 67.872 1.00 3.90 C +ATOM 2398 O VAL C 72 54.930 56.434 67.929 1.00 4.27 C +ATOM 2399 CB VAL C 72 57.550 57.201 69.355 1.00 4.41 C +ATOM 2400 CG1 VAL C 72 58.134 57.263 70.752 1.00 5.07 C +ATOM 2401 CG2 VAL C 72 58.575 57.520 68.283 1.00 5.77 C +ATOM 2402 N LYS C 73 56.414 55.155 66.779 1.00 3.52 C +ATOM 2403 CA LYS C 73 55.571 55.125 65.579 1.00 4.16 C +ATOM 2404 C LYS C 73 55.868 53.841 64.797 1.00 4.31 C +ATOM 2405 O LYS C 73 57.077 53.541 64.631 1.00 4.84 C +ATOM 2406 CB LYS C 73 55.893 56.294 64.647 1.00 5.02 C +ATOM 2407 CG LYS C 73 55.194 56.361 63.285 1.00 5.28 C +ATOM 2408 CD LYS C 73 53.682 56.411 63.319 1.00 5.37 C +ATOM 2409 CE LYS C 73 53.030 56.630 61.976 1.00 6.08 C +ATOM 2410 NZ LYS C 73 53.409 55.657 60.916 1.00 6.35 C +ATOM 2411 N THR C 74 54.825 53.193 64.350 1.00 3.73 C +ATOM 2412 CA THR C 74 55.013 52.052 63.456 1.00 3.85 C +ATOM 2413 C THR C 74 54.103 52.262 62.249 1.00 3.84 C +ATOM 2414 O THR C 74 53.119 53.017 62.260 1.00 3.85 C +ATOM 2415 CB THR C 74 54.626 50.705 64.155 1.00 4.06 C +ATOM 2416 OG1 THR C 74 53.208 50.782 64.451 1.00 4.62 C +ATOM 2417 CG2 THR C 74 55.461 50.387 65.381 1.00 4.69 C +ATOM 2418 N THR C 75 54.460 51.537 61.192 1.00 3.73 C +ATOM 2419 CA THR C 75 53.559 51.389 60.053 1.00 4.09 C +ATOM 2420 C THR C 75 53.439 49.849 59.881 1.00 4.02 C +ATOM 2421 O THR C 75 54.483 49.180 59.787 1.00 4.60 C +ATOM 2422 CB THR C 75 53.947 52.052 58.716 1.00 5.33 C +ATOM 2423 OG1 THR C 75 53.995 53.481 59.053 1.00 6.90 C +ATOM 2424 CG2 THR C 75 52.938 51.782 57.597 1.00 6.26 C +ATOM 2425 N VAL C 76 52.221 49.388 59.859 1.00 3.79 C +ATOM 2426 CA VAL C 76 51.923 47.970 59.705 1.00 4.37 C +ATOM 2427 C VAL C 76 51.232 47.772 58.362 1.00 4.23 C +ATOM 2428 O VAL C 76 50.109 48.259 58.120 1.00 5.09 C +ATOM 2429 CB VAL C 76 51.017 47.518 60.873 1.00 5.09 C +ATOM 2430 CG1 VAL C 76 50.674 46.034 60.718 1.00 6.10 C +ATOM 2431 CG2 VAL C 76 51.642 47.745 62.256 1.00 5.44 C +ATOM 2432 N PHE C 77 51.943 47.079 57.500 1.00 3.73 C +ATOM 2433 CA PHE C 77 51.434 46.755 56.152 1.00 4.03 C +ATOM 2434 C PHE C 77 50.948 45.307 56.221 1.00 3.31 C +ATOM 2435 O PHE C 77 51.785 44.458 56.607 1.00 5.04 C +ATOM 2436 CB PHE C 77 52.535 46.861 55.114 1.00 3.99 C +ATOM 2437 CG PHE C 77 53.226 48.187 55.025 1.00 3.46 C +ATOM 2438 CD1 PHE C 77 54.494 48.378 55.589 1.00 4.75 C +ATOM 2439 CD2 PHE C 77 52.632 49.243 54.338 1.00 4.57 C +ATOM 2440 CE1 PHE C 77 55.186 49.580 55.436 1.00 5.64 C +ATOM 2441 CE2 PHE C 77 53.314 50.457 54.208 1.00 5.55 C +ATOM 2442 CZ PHE C 77 54.585 50.626 54.721 1.00 5.75 C +ATOM 2443 N VAL C 78 49.713 45.018 55.872 1.00 3.70 C +ATOM 2444 CA VAL C 78 49.221 43.641 55.909 1.00 4.71 C +ATOM 2445 C VAL C 78 48.751 43.220 54.528 1.00 4.55 C +ATOM 2446 O VAL C 78 48.352 44.038 53.710 1.00 4.79 C +ATOM 2447 CB VAL C 78 48.100 43.447 56.948 1.00 5.00 C +ATOM 2448 CG1 VAL C 78 48.575 43.745 58.363 1.00 6.84 C +ATOM 2449 CG2 VAL C 78 46.861 44.287 56.648 1.00 5.75 C +ATOM 2450 N LYS C 79 48.753 41.906 54.334 1.00 5.21 C +ATOM 2451 CA LYS C 79 48.222 41.315 53.107 1.00 5.74 C +ATOM 2452 C LYS C 79 46.696 41.199 53.200 1.00 6.17 C +ATOM 2453 O LYS C 79 46.034 41.240 52.134 1.00 6.76 C +ATOM 2454 CB LYS C 79 48.840 39.956 52.842 1.00 6.81 C +ATOM 2455 CG LYS C 79 48.264 39.231 51.634 1.00 8.82 C +ATOM 2456 CD LYS C 79 48.396 39.989 50.323 1.00 10.71 C +ATOM 2457 CE LYS C 79 47.516 39.447 49.209 1.00 11.66 C +ATOM 2458 NZ LYS C 79 46.072 39.707 49.470 1.00 13.37 C +ATOM 2459 N ASP C 80 46.123 41.078 54.376 1.00 6.31 C +ATOM 2460 CA ASP C 80 44.661 40.898 54.487 1.00 6.74 C +ATOM 2461 C ASP C 80 44.088 41.474 55.764 1.00 6.52 C +ATOM 2462 O ASP C 80 44.340 40.896 56.841 1.00 7.52 C +ATOM 2463 CB ASP C 80 44.370 39.382 54.361 1.00 7.41 C +ATOM 2464 CG ASP C 80 42.895 39.052 54.297 1.00 8.15 C +ATOM 2465 OD1 ASP C 80 42.544 37.864 54.054 1.00 10.21 C +ATOM 2466 OD2 ASP C 80 42.034 39.923 54.466 1.00 8.03 C +ATOM 2467 N LEU C 81 43.364 42.574 55.668 1.00 6.91 C +ATOM 2468 CA LEU C 81 42.760 43.190 56.846 1.00 8.19 C +ATOM 2469 C LEU C 81 41.754 42.250 57.501 1.00 8.43 C +ATOM 2470 O LEU C 81 41.386 42.540 58.657 1.00 9.36 C +ATOM 2471 CB LEU C 81 42.188 44.569 56.573 1.00 8.43 C +ATOM 2472 CG LEU C 81 43.238 45.680 56.623 1.00 8.40 C +ATOM 2473 CD1 LEU C 81 42.606 46.935 56.024 1.00 9.27 C +ATOM 2474 CD2 LEU C 81 43.682 45.909 58.050 1.00 9.04 C +ATOM 2475 N ASN C 82 41.326 41.191 56.839 1.00 8.67 C +ATOM 2476 CA ASN C 82 40.394 40.271 57.540 1.00 9.87 C +ATOM 2477 C ASN C 82 41.113 39.557 58.691 1.00 10.44 C +ATOM 2478 O ASN C 82 40.434 39.033 59.592 1.00 11.63 C +ATOM 2479 CB ASN C 82 39.715 39.283 56.608 1.00 10.51 C +ATOM 2480 CG ASN C 82 38.642 39.992 55.772 1.00 10.87 C +ATOM 2481 OD1 ASN C 82 38.003 40.917 56.248 1.00 11.41 C +ATOM 2482 ND2 ASN C 82 38.505 39.530 54.538 1.00 11.83 C +ATOM 2483 N ASP C 83 42.430 39.542 58.688 1.00 10.73 C +ATOM 2484 CA ASP C 83 43.195 38.901 59.787 1.00 11.58 C +ATOM 2485 C ASP C 83 43.606 39.956 60.809 1.00 11.57 C +ATOM 2486 O ASP C 83 44.366 39.650 61.760 1.00 11.86 C +ATOM 2487 CB ASP C 83 44.409 38.174 59.225 1.00 12.86 C +ATOM 2488 CG ASP C 83 44.116 36.833 58.600 1.00 13.31 C +ATOM 2489 OD1 ASP C 83 44.833 36.447 57.683 1.00 14.31 C +ATOM 2490 OD2 ASP C 83 43.183 36.124 59.090 1.00 15.40 C +ATOM 2491 N PHE C 84 43.112 41.173 60.688 1.00 11.64 C +ATOM 2492 CA PHE C 84 43.566 42.211 61.630 1.00 12.27 C +ATOM 2493 C PHE C 84 43.200 42.034 63.088 1.00 11.14 C +ATOM 2494 O PHE C 84 43.995 42.522 63.933 1.00 10.67 C +ATOM 2495 CB PHE C 84 43.296 43.608 61.082 1.00 13.85 C +ATOM 2496 CG PHE C 84 44.457 44.516 61.435 1.00 15.36 C +ATOM 2497 CD1 PHE C 84 44.313 45.490 62.419 1.00 16.41 C +ATOM 2498 CD2 PHE C 84 45.675 44.347 60.771 1.00 15.95 C +ATOM 2499 CE1 PHE C 84 45.396 46.316 62.724 1.00 17.08 C +ATOM 2500 CE2 PHE C 84 46.757 45.182 61.074 1.00 16.89 C +ATOM 2501 CZ PHE C 84 46.612 46.170 62.051 1.00 16.95 C +ATOM 2502 N ALA C 85 42.102 41.392 63.448 1.00 10.77 C +ATOM 2503 CA ALA C 85 41.794 41.220 64.879 1.00 10.60 C +ATOM 2504 C ALA C 85 42.914 40.407 65.535 1.00 9.89 C +ATOM 2505 O ALA C 85 43.346 40.689 66.653 1.00 9.55 C +ATOM 2506 CB ALA C 85 40.425 40.575 65.072 1.00 11.44 C +ATOM 2507 N THR C 86 43.359 39.403 64.784 1.00 10.27 C +ATOM 2508 CA THR C 86 44.420 38.507 65.263 1.00 10.82 C +ATOM 2509 C THR C 86 45.740 39.247 65.418 1.00 9.25 C +ATOM 2510 O THR C 86 46.473 39.123 66.418 1.00 8.54 C +ATOM 2511 CB THR C 86 44.584 37.245 64.317 1.00 12.16 C +ATOM 2512 OG1 THR C 86 43.272 36.607 64.271 1.00 13.99 C +ATOM 2513 CG2 THR C 86 45.690 36.315 64.815 1.00 12.79 C +ATOM 2514 N VAL C 87 46.057 40.011 64.392 1.00 8.71 C +ATOM 2515 CA VAL C 87 47.289 40.822 64.395 1.00 8.40 C +ATOM 2516 C VAL C 87 47.232 41.809 65.555 1.00 7.98 C +ATOM 2517 O VAL C 87 48.236 41.965 66.265 1.00 8.35 C +ATOM 2518 CB VAL C 87 47.470 41.540 63.043 1.00 8.84 C +ATOM 2519 CG1 VAL C 87 48.539 42.621 63.167 1.00 9.19 C +ATOM 2520 CG2 VAL C 87 47.778 40.533 61.950 1.00 9.80 C +ATOM 2521 N ASN C 88 46.109 42.472 65.711 1.00 7.83 C +ATOM 2522 CA ASN C 88 45.933 43.463 66.775 1.00 9.07 C +ATOM 2523 C ASN C 88 46.146 42.851 68.144 1.00 8.46 C +ATOM 2524 O ASN C 88 46.768 43.450 69.026 1.00 7.86 C +ATOM 2525 CB ASN C 88 44.572 44.145 66.740 1.00 10.40 C +ATOM 2526 CG ASN C 88 44.610 45.540 66.169 1.00 11.76 C +ATOM 2527 OD1 ASN C 88 45.662 46.210 66.239 1.00 12.61 C +ATOM 2528 ND2 ASN C 88 43.454 45.921 65.615 1.00 13.35 C +ATOM 2529 N ALA C 89 45.587 41.664 68.340 1.00 7.67 C +ATOM 2530 CA ALA C 89 45.742 40.975 69.637 1.00 7.58 C +ATOM 2531 C ALA C 89 47.212 40.678 69.934 1.00 6.88 C +ATOM 2532 O ALA C 89 47.682 40.867 71.066 1.00 7.11 C +ATOM 2533 CB ALA C 89 44.884 39.713 69.635 1.00 8.02 C +ATOM 2534 N THR C 90 47.898 40.173 68.916 1.00 7.04 C +ATOM 2535 CA THR C 90 49.326 39.858 69.089 1.00 7.07 C +ATOM 2536 C THR C 90 50.133 41.132 69.328 1.00 6.37 C +ATOM 2537 O THR C 90 51.031 41.163 70.183 1.00 6.22 C +ATOM 2538 CB THR C 90 49.853 39.083 67.823 1.00 7.91 C +ATOM 2539 OG1 THR C 90 49.254 37.752 67.848 1.00 10.49 C +ATOM 2540 CG2 THR C 90 51.378 39.020 67.792 1.00 9.07 C +ATOM 2541 N TYR C 91 49.837 42.164 68.549 1.00 6.16 C +ATOM 2542 CA TYR C 91 50.539 43.451 68.653 1.00 5.79 C +ATOM 2543 C TYR C 91 50.341 44.026 70.048 1.00 5.81 C +ATOM 2544 O TYR C 91 51.278 44.488 70.724 1.00 6.66 C +ATOM 2545 CB TYR C 91 50.008 44.344 67.546 1.00 5.88 C +ATOM 2546 CG TYR C 91 50.645 45.698 67.369 1.00 5.59 C +ATOM 2547 CD1 TYR C 91 51.497 45.958 66.295 1.00 5.96 C +ATOM 2548 CD2 TYR C 91 50.394 46.730 68.267 1.00 6.04 C +ATOM 2549 CE1 TYR C 91 52.070 47.210 66.067 1.00 5.47 C +ATOM 2550 CE2 TYR C 91 50.940 47.994 68.093 1.00 6.05 C +ATOM 2551 CZ TYR C 91 51.768 48.210 66.985 1.00 5.90 C +ATOM 2552 OH TYR C 91 52.315 49.467 66.804 1.00 5.93 C +ATOM 2553 N GLU C 92 49.095 44.002 70.502 1.00 6.05 C +ATOM 2554 CA GLU C 92 48.771 44.514 71.841 1.00 6.75 C +ATOM 2555 C GLU C 92 49.548 43.765 72.917 1.00 6.71 C +ATOM 2556 O GLU C 92 50.151 44.350 73.846 1.00 7.08 C +ATOM 2557 CB GLU C 92 47.269 44.437 72.138 1.00 8.59 C +ATOM 2558 CG GLU C 92 46.875 44.989 73.518 1.00 11.80 C +ATOM 2559 CD GLU C 92 45.500 45.544 73.634 1.00 15.28 C +ATOM 2560 OE1 GLU C 92 45.106 46.349 74.486 1.00 18.01 C +ATOM 2561 OE2 GLU C 92 44.704 45.182 72.757 1.00 17.25 C +ATOM 2562 N ALA C 93 49.534 42.434 72.824 1.00 6.56 C +ATOM 2563 CA ALA C 93 50.239 41.573 73.786 1.00 7.09 C +ATOM 2564 C ALA C 93 51.726 41.900 73.817 1.00 6.90 C +ATOM 2565 O ALA C 93 52.313 42.030 74.895 1.00 7.00 C +ATOM 2566 CB ALA C 93 50.036 40.092 73.460 1.00 7.57 C +ATOM 2567 N PHE C 94 52.302 42.042 72.618 1.00 6.67 C +ATOM 2568 CA PHE C 94 53.752 42.332 72.516 1.00 6.61 C +ATOM 2569 C PHE C 94 54.131 43.597 73.288 1.00 5.97 C +ATOM 2570 O PHE C 94 55.105 43.607 74.054 1.00 6.59 C +ATOM 2571 CB PHE C 94 54.101 42.401 71.034 1.00 7.02 C +ATOM 2572 CG PHE C 94 55.555 42.599 70.771 1.00 7.23 C +ATOM 2573 CD1 PHE C 94 56.358 41.464 70.713 1.00 8.12 C +ATOM 2574 CD2 PHE C 94 56.098 43.862 70.605 1.00 8.71 C +ATOM 2575 CE1 PHE C 94 57.717 41.545 70.478 1.00 9.74 C +ATOM 2576 CE2 PHE C 94 57.485 43.979 70.367 1.00 9.96 C +ATOM 2577 CZ PHE C 94 58.243 42.813 70.332 1.00 9.82 C +ATOM 2578 N PHE C 95 53.389 44.675 73.086 1.00 5.98 C +ATOM 2579 CA PHE C 95 53.651 45.951 73.781 1.00 6.00 C +ATOM 2580 C PHE C 95 53.417 45.784 75.281 1.00 6.18 C +ATOM 2581 O PHE C 95 54.226 46.266 76.101 1.00 6.81 C +ATOM 2582 CB PHE C 95 52.962 47.140 73.124 1.00 6.51 C +ATOM 2583 CG PHE C 95 53.714 47.524 71.874 1.00 6.57 C +ATOM 2584 CD1 PHE C 95 53.373 47.028 70.622 1.00 7.43 C +ATOM 2585 CD2 PHE C 95 54.850 48.341 71.976 1.00 6.79 C +ATOM 2586 CE1 PHE C 95 54.111 47.329 69.479 1.00 7.20 C +ATOM 2587 CE2 PHE C 95 55.584 48.669 70.841 1.00 7.08 C +ATOM 2588 CZ PHE C 95 55.238 48.145 69.594 1.00 7.03 C +ATOM 2589 N THR C 96 52.319 45.112 75.622 1.00 6.49 C +ATOM 2590 CA THR C 96 52.019 44.897 77.053 1.00 8.11 C +ATOM 2591 C THR C 96 53.131 44.112 77.732 1.00 7.33 C +ATOM 2592 O THR C 96 53.504 44.429 78.891 1.00 7.70 C +ATOM 2593 CB THR C 96 50.627 44.186 77.231 1.00 9.27 C +ATOM 2594 OG1 THR C 96 49.670 45.085 76.633 1.00 11.25 C +ATOM 2595 CG2 THR C 96 50.311 43.881 78.696 1.00 9.94 C +ATOM 2596 N GLU C 97 53.665 43.106 77.060 1.00 7.31 C +ATOM 2597 CA GLU C 97 54.743 42.266 77.615 1.00 8.29 C +ATOM 2598 C GLU C 97 55.957 43.102 77.942 1.00 7.86 C +ATOM 2599 O GLU C 97 56.745 42.748 78.850 1.00 9.08 C +ATOM 2600 CB GLU C 97 55.168 41.175 76.606 1.00 8.63 C +ATOM 2601 CG GLU C 97 54.068 40.094 76.405 1.00 9.19 C +ATOM 2602 CD GLU C 97 54.140 39.441 75.045 1.00 9.70 C +ATOM 2603 OE1 GLU C 97 55.128 39.587 74.338 1.00 10.55 C +ATOM 2604 OE2 GLU C 97 53.131 38.781 74.714 1.00 11.38 C +ATOM 2605 N HIS C 98 56.159 44.220 77.252 1.00 7.67 C +ATOM 2606 CA HIS C 98 57.305 45.097 77.458 1.00 7.40 C +ATOM 2607 C HIS C 98 56.958 46.321 78.282 1.00 7.94 C +ATOM 2608 O HIS C 98 57.751 47.288 78.280 1.00 8.19 C +ATOM 2609 CB HIS C 98 57.908 45.506 76.069 1.00 7.48 C +ATOM 2610 CG HIS C 98 58.471 44.303 75.377 1.00 7.83 C +ATOM 2611 ND1 HIS C 98 57.790 43.472 74.517 1.00 7.93 C +ATOM 2612 CD2 HIS C 98 59.750 43.815 75.452 1.00 8.60 C +ATOM 2613 CE1 HIS C 98 58.614 42.522 74.117 1.00 8.30 C +ATOM 2614 NE2 HIS C 98 59.801 42.697 74.649 1.00 9.30 C +ATOM 2615 N ASN C 99 55.806 46.291 78.931 1.00 8.01 C +ATOM 2616 CA ASN C 99 55.341 47.423 79.752 1.00 8.93 C +ATOM 2617 C ASN C 99 55.499 48.728 78.974 1.00 7.82 C +ATOM 2618 O ASN C 99 55.928 49.777 79.517 1.00 8.81 C +ATOM 2619 CB ASN C 99 56.144 47.463 81.061 1.00 10.58 C +ATOM 2620 CG ASN C 99 55.546 48.447 82.056 1.00 11.86 C +ATOM 2621 OD1 ASN C 99 54.320 48.653 82.042 1.00 13.08 C +ATOM 2622 ND2 ASN C 99 56.417 49.031 82.877 1.00 13.49 C +ATOM 2623 N ALA C 100 55.106 48.690 77.711 1.00 7.10 C +ATOM 2624 CA ALA C 100 55.270 49.808 76.792 1.00 7.43 C +ATOM 2625 C ALA C 100 54.005 50.563 76.441 1.00 8.24 C +ATOM 2626 O ALA C 100 52.988 49.904 76.191 1.00 9.53 C +ATOM 2627 CB ALA C 100 55.884 49.262 75.483 1.00 7.38 C +ATOM 2628 N THR C 101 54.110 51.880 76.411 1.00 7.83 C +ATOM 2629 CA THR C 101 52.985 52.694 75.927 1.00 8.26 C +ATOM 2630 C THR C 101 52.883 52.331 74.436 1.00 7.07 C +ATOM 2631 O THR C 101 53.936 52.184 73.774 1.00 7.16 C +ATOM 2632 CB THR C 101 53.292 54.229 76.107 1.00 9.39 C +ATOM 2633 OG1 THR C 101 53.397 54.419 77.548 1.00 10.96 C +ATOM 2634 CG2 THR C 101 52.244 55.144 75.476 1.00 10.68 C +ATOM 2635 N PHE C 102 51.687 52.245 73.911 1.00 6.83 C +ATOM 2636 CA PHE C 102 51.556 51.894 72.488 1.00 6.82 C +ATOM 2637 C PHE C 102 52.049 53.025 71.584 1.00 6.10 C +ATOM 2638 O PHE C 102 51.781 54.203 71.847 1.00 6.28 C +ATOM 2639 CB PHE C 102 50.095 51.600 72.146 1.00 7.29 C +ATOM 2640 CG PHE C 102 49.431 50.546 72.979 1.00 7.87 C +ATOM 2641 CD1 PHE C 102 48.256 50.799 73.681 1.00 8.98 C +ATOM 2642 CD2 PHE C 102 49.997 49.264 73.053 1.00 7.94 C +ATOM 2643 CE1 PHE C 102 47.641 49.822 74.451 1.00 10.13 C +ATOM 2644 CE2 PHE C 102 49.401 48.256 73.816 1.00 8.74 C +ATOM 2645 CZ PHE C 102 48.219 48.548 74.523 1.00 9.67 C +ATOM 2646 N PRO C 103 52.750 52.655 70.515 1.00 6.23 C +ATOM 2647 CA PRO C 103 53.188 53.723 69.588 1.00 6.02 C +ATOM 2648 C PRO C 103 52.008 54.299 68.798 1.00 4.53 C +ATOM 2649 O PRO C 103 50.898 53.729 68.719 1.00 4.36 C +ATOM 2650 CB PRO C 103 54.011 52.895 68.557 1.00 7.30 C +ATOM 2651 CG PRO C 103 54.398 51.613 69.236 1.00 7.26 C +ATOM 2652 CD PRO C 103 53.207 51.314 70.155 1.00 6.81 C +ATOM 2653 N ALA C 104 52.268 55.432 68.152 1.00 4.08 C +ATOM 2654 CA ALA C 104 51.379 55.928 67.093 1.00 3.99 C +ATOM 2655 C ALA C 104 51.514 54.866 65.961 1.00 3.68 C +ATOM 2656 O ALA C 104 52.531 54.135 65.862 1.00 4.10 C +ATOM 2657 CB ALA C 104 51.799 57.278 66.624 1.00 4.60 C +ATOM 2658 N ARG C 105 50.488 54.754 65.116 1.00 4.14 C +ATOM 2659 CA ARG C 105 50.483 53.701 64.091 1.00 4.07 C +ATOM 2660 C ARG C 105 49.676 54.037 62.865 1.00 3.75 C +ATOM 2661 O ARG C 105 48.671 54.784 62.974 1.00 3.67 C +ATOM 2662 CB ARG C 105 49.844 52.439 64.776 1.00 5.04 C +ATOM 2663 CG ARG C 105 49.901 51.168 63.932 1.00 6.68 C +ATOM 2664 CD ARG C 105 49.471 49.920 64.669 1.00 7.36 C +ATOM 2665 NE ARG C 105 48.059 49.942 64.950 1.00 9.16 C +ATOM 2666 CZ ARG C 105 47.372 48.872 65.406 1.00 9.60 C +ATOM 2667 NH1 ARG C 105 46.061 48.897 65.570 1.00 10.15 C +ATOM 2668 NH2 ARG C 105 48.029 47.767 65.757 1.00 9.57 C +ATOM 2669 N SER C 106 50.143 53.519 61.735 1.00 3.97 C +ATOM 2670 CA SER C 106 49.356 53.565 60.496 1.00 4.51 C +ATOM 2671 C SER C 106 49.212 52.082 60.072 1.00 4.12 C +ATOM 2672 O SER C 106 50.144 51.289 60.266 1.00 4.73 C +ATOM 2673 CB SER C 106 49.959 54.353 59.374 1.00 5.49 C +ATOM 2674 OG SER C 106 49.957 55.710 59.796 1.00 6.48 C +HETATM 2675 N CSP C 107 48.054 51.758 59.505 1.00 4.52 C +HETATM 2676 CA CSP C 107 47.760 50.378 59.129 1.00 5.72 C +HETATM 2677 CB CSP C 107 46.804 49.700 60.089 0.67 8.42 C +HETATM 2679 SG CSP C 107 47.227 49.776 61.809 0.67 12.80 C +HETATM 2680 P CSP C 107 45.759 51.167 62.354 0.67 14.01 C +HETATM 2681 O1P CSP C 107 45.839 52.330 61.495 0.67 15.06 C +HETATM 2682 O2P CSP C 107 44.369 50.515 62.084 0.67 15.90 C +HETATM 2683 O3P CSP C 107 45.931 51.332 63.867 0.67 14.77 C +HETATM 2684 C CSP C 107 47.046 50.355 57.779 1.00 4.97 C +HETATM 2685 O CSP C 107 45.986 51.024 57.644 1.00 4.62 C +ATOM 2687 N VAL C 108 47.551 49.572 56.859 1.00 4.59 C +ATOM 2688 CA VAL C 108 46.918 49.485 55.529 1.00 4.55 C +ATOM 2689 C VAL C 108 47.075 48.074 55.005 1.00 4.55 C +ATOM 2690 O VAL C 108 48.046 47.373 55.353 1.00 4.69 C +ATOM 2691 CB VAL C 108 47.594 50.491 54.549 1.00 4.96 C +ATOM 2692 CG1 VAL C 108 47.484 51.949 54.998 1.00 5.33 C +ATOM 2693 CG2 VAL C 108 49.027 50.132 54.200 1.00 6.15 C +ATOM 2694 N GLU C 109 46.183 47.680 54.097 1.00 4.88 C +ATOM 2695 CA GLU C 109 46.293 46.413 53.393 1.00 4.49 C +ATOM 2696 C GLU C 109 46.954 46.709 52.038 1.00 4.13 C +ATOM 2697 O GLU C 109 46.405 47.528 51.280 1.00 5.16 C +ATOM 2698 CB GLU C 109 44.938 45.767 53.124 1.00 5.33 C +ATOM 2699 CG GLU C 109 45.089 44.371 52.523 1.00 5.37 C +ATOM 2700 CD GLU C 109 43.746 43.764 52.168 1.00 6.00 C +ATOM 2701 OE1 GLU C 109 43.552 43.382 51.012 1.00 7.16 C +ATOM 2702 OE2 GLU C 109 42.917 43.683 53.105 1.00 5.73 C +ATOM 2703 N VAL C 110 48.087 46.081 51.785 1.00 4.12 C +ATOM 2704 CA VAL C 110 48.778 46.266 50.496 1.00 5.16 C +ATOM 2705 C VAL C 110 48.429 45.106 49.561 1.00 4.97 C +ATOM 2706 O VAL C 110 47.748 44.159 49.994 1.00 5.83 C +ATOM 2707 CB VAL C 110 50.295 46.324 50.727 1.00 5.61 C +ATOM 2708 CG1 VAL C 110 50.678 47.521 51.594 1.00 6.03 C +ATOM 2709 CG2 VAL C 110 50.844 45.036 51.320 1.00 5.94 C +ATOM 2710 N ALA C 111 48.840 45.198 48.309 1.00 5.19 C +ATOM 2711 CA ALA C 111 48.558 44.126 47.352 1.00 5.46 C +ATOM 2712 C ALA C 111 49.429 42.900 47.562 1.00 5.34 C +ATOM 2713 O ALA C 111 48.964 41.750 47.334 1.00 6.46 C +ATOM 2714 CB ALA C 111 48.746 44.653 45.917 1.00 5.06 C +ATOM 2715 N ARG C 112 50.685 43.091 47.959 1.00 5.42 C +ATOM 2716 CA ARG C 112 51.619 41.972 48.127 1.00 5.97 C +ATOM 2717 C ARG C 112 52.817 42.478 48.900 1.00 5.15 C +ATOM 2718 O ARG C 112 53.130 43.687 48.874 1.00 5.33 C +ATOM 2719 CB ARG C 112 52.068 41.486 46.742 1.00 5.86 C +ATOM 2720 CG ARG C 112 52.715 40.113 46.714 1.00 7.01 C +ATOM 2721 CD ARG C 112 53.123 39.755 45.315 1.00 7.87 C +ATOM 2722 NE ARG C 112 53.754 38.438 45.315 1.00 9.03 C +ATOM 2723 CZ ARG C 112 54.495 37.936 44.312 1.00 9.58 C +ATOM 2724 NH1 ARG C 112 55.015 36.706 44.464 1.00 10.53 C +ATOM 2725 NH2 ARG C 112 54.677 38.619 43.181 1.00 10.02 C +ATOM 2726 N LEU C 113 53.475 41.571 49.596 1.00 5.16 C +ATOM 2727 CA LEU C 113 54.662 41.860 50.392 1.00 5.23 C +ATOM 2728 C LEU C 113 55.800 40.958 49.961 1.00 5.70 C +ATOM 2729 O LEU C 113 55.580 39.890 49.350 1.00 6.10 C +ATOM 2730 CB LEU C 113 54.335 41.632 51.873 1.00 5.50 C +ATOM 2731 CG LEU C 113 53.370 42.649 52.474 1.00 5.34 C +ATOM 2732 CD1 LEU C 113 52.921 42.176 53.859 1.00 5.70 C +ATOM 2733 CD2 LEU C 113 54.010 44.032 52.557 1.00 4.99 C +ATOM 2734 N PRO C 114 57.024 41.361 50.268 1.00 6.67 C +ATOM 2735 CA PRO C 114 58.195 40.539 49.934 1.00 7.38 C +ATOM 2736 C PRO C 114 57.984 39.124 50.475 1.00 7.04 C +ATOM 2737 O PRO C 114 57.489 38.861 51.586 1.00 7.08 C +ATOM 2738 CB PRO C 114 59.357 41.239 50.649 1.00 7.55 C +ATOM 2739 CG PRO C 114 58.922 42.679 50.756 1.00 7.89 C +ATOM 2740 CD PRO C 114 57.405 42.617 50.956 1.00 7.17 C +ATOM 2741 N LYS C 115 58.370 38.152 49.650 1.00 7.96 C +ATOM 2742 CA LYS C 115 58.299 36.717 49.953 1.00 9.22 C +ATOM 2743 C LYS C 115 56.876 36.276 50.209 1.00 9.21 C +ATOM 2744 O LYS C 115 56.725 35.203 50.835 1.00 9.21 C +ATOM 2745 CB LYS C 115 59.162 36.379 51.173 1.00 10.55 C +ATOM 2746 CG LYS C 115 60.632 36.740 50.934 1.00 12.98 C +ATOM 2747 CD LYS C 115 61.449 36.179 52.106 1.00 15.15 C +ATOM 2748 CE LYS C 115 62.932 36.188 51.791 1.00 16.92 C +ATOM 2749 NZ LYS C 115 63.588 34.907 52.176 1.00 18.34 C +ATOM 2750 N ASP C 116 55.882 37.020 49.783 1.00 8.41 C +ATOM 2751 CA ASP C 116 54.481 36.653 50.010 1.00 8.14 C +ATOM 2752 C ASP C 116 54.137 36.537 51.491 1.00 7.11 C +ATOM 2753 O ASP C 116 53.192 35.783 51.846 1.00 8.04 C +ATOM 2754 CB ASP C 116 54.075 35.408 49.198 1.00 9.13 C +ATOM 2755 CG ASP C 116 53.984 35.783 47.712 1.00 10.16 C +ATOM 2756 OD1 ASP C 116 54.853 35.295 46.977 1.00 11.23 C +ATOM 2757 OD2 ASP C 116 53.069 36.542 47.365 1.00 10.06 C +ATOM 2758 N VAL C 117 54.811 37.303 52.340 1.00 6.39 C +ATOM 2759 CA VAL C 117 54.470 37.277 53.781 1.00 5.93 C +ATOM 2760 C VAL C 117 53.123 37.988 53.972 1.00 5.45 C +ATOM 2761 O VAL C 117 52.615 38.671 53.077 1.00 5.92 C +ATOM 2762 CB VAL C 117 55.611 37.850 54.629 1.00 5.41 C +ATOM 2763 CG1 VAL C 117 56.910 37.045 54.552 1.00 6.56 C +ATOM 2764 CG2 VAL C 117 55.801 39.339 54.353 1.00 4.77 C +ATOM 2765 N LYS C 118 52.599 37.861 55.159 1.00 5.60 C +ATOM 2766 CA LYS C 118 51.309 38.448 55.494 1.00 5.78 C +ATOM 2767 C LYS C 118 51.421 39.794 56.190 1.00 5.20 C +ATOM 2768 O LYS C 118 50.398 40.449 56.351 1.00 4.89 C +ATOM 2769 CB LYS C 118 50.545 37.481 56.401 1.00 6.48 C +ATOM 2770 CG LYS C 118 50.197 36.142 55.766 1.00 8.03 C +ATOM 2771 CD LYS C 118 49.587 35.093 56.681 1.00 10.35 C +ATOM 2772 CE LYS C 118 49.354 33.779 55.939 1.00 12.02 C +ATOM 2773 NZ LYS C 118 48.768 32.708 56.770 1.00 13.89 C +ATOM 2774 N ILE C 119 52.620 40.201 56.595 1.00 4.72 C +ATOM 2775 CA ILE C 119 52.805 41.442 57.347 1.00 4.45 C +ATOM 2776 C ILE C 119 54.233 41.948 57.236 1.00 4.59 C +ATOM 2777 O ILE C 119 55.158 41.151 57.090 1.00 4.61 C +ATOM 2778 CB ILE C 119 52.378 41.166 58.835 1.00 4.91 C +ATOM 2779 CG1 ILE C 119 52.307 42.496 59.638 1.00 4.94 C +ATOM 2780 CG2 ILE C 119 53.294 40.145 59.557 1.00 5.42 C +ATOM 2781 CD1 ILE C 119 51.552 42.276 60.967 1.00 5.66 C +ATOM 2782 N GLU C 120 54.361 43.266 57.294 1.00 4.02 C +ATOM 2783 CA GLU C 120 55.668 43.938 57.295 1.00 3.81 C +ATOM 2784 C GLU C 120 55.491 45.119 58.249 1.00 3.77 C +ATOM 2785 O GLU C 120 54.507 45.874 58.112 1.00 4.01 C +ATOM 2786 CB GLU C 120 56.069 44.417 55.919 1.00 4.09 C +ATOM 2787 CG GLU C 120 57.420 45.120 55.856 1.00 4.28 C +ATOM 2788 CD GLU C 120 57.808 45.637 54.500 1.00 4.49 C +ATOM 2789 OE1 GLU C 120 58.514 46.641 54.356 1.00 6.49 C +ATOM 2790 OE2 GLU C 120 57.364 44.960 53.518 1.00 5.06 C +ATOM 2791 N ILE C 121 56.418 45.302 59.173 1.00 3.35 C +ATOM 2792 CA ILE C 121 56.304 46.382 60.161 1.00 3.57 C +ATOM 2793 C ILE C 121 57.596 47.173 60.255 1.00 3.38 C +ATOM 2794 O ILE C 121 58.665 46.614 60.488 1.00 3.55 C +ATOM 2795 CB ILE C 121 56.009 45.799 61.584 1.00 4.18 C +ATOM 2796 CG1 ILE C 121 54.777 44.888 61.562 1.00 5.00 C +ATOM 2797 CG2 ILE C 121 55.858 46.938 62.619 1.00 5.16 C +ATOM 2798 CD1 ILE C 121 54.470 44.198 62.912 1.00 5.62 C +ATOM 2799 N GLU C 122 57.456 48.487 60.086 1.00 3.62 C +ATOM 2800 CA GLU C 122 58.594 49.396 60.249 1.00 3.82 C +ATOM 2801 C GLU C 122 58.342 50.201 61.524 1.00 3.47 C +ATOM 2802 O GLU C 122 57.176 50.402 61.924 1.00 3.81 C +ATOM 2803 CB GLU C 122 58.847 50.309 59.073 1.00 6.01 C +ATOM 2804 CG GLU C 122 57.680 51.237 58.774 1.00 7.17 C +ATOM 2805 CD GLU C 122 57.886 52.243 57.696 1.00 8.33 C +ATOM 2806 OE1 GLU C 122 57.155 53.244 57.674 1.00 10.86 C +ATOM 2807 OE2 GLU C 122 58.772 52.050 56.839 1.00 7.19 C +ATOM 2808 N ALA C 123 59.418 50.651 62.151 1.00 4.17 C +ATOM 2809 CA ALA C 123 59.272 51.377 63.409 1.00 4.16 C +ATOM 2810 C ALA C 123 60.271 52.493 63.570 1.00 3.85 C +ATOM 2811 O ALA C 123 61.371 52.469 62.978 1.00 4.05 C +ATOM 2812 CB ALA C 123 59.479 50.429 64.603 1.00 5.43 C +ATOM 2813 N ILE C 124 59.869 53.494 64.325 1.00 3.64 C +ATOM 2814 CA ILE C 124 60.674 54.631 64.724 1.00 4.00 C +ATOM 2815 C ILE C 124 60.714 54.613 66.259 1.00 3.37 C +ATOM 2816 O ILE C 124 59.620 54.497 66.855 1.00 3.97 C +ATOM 2817 CB ILE C 124 60.087 56.000 64.242 1.00 5.41 C +ATOM 2818 CG1 ILE C 124 60.117 56.068 62.705 1.00 6.98 C +ATOM 2819 CG2 ILE C 124 60.874 57.183 64.859 1.00 6.64 C +ATOM 2820 CD1 ILE C 124 59.337 57.288 62.159 1.00 8.60 C +ATOM 2821 N ALA C 125 61.880 54.752 66.842 1.00 3.70 C +ATOM 2822 CA ALA C 125 62.068 54.808 68.301 1.00 4.32 C +ATOM 2823 C ALA C 125 62.930 56.028 68.635 1.00 3.88 C +ATOM 2824 O ALA C 125 63.665 56.523 67.777 1.00 4.96 C +ATOM 2825 CB ALA C 125 62.702 53.501 68.783 1.00 5.11 C +ATOM 2826 N VAL C 126 62.787 56.521 69.872 1.00 4.73 C +ATOM 2827 CA VAL C 126 63.588 57.683 70.287 1.00 5.32 C +ATOM 2828 C VAL C 126 64.218 57.397 71.648 1.00 5.65 C +ATOM 2829 O VAL C 126 63.670 56.687 72.479 1.00 6.01 C +ATOM 2830 CB VAL C 126 62.778 58.997 70.332 1.00 6.36 C +ATOM 2831 CG1 VAL C 126 62.402 59.496 68.943 1.00 7.37 C +ATOM 2832 CG2 VAL C 126 61.592 58.899 71.258 1.00 7.21 C +ATOM 2833 N ARG C 127 65.384 58.004 71.813 1.00 5.90 C +ATOM 2834 CA ARG C 127 66.095 57.867 73.105 1.00 8.86 C +ATOM 2835 C ARG C 127 65.483 58.748 74.200 1.00 10.67 C +ATOM 2836 O ARG C 127 65.521 58.297 75.374 1.00 12.25 C +ATOM 2837 CB ARG C 127 67.564 58.270 73.010 1.00 8.97 C +ATOM 2838 CG ARG C 127 68.304 57.429 71.998 1.00 8.83 C +ATOM 2839 CD ARG C 127 69.812 57.632 72.173 1.00 9.65 C +ATOM 2840 NE ARG C 127 70.494 56.885 71.128 1.00 8.63 C +ATOM 2841 CZ ARG C 127 70.713 55.591 71.181 1.00 8.65 C +ATOM 2842 NH1 ARG C 127 70.467 54.865 72.258 1.00 8.88 C +ATOM 2843 NH2 ARG C 127 71.099 54.968 70.066 1.00 8.68 C +ATOM 2844 N ARG C 128 65.001 59.905 73.836 1.00 12.46 C +ATOM 2845 CA ARG C 128 64.407 60.872 74.766 1.00 14.89 C +ATOM 2846 C ARG C 128 62.918 61.127 74.505 1.00 16.10 C +ATOM 2847 O ARG C 128 62.583 61.112 73.288 1.00 17.58 C +ATOM 2848 CB ARG C 128 65.151 62.222 74.648 1.00 15.67 C +ATOM 2849 OXT ARG C 128 62.395 61.959 75.293 1.00 17.72 C +END diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/prot-prot.pdb b/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/prot-prot.pdb new file mode 100644 index 000000000..4e05a6efb --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/prot-prot.pdb @@ -0,0 +1,3620 @@ +SEQRES 1 A 168 GLY LEU PHE ASP LYS LEU LYS SER LEU VAL SER ASP ASP +SEQRES 4 A 168 VAL PHE ALA GLU LYS ILE VAL GLY ASP GLY ILE ALA ILE +SEQRES 7 A 168 ILE GLU SER ASP SER GLY VAL GLU LEU PHE VAL HIS PHE +SEQRES 8 A 168 GLY ILE ASP THR VAL GLU LEU LYS GLY GLU GLY PHE LYS +SEQRES 9 A 168 ARG ILE ALA GLU GLU GLY GLN ARG VAL LYS VAL GLY ASP +SEQRES 11 A 168 ALA LYS SER THR LEU THR PRO VAL VAL ILE SER ASN MET +SEQRES 12 A 168 ASP GLU ILE LYS GLU LEU ILE LYS LEU SER GLY SER VAL +SEQRES 6 B 85 GLU GLY GLU ASP GLU GLN LYS ALA VAL GLU HIS LEU VAL +SHEET 1 A 3 ILE A 20 ILE A 23 0 +SHEET 2 A 3 PRO A 162 LYS A 167 -1 N VAL A 163 O ILE A 22 +SHEET 3 A 3 GLU A 148 LYS A 151 -1 O GLU A 148 N LYS A 167 +SHEET 1 B 8 ARG A 112 VAL A 113 0 +SHEET 2 B 8 GLY A 65 ILE A 70 -1 O GLY A 65 N VAL A 113 +SHEET 3 B 8 ALA A 76 SER A 81 -1 O SER A 78 N GLY A 68 +SHEET 4 B 8 GLU A 86 HIS A 90 -1 N LEU A 87 O ILE A 79 +SHEET 5 B 8 THR A 136 ILE A 140 -1 O PRO A 137 N HIS A 90 +SHEET 6 B 8 ASP A 48 PRO A 54 -1 O ASP A 48 N ILE A 140 +SHEET 7 B 8 GLY A 28 VAL A 31 -1 O GLU A 29 N LYS A 53 +SHEET 8 B 8 SER A 155 VAL A 156 -1 N VAL A 156 O GLY A 28 +SHEET 1 C 3 LYS A 58 VAL A 60 0 +SHEET 2 C 3 THR A 118 PHE A 122 -1 N VAL A 119 O MET A 59 +SHEET 3 C 3 PHE A 103 ARG A 105 -1 O LYS A 104 N GLU A 121 +SHEET 1 D 4 PHE B 302 THR B 307 0 +SHEET 2 D 4 VAL B 360 GLU B 366 -1 N VAL B 361 O VAL B 306 +SHEET 3 D 4 GLU B 332 SER B 337 -1 O GLU B 332 N GLU B 366 +SHEET 4 D 4 LYS B 340 SER B 343 -1 O LYS B 340 N SER B 337 +ATOM 1 N THR A 19 51.382 49.015 12.266 1.00 0.15 A +ATOM 2 CA THR A 19 51.464 47.969 13.285 1.00 0.14 A +ATOM 3 C THR A 19 50.687 48.310 14.540 1.00 0.13 A +ATOM 4 O THR A 19 50.904 49.317 15.188 1.00 0.13 A +ATOM 5 CB THR A 19 52.915 47.521 13.637 1.00 0.13 A +ATOM 6 OG1 THR A 19 52.992 46.104 13.665 1.00 0.13 A +ATOM 7 CG2 THR A 19 53.358 48.069 15.002 1.00 0.13 A +ATOM 8 HA THR A 19 50.923 47.107 12.926 1.00 0.13 A +ATOM 9 HB THR A 19 53.588 47.896 12.881 1.00 0.14 A +ATOM 10 HG1 THR A 19 53.378 45.846 14.507 1.00 0.12 A +ATOM 11 1HG2 THR A 19 53.166 49.130 15.042 1.00 0.14 A +ATOM 12 2HG2 THR A 19 54.413 47.892 15.134 1.00 0.13 A +ATOM 13 3HG2 THR A 19 52.807 47.570 15.786 1.00 0.12 A +ATOM 14 N ILE A 20 49.771 47.410 14.891 1.00 0.12 A +ATOM 15 CA ILE A 20 49.010 47.580 16.076 1.00 0.12 A +ATOM 16 C ILE A 20 49.479 46.624 17.158 1.00 0.11 A +ATOM 17 O ILE A 20 49.608 45.428 16.967 1.00 0.10 A +ATOM 18 CB ILE A 20 47.541 47.355 15.789 1.00 0.12 A +ATOM 19 CG1 ILE A 20 47.124 48.242 14.572 1.00 0.13 A +ATOM 20 CG2 ILE A 20 46.684 47.697 17.013 1.00 0.11 A +ATOM 21 CD1 ILE A 20 46.614 47.391 13.409 1.00 0.13 A +ATOM 22 H ILE A 20 49.624 46.623 14.326 1.00 0.12 A +ATOM 23 HA ILE A 20 49.150 48.583 16.451 1.00 0.12 A +ATOM 24 HB ILE A 20 47.395 46.391 15.588 1.00 0.11 A +ATOM 25 1HG1 ILE A 20 46.340 48.920 14.868 1.00 0.13 A +ATOM 26 2HG1 ILE A 20 47.969 48.819 14.228 1.00 0.13 A +ATOM 27 1HG2 ILE A 20 46.783 48.744 17.248 1.00 0.12 A +ATOM 28 2HG2 ILE A 20 47.003 47.102 17.855 1.00 0.10 A +ATOM 29 3HG2 ILE A 20 45.648 47.475 16.790 1.00 0.11 A +ATOM 30 1HD1 ILE A 20 46.287 48.026 12.613 1.00 0.14 A +ATOM 31 2HD1 ILE A 20 45.792 46.811 13.736 1.00 0.13 A +ATOM 32 3HD1 ILE A 20 47.404 46.757 13.049 1.00 0.13 A +ATOM 33 N GLU A 21 49.697 47.189 18.314 1.00 0.10 A +ATOM 34 CA GLU A 21 50.078 46.438 19.494 1.00 0.10 A +ATOM 35 C GLU A 21 48.864 46.222 20.401 1.00 0.09 A +ATOM 36 O GLU A 21 48.211 47.155 20.833 1.00 0.09 A +ATOM 37 CB GLU A 21 51.156 47.156 20.303 1.00 0.10 A +ATOM 38 CG GLU A 21 52.561 46.600 20.010 1.00 0.10 A +ATOM 39 CD GLU A 21 53.641 47.575 20.497 1.00 0.11 A +ATOM 40 OE1 GLU A 21 53.427 48.234 21.507 1.00 0.11 A +ATOM 41 OE2 GLU A 21 54.669 47.650 19.836 1.00 0.12 A +ATOM 42 H GLU A 21 49.566 48.157 18.394 1.00 0.11 A +ATOM 43 HA GLU A 21 50.456 45.474 19.187 1.00 0.09 A +ATOM 44 1HB GLU A 21 51.140 48.204 20.049 1.00 0.11 A +ATOM 45 2HB GLU A 21 50.958 47.051 21.363 1.00 0.10 A +ATOM 46 1HG GLU A 21 52.684 45.657 20.517 1.00 0.10 A +ATOM 47 2HG GLU A 21 52.677 46.451 18.951 1.00 0.10 A +ATOM 48 N ILE A 22 48.608 44.981 20.708 1.00 0.08 A +ATOM 49 CA ILE A 22 47.531 44.605 21.626 1.00 0.07 A +ATOM 50 C ILE A 22 48.175 44.467 22.989 1.00 0.07 A +ATOM 51 O ILE A 22 49.129 43.730 23.172 1.00 0.06 A +ATOM 52 CB ILE A 22 46.798 43.298 21.232 1.00 0.07 A +ATOM 53 CG1 ILE A 22 46.411 43.262 19.744 1.00 0.07 A +ATOM 54 CG2 ILE A 22 45.569 43.084 22.117 1.00 0.06 A +ATOM 55 CD1 ILE A 22 45.253 44.213 19.451 1.00 0.08 A +ATOM 56 H ILE A 22 49.163 44.275 20.317 1.00 0.08 A +ATOM 57 HA ILE A 22 46.807 45.406 21.646 1.00 0.07 A +ATOM 58 HB ILE A 22 47.473 42.481 21.431 1.00 0.06 A +ATOM 59 1HG1 ILE A 22 47.265 43.544 19.149 1.00 0.08 A +ATOM 60 2HG1 ILE A 22 46.117 42.254 19.485 1.00 0.07 A +ATOM 61 1HG2 ILE A 22 44.884 43.906 21.994 1.00 0.06 A +ATOM 62 2HG2 ILE A 22 45.879 43.021 23.150 1.00 0.05 A +ATOM 63 3HG2 ILE A 22 45.081 42.162 21.833 1.00 0.06 A +ATOM 64 1HD1 ILE A 22 44.992 44.141 18.406 1.00 0.09 A +ATOM 65 2HD1 ILE A 22 45.551 45.223 19.679 1.00 0.08 A +ATOM 66 3HD1 ILE A 22 44.396 43.944 20.050 1.00 0.08 A +ATOM 67 N ILE A 23 47.674 45.200 23.936 1.00 0.07 A +ATOM 68 CA ILE A 23 48.214 45.187 25.257 1.00 0.06 A +ATOM 69 C ILE A 23 47.524 44.180 26.133 1.00 0.05 A +ATOM 70 O ILE A 23 46.365 43.887 25.994 1.00 0.05 A +ATOM 71 CB ILE A 23 48.244 46.597 25.858 1.00 0.07 A +ATOM 72 CG1 ILE A 23 48.863 47.564 24.839 1.00 0.08 A +ATOM 73 CG2 ILE A 23 49.061 46.606 27.152 1.00 0.08 A +ATOM 74 CD1 ILE A 23 50.332 47.223 24.576 1.00 0.09 A +ATOM 75 H ILE A 23 46.910 45.780 23.732 1.00 0.07 A +ATOM 76 HA ILE A 23 49.222 44.798 25.223 1.00 0.07 A +ATOM 77 HB ILE A 23 47.234 46.910 26.078 1.00 0.07 A +ATOM 78 1HG1 ILE A 23 48.316 47.493 23.910 1.00 0.08 A +ATOM 79 2HG1 ILE A 23 48.794 48.570 25.212 1.00 0.09 A +ATOM 80 1HG2 ILE A 23 49.214 47.627 27.472 1.00 0.08 A +ATOM 81 2HG2 ILE A 23 50.019 46.141 26.974 1.00 0.08 A +ATOM 82 3HG2 ILE A 23 48.533 46.062 27.919 1.00 0.07 A +ATOM 83 1HD1 ILE A 23 50.386 46.363 23.939 1.00 0.08 A +ATOM 84 2HD1 ILE A 23 50.843 47.022 25.503 1.00 0.09 A +ATOM 85 3HD1 ILE A 23 50.805 48.057 24.086 1.00 0.10 A +ATOM 86 N ALA A 24 48.283 43.611 27.034 1.00 0.05 A +ATOM 87 CA ALA A 24 47.709 42.611 27.878 1.00 0.05 A +ATOM 88 C ALA A 24 46.519 43.065 28.708 1.00 0.04 A +ATOM 89 O ALA A 24 46.580 44.043 29.435 1.00 0.05 A +ATOM 90 CB ALA A 24 48.786 42.193 28.879 1.00 0.05 A +ATOM 91 H ALA A 24 49.223 43.872 27.129 1.00 0.06 A +ATOM 92 HA ALA A 24 47.403 41.760 27.287 1.00 0.04 A +ATOM 93 1HB ALA A 24 49.615 41.763 28.342 1.00 0.05 A +ATOM 94 2HB ALA A 24 48.380 41.462 29.565 1.00 0.05 A +ATOM 95 3HB ALA A 24 49.123 43.058 29.431 1.00 0.06 A +ATOM 96 N PRO A 25 45.399 42.414 28.524 1.00 0.04 A +ATOM 97 CA PRO A 25 44.171 42.792 29.225 1.00 0.04 A +ATOM 98 C PRO A 25 44.198 42.324 30.711 1.00 0.04 A +ATOM 99 O PRO A 25 43.497 42.859 31.546 1.00 0.04 A +ATOM 100 CB PRO A 25 43.034 42.136 28.433 1.00 0.03 A +ATOM 101 CG PRO A 25 43.668 41.077 27.566 1.00 0.03 A +ATOM 102 CD PRO A 25 45.127 41.454 27.409 1.00 0.03 A +ATOM 103 HA PRO A 25 44.056 43.865 29.233 1.00 0.04 A +ATOM 104 1HB PRO A 25 42.321 41.680 29.111 1.00 0.03 A +ATOM 105 2HB PRO A 25 42.532 42.871 27.819 1.00 0.04 A +ATOM 106 1HG PRO A 25 43.596 40.106 28.034 1.00 0.03 A +ATOM 107 2HG PRO A 25 43.187 41.050 26.591 1.00 0.04 A +ATOM 108 1HD PRO A 25 45.757 40.589 27.432 1.00 0.03 A +ATOM 109 2HD PRO A 25 45.251 41.982 26.462 1.00 0.04 A +ATOM 110 N LEU A 26 45.039 41.362 31.023 1.00 0.04 A +ATOM 111 CA LEU A 26 45.258 40.877 32.399 1.00 0.05 A +ATOM 112 C LEU A 26 46.724 40.422 32.577 1.00 0.05 A +ATOM 113 O LEU A 26 47.431 40.153 31.624 1.00 0.05 A +ATOM 114 CB LEU A 26 44.284 39.798 33.045 1.00 0.05 A +ATOM 115 CG LEU A 26 43.438 38.919 32.089 1.00 0.04 A +ATOM 116 CD1 LEU A 26 44.229 38.417 30.898 1.00 0.04 A +ATOM 117 CD2 LEU A 26 42.899 37.696 32.874 1.00 0.05 A +ATOM 118 H LEU A 26 45.575 40.961 30.308 1.00 0.04 A +ATOM 119 HA LEU A 26 45.222 41.745 33.039 1.00 0.05 A +ATOM 120 1HB LEU A 26 44.874 39.134 33.658 1.00 0.05 A +ATOM 121 2HB LEU A 26 43.599 40.324 33.702 1.00 0.05 A +ATOM 122 HG LEU A 26 42.616 39.483 31.733 1.00 0.04 A +ATOM 123 1HD1 LEU A 26 43.679 37.609 30.428 1.00 0.04 A +ATOM 124 2HD1 LEU A 26 45.189 38.057 31.226 1.00 0.05 A +ATOM 125 3HD1 LEU A 26 44.355 39.218 30.192 1.00 0.04 A +ATOM 126 1HD2 LEU A 26 42.000 37.337 32.408 1.00 0.05 A +ATOM 127 2HD2 LEU A 26 42.681 37.971 33.897 1.00 0.06 A +ATOM 128 3HD2 LEU A 26 43.638 36.911 32.862 1.00 0.06 A +ATOM 129 N SER A 27 47.172 40.328 33.834 1.00 0.06 A +ATOM 130 CA SER A 27 48.525 39.860 34.118 1.00 0.07 A +ATOM 131 C SER A 27 48.590 38.363 34.115 1.00 0.07 A +ATOM 132 O SER A 27 47.653 37.682 34.484 1.00 0.07 A +ATOM 133 CB SER A 27 49.037 40.332 35.469 1.00 0.08 A +ATOM 134 OG SER A 27 49.037 41.751 35.525 1.00 0.08 A +ATOM 135 H SER A 27 46.570 40.538 34.578 1.00 0.06 A +ATOM 136 HA SER A 27 49.188 40.230 33.349 1.00 0.07 A +ATOM 137 1HB SER A 27 48.400 39.947 36.248 1.00 0.08 A +ATOM 138 2HB SER A 27 50.042 39.959 35.616 1.00 0.09 A +ATOM 139 HG SER A 27 49.820 42.026 36.012 1.00 0.09 A +ATOM 140 N GLY A 28 49.717 37.836 33.717 1.00 0.08 A +ATOM 141 CA GLY A 28 49.856 36.412 33.714 1.00 0.08 A +ATOM 142 C GLY A 28 50.928 35.974 32.741 1.00 0.08 A +ATOM 143 O GLY A 28 51.862 36.691 32.426 1.00 0.08 A +ATOM 144 H GLY A 28 50.457 38.414 33.433 1.00 0.08 A +ATOM 145 1HA GLY A 28 50.136 36.077 34.702 1.00 0.09 A +ATOM 146 2HA GLY A 28 48.916 35.960 33.435 1.00 0.08 A +ATOM 147 N GLU A 29 50.783 34.763 32.308 1.00 0.08 A +ATOM 148 CA GLU A 29 51.720 34.110 31.417 1.00 0.09 A +ATOM 149 C GLU A 29 51.052 33.780 30.117 1.00 0.08 A +ATOM 150 O GLU A 29 49.942 33.287 30.091 1.00 0.08 A +ATOM 151 CB GLU A 29 52.330 32.838 32.078 1.00 0.10 A +ATOM 152 CG GLU A 29 53.877 32.953 32.241 1.00 0.11 A +ATOM 153 CD GLU A 29 54.571 31.908 31.374 1.00 0.11 A +ATOM 154 OE1 GLU A 29 54.250 30.741 31.546 1.00 0.12 A +ATOM 155 OE2 GLU A 29 55.393 32.287 30.552 1.00 0.11 A +ATOM 156 H GLU A 29 50.004 34.254 32.612 1.00 0.09 A +ATOM 157 HA GLU A 29 52.517 34.799 31.176 1.00 0.09 A +ATOM 158 1HB GLU A 29 51.882 32.714 33.055 1.00 0.10 A +ATOM 159 2HB GLU A 29 52.090 31.966 31.480 1.00 0.10 A +ATOM 160 1HG GLU A 29 54.223 33.932 31.955 1.00 0.10 A +ATOM 161 2HG GLU A 29 54.142 32.778 33.273 1.00 0.11 A +ATOM 162 N ILE A 30 51.718 34.059 29.015 1.00 0.08 A +ATOM 163 CA ILE A 30 51.087 33.766 27.768 1.00 0.07 A +ATOM 164 C ILE A 30 51.099 32.268 27.509 1.00 0.08 A +ATOM 165 O ILE A 30 52.035 31.557 27.813 1.00 0.09 A +ATOM 166 CB ILE A 30 51.692 34.547 26.609 1.00 0.07 A +ATOM 167 CG1 ILE A 30 51.330 36.020 26.804 1.00 0.06 A +ATOM 168 CG2 ILE A 30 51.132 34.032 25.275 1.00 0.07 A +ATOM 169 CD1 ILE A 30 51.972 36.885 25.722 1.00 0.06 A +ATOM 170 H ILE A 30 52.610 34.462 29.048 1.00 0.08 A +ATOM 171 HA ILE A 30 50.039 34.014 27.843 1.00 0.07 A +ATOM 172 HB ILE A 30 52.766 34.433 26.617 1.00 0.07 A +ATOM 173 1HG1 ILE A 30 50.257 36.128 26.758 1.00 0.06 A +ATOM 174 2HG1 ILE A 30 51.680 36.344 27.772 1.00 0.07 A +ATOM 175 1HG2 ILE A 30 50.057 33.973 25.338 1.00 0.06 A +ATOM 176 2HG2 ILE A 30 51.534 33.050 25.070 1.00 0.07 A +ATOM 177 3HG2 ILE A 30 51.411 34.703 24.478 1.00 0.06 A +ATOM 178 1HD1 ILE A 30 51.676 36.525 24.748 1.00 0.06 A +ATOM 179 2HD1 ILE A 30 53.046 36.843 25.814 1.00 0.07 A +ATOM 180 3HD1 ILE A 30 51.642 37.901 25.842 1.00 0.06 A +ATOM 181 N VAL A 31 50.007 31.804 26.952 1.00 0.08 A +ATOM 182 CA VAL A 31 49.820 30.401 26.658 1.00 0.09 A +ATOM 183 C VAL A 31 49.295 30.264 25.218 1.00 0.09 A +ATOM 184 O VAL A 31 48.700 31.177 24.679 1.00 0.08 A +ATOM 185 CB VAL A 31 48.846 29.829 27.687 1.00 0.09 A +ATOM 186 CG1 VAL A 31 48.242 28.510 27.205 1.00 0.10 A +ATOM 187 CG2 VAL A 31 49.548 29.614 29.025 1.00 0.10 A +ATOM 188 H VAL A 31 49.288 32.430 26.726 1.00 0.07 A +ATOM 189 HA VAL A 31 50.766 29.883 26.721 1.00 0.09 A +ATOM 190 HB VAL A 31 48.045 30.541 27.833 1.00 0.09 A +ATOM 191 1HG1 VAL A 31 47.644 28.687 26.323 1.00 0.10 A +ATOM 192 2HG1 VAL A 31 47.614 28.103 27.981 1.00 0.11 A +ATOM 193 3HG1 VAL A 31 49.031 27.814 26.973 1.00 0.11 A +ATOM 194 1HG2 VAL A 31 49.961 30.551 29.368 1.00 0.09 A +ATOM 195 2HG2 VAL A 31 50.338 28.889 28.910 1.00 0.10 A +ATOM 196 3HG2 VAL A 31 48.829 29.253 29.749 1.00 0.10 A +ATOM 197 N ASN A 32 49.517 29.120 24.605 1.00 0.09 A +ATOM 198 CA ASN A 32 49.037 28.878 23.238 1.00 0.10 A +ATOM 199 C ASN A 32 47.549 28.716 23.211 1.00 0.10 A +ATOM 200 O ASN A 32 46.967 28.050 24.047 1.00 0.10 A +ATOM 201 CB ASN A 32 49.563 27.579 22.571 1.00 0.11 A +ATOM 202 CG ASN A 32 51.071 27.562 22.387 1.00 0.11 A +ATOM 203 OD1 ASN A 32 51.680 26.500 22.400 1.00 0.11 A +ATOM 204 ND2 ASN A 32 51.695 28.684 22.193 1.00 0.10 A +ATOM 205 H ASN A 32 49.997 28.406 25.074 1.00 0.10 A +ATOM 206 HA ASN A 32 49.339 29.714 22.626 1.00 0.09 A +ATOM 207 1HB ASN A 32 49.281 26.740 23.179 1.00 0.11 A +ATOM 208 2HB ASN A 32 49.101 27.487 21.623 1.00 0.11 A +ATOM 209 1HD2 ASN A 32 51.189 29.523 22.175 1.00 0.09 A +ATOM 210 2HD2 ASN A 32 52.663 28.692 22.052 1.00 0.10 A +ATOM 211 N ILE A 33 46.921 29.294 22.238 1.00 0.10 A +ATOM 212 CA ILE A 33 45.491 29.170 22.170 1.00 0.10 A +ATOM 213 C ILE A 33 45.147 27.742 21.863 1.00 0.11 A +ATOM 214 O ILE A 33 44.070 27.266 22.185 1.00 0.12 A +ATOM 215 CB ILE A 33 44.833 30.207 21.226 1.00 0.10 A +ATOM 216 CG1 ILE A 33 43.340 30.333 21.601 1.00 0.10 A +ATOM 217 CG2 ILE A 33 44.983 29.790 19.753 1.00 0.10 A +ATOM 218 CD1 ILE A 33 42.789 31.682 21.188 1.00 0.09 A +ATOM 219 H ILE A 33 47.413 29.817 21.571 1.00 0.09 A +ATOM 220 HA ILE A 33 45.087 29.304 23.161 1.00 0.10 A +ATOM 221 HB ILE A 33 45.322 31.162 21.366 1.00 0.09 A +ATOM 222 1HG1 ILE A 33 42.780 29.557 21.112 1.00 0.11 A +ATOM 223 2HG1 ILE A 33 43.218 30.236 22.670 1.00 0.10 A +ATOM 224 1HG2 ILE A 33 44.173 29.135 19.473 1.00 0.11 A +ATOM 225 2HG2 ILE A 33 45.924 29.280 19.614 1.00 0.10 A +ATOM 226 3HG2 ILE A 33 44.961 30.674 19.128 1.00 0.10 A +ATOM 227 1HD1 ILE A 33 42.747 31.748 20.112 1.00 0.10 A +ATOM 228 2HD1 ILE A 33 43.419 32.465 21.581 1.00 0.08 A +ATOM 229 3HD1 ILE A 33 41.799 31.775 21.599 1.00 0.09 A +ATOM 230 N GLU A 34 46.048 27.032 21.271 1.00 0.12 A +ATOM 231 CA GLU A 34 45.754 25.673 20.965 1.00 0.13 A +ATOM 232 C GLU A 34 45.783 24.833 22.210 1.00 0.13 A +ATOM 233 O GLU A 34 45.287 23.721 22.201 1.00 0.14 A +ATOM 234 CB GLU A 34 46.584 25.088 19.807 1.00 0.13 A +ATOM 235 CG GLU A 34 48.023 25.596 19.810 1.00 0.13 A +ATOM 236 CD GLU A 34 48.106 26.983 19.159 1.00 0.12 A +ATOM 237 OE1 GLU A 34 47.335 27.241 18.249 1.00 0.12 A +ATOM 238 OE2 GLU A 34 48.956 27.756 19.566 1.00 0.11 A +ATOM 239 H GLU A 34 46.905 27.437 21.023 1.00 0.11 A +ATOM 240 HA GLU A 34 44.709 25.605 20.699 1.00 0.13 A +ATOM 241 1HB GLU A 34 46.598 24.011 19.897 1.00 0.14 A +ATOM 242 2HB GLU A 34 46.115 25.351 18.870 1.00 0.13 A +ATOM 243 1HG GLU A 34 48.377 25.638 20.819 1.00 0.12 A +ATOM 244 2HG GLU A 34 48.639 24.910 19.247 1.00 0.13 A +ATOM 245 N ASP A 35 46.322 25.341 23.287 1.00 0.13 A +ATOM 246 CA ASP A 35 46.372 24.560 24.500 1.00 0.13 A +ATOM 247 C ASP A 35 45.216 24.829 25.447 1.00 0.13 A +ATOM 248 O ASP A 35 45.229 24.396 26.586 1.00 0.14 A +ATOM 249 CB ASP A 35 47.701 24.694 25.230 1.00 0.13 A +ATOM 250 CG ASP A 35 48.870 24.444 24.279 1.00 0.13 A +ATOM 251 OD1 ASP A 35 48.631 23.898 23.215 1.00 0.13 A +ATOM 252 OD2 ASP A 35 49.988 24.807 24.629 1.00 0.13 A +ATOM 253 H ASP A 35 46.711 26.239 23.263 1.00 0.12 A +ATOM 254 HA ASP A 35 46.220 23.521 24.247 1.00 0.14 A +ATOM 255 1HB ASP A 35 47.779 25.687 25.645 1.00 0.12 A +ATOM 256 2HB ASP A 35 47.736 23.970 26.032 1.00 0.14 A +ATOM 257 N VAL A 36 44.221 25.503 24.981 1.00 0.13 A +ATOM 258 CA VAL A 36 43.039 25.810 25.801 1.00 0.13 A +ATOM 259 C VAL A 36 42.030 24.651 25.721 1.00 0.14 A +ATOM 260 O VAL A 36 41.819 24.076 24.669 1.00 0.15 A +ATOM 261 CB VAL A 36 42.350 27.104 25.340 1.00 0.12 A +ATOM 262 CG1 VAL A 36 40.876 27.140 25.723 1.00 0.12 A +ATOM 263 CG2 VAL A 36 43.056 28.339 25.913 1.00 0.11 A +ATOM 264 H VAL A 36 44.261 25.837 24.060 1.00 0.13 A +ATOM 265 HA VAL A 36 43.347 25.925 26.830 1.00 0.13 A +ATOM 266 HB VAL A 36 42.418 27.153 24.262 1.00 0.12 A +ATOM 267 1HG1 VAL A 36 40.513 28.152 25.637 1.00 0.12 A +ATOM 268 2HG1 VAL A 36 40.762 26.789 26.731 1.00 0.13 A +ATOM 269 3HG1 VAL A 36 40.317 26.503 25.056 1.00 0.13 A +ATOM 270 1HG2 VAL A 36 42.689 29.222 25.408 1.00 0.10 A +ATOM 271 2HG2 VAL A 36 44.120 28.253 25.757 1.00 0.11 A +ATOM 272 3HG2 VAL A 36 42.847 28.418 26.969 1.00 0.11 A +ATOM 273 N PRO A 37 41.556 24.207 26.863 1.00 0.15 A +ATOM 274 CA PRO A 37 40.691 23.029 26.956 1.00 0.16 A +ATOM 275 C PRO A 37 39.301 23.299 26.377 1.00 0.16 A +ATOM 276 O PRO A 37 38.285 22.999 26.981 1.00 0.16 A +ATOM 277 CB PRO A 37 40.585 22.740 28.471 1.00 0.16 A +ATOM 278 CG PRO A 37 41.360 23.779 29.226 1.00 0.15 A +ATOM 279 CD PRO A 37 42.043 24.660 28.210 1.00 0.14 A +ATOM 280 HA PRO A 37 41.132 22.191 26.438 1.00 0.16 A +ATOM 281 1HB PRO A 37 39.551 22.765 28.794 1.00 0.16 A +ATOM 282 2HB PRO A 37 40.989 21.758 28.680 1.00 0.17 A +ATOM 283 1HG PRO A 37 40.699 24.378 29.843 1.00 0.15 A +ATOM 284 2HG PRO A 37 42.105 23.302 29.862 1.00 0.15 A +ATOM 285 1HD PRO A 37 41.841 25.698 28.395 1.00 0.13 A +ATOM 286 2HD PRO A 37 43.120 24.469 28.271 1.00 0.14 A +ATOM 287 N ASP A 38 39.245 23.864 25.218 1.00 0.16 A +ATOM 288 CA ASP A 38 37.962 24.146 24.610 1.00 0.16 A +ATOM 289 C ASP A 38 38.145 24.095 23.103 1.00 0.16 A +ATOM 290 O ASP A 38 38.884 24.871 22.531 1.00 0.15 A +ATOM 291 CB ASP A 38 37.414 25.506 25.059 1.00 0.15 A +ATOM 292 CG ASP A 38 35.978 25.667 24.558 1.00 0.17 A +ATOM 293 OD1 ASP A 38 35.556 24.849 23.757 1.00 0.22 A +ATOM 294 OD2 ASP A 38 35.322 26.601 24.987 1.00 0.18 A +ATOM 295 H ASP A 38 40.072 24.105 24.751 1.00 0.15 A +ATOM 296 HA ASP A 38 37.263 23.373 24.893 1.00 0.17 A +ATOM 297 1HB ASP A 38 37.428 25.561 26.138 1.00 0.15 A +ATOM 298 2HB ASP A 38 38.025 26.294 24.651 1.00 0.14 A +ATOM 299 N VAL A 39 37.501 23.164 22.447 1.00 0.17 A +ATOM 300 CA VAL A 39 37.679 23.064 21.011 1.00 0.17 A +ATOM 301 C VAL A 39 37.250 24.328 20.309 1.00 0.17 A +ATOM 302 O VAL A 39 37.896 24.717 19.352 1.00 0.16 A +ATOM 303 CB VAL A 39 37.057 21.845 20.323 1.00 0.19 A +ATOM 304 CG1 VAL A 39 37.626 20.565 20.939 1.00 0.19 A +ATOM 305 CG2 VAL A 39 35.539 21.871 20.517 1.00 0.19 A +ATOM 306 H VAL A 39 36.919 22.533 22.921 1.00 0.18 A +ATOM 307 HA VAL A 39 38.740 23.044 20.814 1.00 0.17 A +ATOM 308 HB VAL A 39 37.288 21.870 19.268 1.00 0.19 A +ATOM 309 1HG1 VAL A 39 37.023 19.722 20.637 1.00 1.03 A +ATOM 310 2HG1 VAL A 39 37.615 20.649 22.015 1.00 1.02 A +ATOM 311 3HG1 VAL A 39 38.641 20.423 20.598 1.00 1.04 A +ATOM 312 1HG2 VAL A 39 35.095 21.038 19.991 1.00 1.01 A +ATOM 313 2HG2 VAL A 39 35.142 22.796 20.126 1.00 1.02 A +ATOM 314 3HG2 VAL A 39 35.309 21.796 21.569 1.00 1.05 A +ATOM 315 N VAL A 40 36.211 24.997 20.712 1.00 0.17 A +ATOM 316 CA VAL A 40 35.874 26.201 19.968 1.00 0.16 A +ATOM 317 C VAL A 40 36.968 27.239 20.038 1.00 0.15 A +ATOM 318 O VAL A 40 37.196 27.944 19.070 1.00 0.15 A +ATOM 319 CB VAL A 40 34.454 26.799 20.091 1.00 0.17 A +ATOM 320 CG1 VAL A 40 33.446 25.870 19.410 1.00 0.19 A +ATOM 321 CG2 VAL A 40 34.097 26.943 21.575 1.00 0.27 A +ATOM 322 H VAL A 40 35.677 24.686 21.471 1.00 0.17 A +ATOM 323 HA VAL A 40 36.029 25.977 18.924 1.00 0.17 A +ATOM 324 HB VAL A 40 34.429 27.769 19.615 1.00 0.22 A +ATOM 325 1HG1 VAL A 40 32.451 26.274 19.523 1.00 1.06 A +ATOM 326 2HG1 VAL A 40 33.492 24.892 19.866 1.00 0.99 A +ATOM 327 3HG1 VAL A 40 33.684 25.789 18.360 1.00 1.03 A +ATOM 328 1HG2 VAL A 40 33.268 27.622 21.680 1.00 1.06 A +ATOM 329 2HG2 VAL A 40 34.948 27.330 22.116 1.00 1.06 A +ATOM 330 3HG2 VAL A 40 33.824 25.977 21.977 1.00 1.07 A +ATOM 331 N PHE A 41 37.652 27.365 21.090 1.00 0.14 A +ATOM 332 CA PHE A 41 38.695 28.359 21.124 1.00 0.13 A +ATOM 333 C PHE A 41 39.985 27.785 20.503 1.00 0.13 A +ATOM 334 O PHE A 41 40.689 28.436 19.757 1.00 0.13 A +ATOM 335 CB PHE A 41 39.002 28.721 22.577 1.00 0.12 A +ATOM 336 CG PHE A 41 37.992 29.708 23.111 1.00 0.13 A +ATOM 337 CD1 PHE A 41 38.161 31.083 22.855 1.00 0.16 A +ATOM 338 CD2 PHE A 41 36.901 29.264 23.880 1.00 0.16 A +ATOM 339 CE1 PHE A 41 37.241 32.013 23.370 1.00 0.18 A +ATOM 340 CE2 PHE A 41 35.976 30.196 24.392 1.00 0.19 A +ATOM 341 CZ PHE A 41 36.149 31.571 24.138 1.00 0.18 A +ATOM 342 H PHE A 41 37.442 26.821 21.878 1.00 0.15 A +ATOM 343 HA PHE A 41 38.369 29.241 20.595 1.00 0.13 A +ATOM 344 1HB PHE A 41 38.974 27.827 23.178 1.00 0.14 A +ATOM 345 2HB PHE A 41 39.989 29.161 22.643 1.00 0.11 A +ATOM 346 HD1 PHE A 41 38.999 31.422 22.264 1.00 0.20 A +ATOM 347 HD2 PHE A 41 36.770 28.210 24.074 1.00 0.18 A +ATOM 348 HE1 PHE A 41 37.372 33.067 23.174 1.00 0.21 A +ATOM 349 HE2 PHE A 41 35.138 29.857 24.982 1.00 0.23 A +ATOM 350 HZ PHE A 41 35.448 32.287 24.536 1.00 0.21 A +ATOM 351 N ALA A 42 40.298 26.573 20.872 1.00 0.14 A +ATOM 352 CA ALA A 42 41.505 25.895 20.427 1.00 0.14 A +ATOM 353 C ALA A 42 41.474 25.777 18.945 1.00 0.14 A +ATOM 354 O ALA A 42 42.496 25.893 18.288 1.00 0.14 A +ATOM 355 CB ALA A 42 41.653 24.529 21.098 1.00 0.15 A +ATOM 356 H ALA A 42 39.711 26.101 21.497 1.00 0.14 A +ATOM 357 HA ALA A 42 42.362 26.503 20.676 1.00 0.13 A +ATOM 358 1HB ALA A 42 40.920 23.848 20.693 1.00 0.16 A +ATOM 359 2HB ALA A 42 41.501 24.632 22.161 1.00 0.14 A +ATOM 360 3HB ALA A 42 42.644 24.142 20.911 1.00 0.15 A +ATOM 361 N GLU A 43 40.322 25.563 18.389 1.00 0.15 A +ATOM 362 CA GLU A 43 40.269 25.443 16.937 1.00 0.16 A +ATOM 363 C GLU A 43 40.012 26.815 16.290 1.00 0.15 A +ATOM 364 O GLU A 43 39.855 26.951 15.094 1.00 0.16 A +ATOM 365 CB GLU A 43 39.339 24.302 16.419 1.00 0.17 A +ATOM 366 CG GLU A 43 39.837 22.956 16.950 1.00 0.20 A +ATOM 367 CD GLU A 43 38.973 21.830 16.381 1.00 0.57 A +ATOM 368 OE1 GLU A 43 37.963 22.137 15.769 1.00 0.81 A +ATOM 369 OE2 GLU A 43 39.335 20.680 16.566 1.00 0.70 A +ATOM 370 H GLU A 43 39.514 25.479 18.937 1.00 0.15 A +ATOM 371 HA GLU A 43 41.269 25.254 16.578 1.00 0.16 A +ATOM 372 1HB GLU A 43 38.330 24.475 16.765 1.00 0.17 A +ATOM 373 2HB GLU A 43 39.352 24.289 15.339 1.00 0.20 A +ATOM 374 1HG GLU A 43 40.865 22.810 16.650 1.00 0.28 A +ATOM 375 2HG GLU A 43 39.772 22.948 18.028 1.00 0.45 A +ATOM 376 N LYS A 44 40.049 27.819 17.102 1.00 0.14 A +ATOM 377 CA LYS A 44 39.903 29.211 16.692 1.00 0.14 A +ATOM 378 C LYS A 44 38.679 29.477 15.861 1.00 0.14 A +ATOM 379 O LYS A 44 38.703 30.258 14.928 1.00 0.15 A +ATOM 380 CB LYS A 44 41.095 29.763 15.959 1.00 0.13 A +ATOM 381 CG LYS A 44 42.417 29.445 16.648 1.00 0.12 A +ATOM 382 CD LYS A 44 43.351 28.785 15.606 1.00 0.13 A +ATOM 383 CE LYS A 44 44.800 29.237 15.767 1.00 0.12 A +ATOM 384 NZ LYS A 44 45.664 28.038 15.791 1.00 0.13 A +ATOM 385 H LYS A 44 40.185 27.638 18.054 1.00 0.14 A +ATOM 386 HA LYS A 44 39.740 29.810 17.577 1.00 0.13 A +ATOM 387 1HB LYS A 44 41.074 29.338 14.968 1.00 0.14 A +ATOM 388 2HB LYS A 44 40.987 30.821 15.855 1.00 0.13 A +ATOM 389 1HG LYS A 44 42.850 30.365 17.022 1.00 0.12 A +ATOM 390 2HG LYS A 44 42.256 28.766 17.475 1.00 0.13 A +ATOM 391 1HD LYS A 44 43.292 27.717 15.719 1.00 0.14 A +ATOM 392 2HD LYS A 44 43.027 29.043 14.603 1.00 0.13 A +ATOM 393 1HE LYS A 44 45.075 29.860 14.927 1.00 0.12 A +ATOM 394 2HE LYS A 44 44.932 29.789 16.681 1.00 0.11 A +ATOM 395 1HZ LYS A 44 45.079 27.186 15.673 1.00 0.13 A +ATOM 396 2HZ LYS A 44 46.163 27.997 16.701 1.00 0.12 A +ATOM 397 3HZ LYS A 44 46.351 28.095 15.015 1.00 0.13 A +ATOM 398 N ILE A 45 37.616 28.876 16.202 1.00 0.15 A +ATOM 399 CA ILE A 45 36.414 29.103 15.479 1.00 0.16 A +ATOM 400 C ILE A 45 35.921 30.546 15.684 1.00 0.15 A +ATOM 401 O ILE A 45 35.225 31.141 14.885 1.00 0.16 A +ATOM 402 CB ILE A 45 35.422 28.160 16.114 1.00 0.17 A +ATOM 403 CG1 ILE A 45 35.958 26.707 16.089 1.00 0.17 A +ATOM 404 CG2 ILE A 45 34.076 28.235 15.372 1.00 0.17 A +ATOM 405 CD1 ILE A 45 36.604 26.339 14.741 1.00 0.17 A +ATOM 406 H ILE A 45 37.628 28.250 16.957 1.00 0.15 A +ATOM 407 HA ILE A 45 36.546 28.872 14.433 1.00 0.17 A +ATOM 408 HB ILE A 45 35.268 28.459 17.141 1.00 0.18 A +ATOM 409 1HG1 ILE A 45 36.700 26.599 16.859 1.00 0.18 A +ATOM 410 2HG1 ILE A 45 35.140 26.028 16.284 1.00 0.17 A +ATOM 411 1HG2 ILE A 45 33.717 29.251 15.376 1.00 1.03 A +ATOM 412 2HG2 ILE A 45 33.357 27.601 15.868 1.00 1.05 A +ATOM 413 3HG2 ILE A 45 34.195 27.908 14.354 1.00 1.01 A +ATOM 414 1HD1 ILE A 45 37.569 26.813 14.664 1.00 1.04 A +ATOM 415 2HD1 ILE A 45 35.981 26.660 13.926 1.00 1.02 A +ATOM 416 3HD1 ILE A 45 36.731 25.268 14.689 1.00 1.02 A +ATOM 417 N VAL A 46 36.242 31.009 16.821 1.00 0.15 A +ATOM 418 CA VAL A 46 35.869 32.280 17.372 1.00 0.14 A +ATOM 419 C VAL A 46 36.898 33.396 17.005 1.00 0.13 A +ATOM 420 O VAL A 46 36.651 34.568 17.211 1.00 0.13 A +ATOM 421 CB VAL A 46 35.660 31.929 18.858 1.00 0.14 A +ATOM 422 CG1 VAL A 46 34.748 32.980 19.505 1.00 0.46 A +ATOM 423 CG2 VAL A 46 35.032 30.533 19.022 1.00 0.50 A +ATOM 424 H VAL A 46 36.755 30.418 17.407 1.00 0.14 A +ATOM 425 HA VAL A 46 34.960 32.651 16.924 1.00 0.15 A +ATOM 426 HB VAL A 46 36.620 31.949 19.358 1.00 0.32 A +ATOM 427 1HG1 VAL A 46 35.018 33.965 19.151 1.00 1.10 A +ATOM 428 2HG1 VAL A 46 34.861 32.942 20.578 1.00 1.12 A +ATOM 429 3HG1 VAL A 46 33.720 32.773 19.245 1.00 1.25 A +ATOM 430 1HG2 VAL A 46 34.493 30.476 19.958 1.00 1.21 A +ATOM 431 2HG2 VAL A 46 35.810 29.790 19.015 1.00 1.18 A +ATOM 432 3HG2 VAL A 46 34.360 30.349 18.209 1.00 1.14 A +ATOM 433 N GLY A 47 38.003 33.036 16.409 1.00 0.13 A +ATOM 434 CA GLY A 47 39.012 33.980 15.948 1.00 0.12 A +ATOM 435 C GLY A 47 40.353 33.495 16.376 1.00 0.12 A +ATOM 436 O GLY A 47 40.447 32.447 16.967 1.00 0.12 A +ATOM 437 H GLY A 47 38.161 32.080 16.272 1.00 0.13 A +ATOM 438 1HA GLY A 47 38.962 34.065 14.872 1.00 0.13 A +ATOM 439 2HA GLY A 47 38.835 34.947 16.393 1.00 0.12 A +ATOM 440 N ASP A 48 41.403 34.243 16.140 1.00 0.11 A +ATOM 441 CA ASP A 48 42.697 33.751 16.575 1.00 0.10 A +ATOM 442 C ASP A 48 43.373 34.676 17.581 1.00 0.09 A +ATOM 443 O ASP A 48 43.132 35.867 17.601 1.00 0.09 A +ATOM 444 CB ASP A 48 43.642 33.605 15.350 1.00 0.11 A +ATOM 445 CG ASP A 48 44.837 32.697 15.644 1.00 0.11 A +ATOM 446 OD1 ASP A 48 44.904 32.143 16.729 1.00 0.10 A +ATOM 447 OD2 ASP A 48 45.672 32.570 14.754 1.00 0.11 A +ATOM 448 H ASP A 48 41.311 35.116 15.704 1.00 0.11 A +ATOM 449 HA ASP A 48 42.574 32.788 17.049 1.00 0.11 A +ATOM 450 1HB ASP A 48 43.085 33.193 14.523 1.00 0.12 A +ATOM 451 2HB ASP A 48 44.005 34.584 15.079 1.00 0.10 A +ATOM 452 N GLY A 49 44.266 34.138 18.405 1.00 0.09 A +ATOM 453 CA GLY A 49 44.957 35.025 19.324 1.00 0.08 A +ATOM 454 C GLY A 49 45.805 34.231 20.330 1.00 0.07 A +ATOM 455 O GLY A 49 46.455 33.274 19.966 1.00 0.08 A +ATOM 456 H GLY A 49 44.471 33.181 18.376 1.00 0.09 A +ATOM 457 1HA GLY A 49 45.594 35.688 18.756 1.00 0.08 A +ATOM 458 2HA GLY A 49 44.226 35.605 19.867 1.00 0.07 A +ATOM 459 N ILE A 50 45.790 34.621 21.606 1.00 0.07 A +ATOM 460 CA ILE A 50 46.543 33.907 22.623 1.00 0.07 A +ATOM 461 C ILE A 50 45.647 33.721 23.855 1.00 0.06 A +ATOM 462 O ILE A 50 44.552 34.244 23.930 1.00 0.06 A +ATOM 463 CB ILE A 50 47.825 34.652 23.072 1.00 0.06 A +ATOM 464 CG1 ILE A 50 47.564 36.120 23.466 1.00 0.05 A +ATOM 465 CG2 ILE A 50 48.894 34.624 21.973 1.00 0.06 A +ATOM 466 CD1 ILE A 50 47.049 36.234 24.902 1.00 0.05 A +ATOM 467 H ILE A 50 45.247 35.392 21.869 1.00 0.06 A +ATOM 468 HA ILE A 50 46.827 32.943 22.227 1.00 0.07 A +ATOM 469 HB ILE A 50 48.228 34.126 23.922 1.00 0.06 A +ATOM 470 1HG1 ILE A 50 48.488 36.677 23.395 1.00 0.05 A +ATOM 471 2HG1 ILE A 50 46.847 36.541 22.791 1.00 0.05 A +ATOM 472 1HG2 ILE A 50 48.474 34.972 21.044 1.00 0.06 A +ATOM 473 2HG2 ILE A 50 49.264 33.618 21.852 1.00 0.07 A +ATOM 474 3HG2 ILE A 50 49.713 35.272 22.262 1.00 0.06 A +ATOM 475 1HD1 ILE A 50 47.187 37.248 25.253 1.00 0.04 A +ATOM 476 2HD1 ILE A 50 47.589 35.559 25.545 1.00 0.05 A +ATOM 477 3HD1 ILE A 50 46.014 35.992 24.921 1.00 0.05 A +ATOM 478 N ALA A 51 46.158 33.007 24.820 1.00 0.07 A +ATOM 479 CA ALA A 51 45.521 32.783 26.117 1.00 0.07 A +ATOM 480 C ALA A 51 46.471 33.296 27.223 1.00 0.07 A +ATOM 481 O ALA A 51 47.667 33.406 27.014 1.00 0.07 A +ATOM 482 CB ALA A 51 45.306 31.291 26.329 1.00 0.08 A +ATOM 483 H ALA A 51 47.042 32.612 24.677 1.00 0.07 A +ATOM 484 HA ALA A 51 44.567 33.291 26.142 1.00 0.07 A +ATOM 485 1HB ALA A 51 44.657 30.908 25.556 1.00 0.08 A +ATOM 486 2HB ALA A 51 44.851 31.127 27.294 1.00 0.08 A +ATOM 487 3HB ALA A 51 46.256 30.781 26.287 1.00 0.08 A +ATOM 488 N ILE A 52 45.945 33.590 28.395 1.00 0.06 A +ATOM 489 CA ILE A 52 46.733 34.039 29.523 1.00 0.07 A +ATOM 490 C ILE A 52 46.347 33.293 30.788 1.00 0.07 A +ATOM 491 O ILE A 52 45.196 33.254 31.169 1.00 0.07 A +ATOM 492 CB ILE A 52 46.555 35.520 29.810 1.00 0.06 A +ATOM 493 CG1 ILE A 52 47.171 36.333 28.659 1.00 0.05 A +ATOM 494 CG2 ILE A 52 47.243 35.906 31.130 1.00 0.06 A +ATOM 495 CD1 ILE A 52 46.589 37.750 28.622 1.00 0.04 A +ATOM 496 H ILE A 52 44.978 33.490 28.515 1.00 0.07 A +ATOM 497 HA ILE A 52 47.774 33.850 29.314 1.00 0.07 A +ATOM 498 HB ILE A 52 45.501 35.744 29.882 1.00 0.05 A +ATOM 499 1HG1 ILE A 52 48.240 36.394 28.799 1.00 0.05 A +ATOM 500 2HG1 ILE A 52 46.961 35.842 27.725 1.00 0.05 A +ATOM 501 1HG2 ILE A 52 47.402 36.974 31.157 1.00 0.06 A +ATOM 502 2HG2 ILE A 52 48.192 35.397 31.205 1.00 0.07 A +ATOM 503 3HG2 ILE A 52 46.614 35.616 31.959 1.00 0.06 A +ATOM 504 1HD1 ILE A 52 47.020 38.289 27.790 1.00 0.04 A +ATOM 505 2HD1 ILE A 52 46.822 38.264 29.542 1.00 0.04 A +ATOM 506 3HD1 ILE A 52 45.517 37.698 28.497 1.00 0.04 A +ATOM 507 N LYS A 53 47.325 32.753 31.468 1.00 0.08 A +ATOM 508 CA LYS A 53 47.073 32.119 32.746 1.00 0.09 A +ATOM 509 C LYS A 53 47.162 33.312 33.700 1.00 0.09 A +ATOM 510 O LYS A 53 48.207 33.909 33.825 1.00 0.09 A +ATOM 511 CB LYS A 53 48.064 31.002 33.081 1.00 0.10 A +ATOM 512 CG LYS A 53 47.373 29.772 33.749 1.00 0.11 A +ATOM 513 CD LYS A 53 47.317 29.902 35.288 1.00 0.12 A +ATOM 514 CE LYS A 53 46.424 28.781 35.871 1.00 0.13 A +ATOM 515 NZ LYS A 53 46.079 29.045 37.304 1.00 0.13 A +ATOM 516 H LYS A 53 48.240 32.798 31.122 1.00 0.08 A +ATOM 517 HA LYS A 53 46.078 31.699 32.728 1.00 0.09 A +ATOM 518 1HB LYS A 53 48.539 30.678 32.165 1.00 0.10 A +ATOM 519 2HB LYS A 53 48.824 31.383 33.750 1.00 0.10 A +ATOM 520 1HG LYS A 53 46.373 29.665 33.374 1.00 0.11 A +ATOM 521 2HG LYS A 53 47.934 28.883 33.498 1.00 0.12 A +ATOM 522 1HD LYS A 53 48.315 29.805 35.689 1.00 0.12 A +ATOM 523 2HD LYS A 53 46.909 30.862 35.557 1.00 0.11 A +ATOM 524 1HE LYS A 53 45.510 28.720 35.302 1.00 0.12 A +ATOM 525 2HE LYS A 53 46.948 27.840 35.803 1.00 0.13 A +ATOM 526 1HZ LYS A 53 46.485 29.950 37.606 1.00 0.13 A +ATOM 527 2HZ LYS A 53 46.460 28.276 37.897 1.00 0.14 A +ATOM 528 3HZ LYS A 53 45.044 29.076 37.410 1.00 0.13 A +ATOM 529 N PRO A 54 46.049 33.734 34.243 1.00 0.09 A +ATOM 530 CA PRO A 54 45.940 34.975 35.019 1.00 0.08 A +ATOM 531 C PRO A 54 46.634 34.889 36.403 1.00 0.09 A +ATOM 532 O PRO A 54 46.687 33.848 37.022 1.00 0.10 A +ATOM 533 CB PRO A 54 44.419 35.156 35.247 1.00 0.08 A +ATOM 534 CG PRO A 54 43.711 33.998 34.631 1.00 0.08 A +ATOM 535 CD PRO A 54 44.762 32.985 34.242 1.00 0.09 A +ATOM 536 HA PRO A 54 46.345 35.808 34.463 1.00 0.08 A +ATOM 537 1HB PRO A 54 44.201 35.199 36.311 1.00 0.08 A +ATOM 538 2HB PRO A 54 44.090 36.072 34.795 1.00 0.07 A +ATOM 539 1HG PRO A 54 43.032 33.571 35.345 1.00 0.09 A +ATOM 540 2HG PRO A 54 43.164 34.307 33.751 1.00 0.08 A +ATOM 541 1HD PRO A 54 44.801 32.176 34.973 1.00 0.10 A +ATOM 542 2HD PRO A 54 44.540 32.593 33.272 1.00 0.09 A +ATOM 543 N THR A 55 47.121 36.009 36.890 1.00 0.09 A +ATOM 544 CA THR A 55 47.759 36.093 38.212 1.00 0.10 A +ATOM 545 C THR A 55 47.322 37.366 38.926 1.00 0.10 A +ATOM 546 O THR A 55 47.803 37.649 40.005 1.00 0.11 A +ATOM 547 CB THR A 55 49.294 36.242 38.145 1.00 0.11 A +ATOM 548 OG1 THR A 55 49.622 37.403 37.398 1.00 0.10 A +ATOM 549 CG2 THR A 55 49.937 35.013 37.502 1.00 0.11 A +ATOM 550 H THR A 55 47.044 36.828 36.360 1.00 0.08 A +ATOM 551 HA THR A 55 47.527 35.193 38.763 1.00 0.11 A +ATOM 552 HB THR A 55 49.684 36.346 39.148 1.00 0.11 A +ATOM 553 HG1 THR A 55 50.127 37.988 37.968 1.00 0.10 A +ATOM 554 1HG2 THR A 55 49.428 34.772 36.583 1.00 0.10 A +ATOM 555 2HG2 THR A 55 49.873 34.178 38.183 1.00 0.12 A +ATOM 556 3HG2 THR A 55 50.977 35.225 37.294 1.00 0.11 A +ATOM 557 N GLY A 56 46.458 38.162 38.327 1.00 0.09 A +ATOM 558 CA GLY A 56 46.046 39.418 38.947 1.00 0.09 A +ATOM 559 C GLY A 56 44.604 39.428 39.471 1.00 0.09 A +ATOM 560 O GLY A 56 44.100 38.441 39.966 1.00 0.09 A +ATOM 561 H GLY A 56 46.084 37.908 37.458 1.00 0.08 A +ATOM 562 1HA GLY A 56 46.711 39.621 39.772 1.00 0.10 A +ATOM 563 2HA GLY A 56 46.136 40.202 38.211 1.00 0.09 A +ATOM 564 N ASN A 57 43.945 40.588 39.356 1.00 0.08 A +ATOM 565 CA ASN A 57 42.577 40.750 39.822 1.00 0.08 A +ATOM 566 C ASN A 57 41.778 41.630 38.920 1.00 0.08 A +ATOM 567 O ASN A 57 40.710 42.075 39.306 1.00 0.08 A +ATOM 568 CB ASN A 57 42.521 41.365 41.224 1.00 0.09 A +ATOM 569 CG ASN A 57 43.170 42.748 41.224 1.00 0.09 A +ATOM 570 OD1 ASN A 57 42.697 43.664 40.576 1.00 0.09 A +ATOM 571 ND2 ASN A 57 44.248 42.933 41.939 1.00 0.10 A +ATOM 572 H ASN A 57 44.393 41.353 38.938 1.00 0.08 A +ATOM 573 HA ASN A 57 42.099 39.783 39.846 1.00 0.09 A +ATOM 574 1HB ASN A 57 41.491 41.451 41.535 1.00 0.09 A +ATOM 575 2HB ASN A 57 43.050 40.725 41.914 1.00 0.10 A +ATOM 576 N LYS A 58 42.221 41.917 37.734 1.00 0.07 A +ATOM 577 CA LYS A 58 41.372 42.734 36.950 1.00 0.06 A +ATOM 578 C LYS A 58 41.628 42.600 35.448 1.00 0.05 A +ATOM 579 O LYS A 58 42.701 42.244 35.001 1.00 0.05 A +ATOM 580 CB LYS A 58 41.517 44.141 37.443 1.00 0.07 A +ATOM 581 CG LYS A 58 42.825 44.723 36.916 1.00 0.07 A +ATOM 582 CD LYS A 58 43.121 46.093 37.579 1.00 0.08 A +ATOM 583 CE LYS A 58 44.587 46.176 38.062 1.00 0.09 A +ATOM 584 NZ LYS A 58 45.416 46.936 37.087 1.00 0.09 A +ATOM 585 H LYS A 58 43.082 41.583 37.409 1.00 0.07 A +ATOM 586 HA LYS A 58 40.347 42.409 37.058 1.00 0.06 A +ATOM 587 1HB LYS A 58 40.687 44.734 37.085 1.00 0.07 A +ATOM 588 2HB LYS A 58 41.526 44.149 38.521 1.00 0.07 A +ATOM 589 1HG LYS A 58 43.614 44.021 37.118 1.00 0.07 A +ATOM 590 2HG LYS A 58 42.743 44.859 35.847 1.00 0.06 A +ATOM 591 1HD LYS A 58 42.941 46.880 36.859 1.00 0.08 A +ATOM 592 2HD LYS A 58 42.462 46.242 38.426 1.00 0.08 A +ATOM 593 1HE LYS A 58 44.619 46.679 39.012 1.00 0.09 A +ATOM 594 2HE LYS A 58 45.003 45.188 38.179 1.00 0.08 A +ATOM 595 1HZ LYS A 58 45.473 46.412 36.191 1.00 0.08 A +ATOM 596 2HZ LYS A 58 46.372 47.056 37.480 1.00 0.09 A +ATOM 597 3HZ LYS A 58 44.989 47.868 36.918 1.00 0.09 A +ATOM 598 N MET A 59 40.589 42.903 34.674 1.00 0.05 A +ATOM 599 CA MET A 59 40.652 42.860 33.238 1.00 0.04 A +ATOM 600 C MET A 59 40.472 44.289 32.682 1.00 0.05 A +ATOM 601 O MET A 59 39.477 44.941 32.942 1.00 0.05 A +ATOM 602 CB MET A 59 39.550 41.917 32.785 1.00 0.04 A +ATOM 603 CG MET A 59 40.023 40.839 31.827 1.00 0.04 A +ATOM 604 SD MET A 59 38.785 39.504 31.625 1.00 0.05 A +ATOM 605 CE MET A 59 37.878 39.625 33.193 1.00 0.06 A +ATOM 606 H MET A 59 39.758 43.201 35.096 1.00 0.05 A +ATOM 607 HA MET A 59 41.615 42.490 32.918 1.00 0.04 A +ATOM 608 1HB MET A 59 39.176 41.480 33.665 1.00 0.05 A +ATOM 609 2HB MET A 59 38.757 42.485 32.314 1.00 0.05 A +ATOM 610 1HG MET A 59 40.204 41.289 30.863 1.00 0.04 A +ATOM 611 2HG MET A 59 40.924 40.429 32.204 1.00 0.04 A +ATOM 612 1HE MET A 59 37.336 40.559 33.217 1.00 0.05 A +ATOM 613 2HE MET A 59 38.568 39.578 34.019 1.00 0.06 A +ATOM 614 3HE MET A 59 37.185 38.811 33.277 1.00 0.06 A +ATOM 615 N VAL A 60 41.451 44.782 31.927 1.00 0.05 A +ATOM 616 CA VAL A 60 41.380 46.121 31.378 1.00 0.05 A +ATOM 617 C VAL A 60 41.289 46.084 29.877 1.00 0.05 A +ATOM 618 O VAL A 60 41.393 45.055 29.237 1.00 0.05 A +ATOM 619 CB VAL A 60 42.591 46.937 31.700 1.00 0.06 A +ATOM 620 CG1 VAL A 60 42.961 46.748 33.170 1.00 0.06 A +ATOM 621 CG2 VAL A 60 43.758 46.432 30.833 1.00 0.06 A +ATOM 622 H VAL A 60 42.244 44.234 31.751 1.00 0.04 A +ATOM 623 HA VAL A 60 40.511 46.616 31.784 1.00 0.06 A +ATOM 624 HB VAL A 60 42.401 47.968 31.497 1.00 0.07 A +ATOM 625 1HG1 VAL A 60 42.129 47.025 33.794 1.00 0.06 A +ATOM 626 2HG1 VAL A 60 43.815 47.366 33.406 1.00 0.07 A +ATOM 627 3HG1 VAL A 60 43.212 45.712 33.340 1.00 0.06 A +ATOM 628 1HG2 VAL A 60 43.697 46.875 29.847 1.00 0.06 A +ATOM 629 2HG2 VAL A 60 43.686 45.361 30.747 1.00 0.05 A +ATOM 630 3HG2 VAL A 60 44.699 46.686 31.284 1.00 0.06 A +ATOM 631 N ALA A 61 41.112 47.242 29.340 1.00 0.06 A +ATOM 632 CA ALA A 61 41.017 47.412 27.883 1.00 0.07 A +ATOM 633 C ALA A 61 42.345 47.121 27.252 1.00 0.06 A +ATOM 634 O ALA A 61 43.335 47.704 27.655 1.00 0.07 A +ATOM 635 CB ALA A 61 40.618 48.853 27.559 1.00 0.08 A +ATOM 636 H ALA A 61 41.018 48.030 29.915 1.00 0.07 A +ATOM 637 HA ALA A 61 40.273 46.736 27.490 1.00 0.06 A +ATOM 638 1HB ALA A 61 40.560 48.978 26.488 1.00 0.08 A +ATOM 639 2HB ALA A 61 41.357 49.530 27.961 1.00 0.08 A +ATOM 640 3HB ALA A 61 39.655 49.067 27.999 1.00 0.08 A +ATOM 641 N PRO A 62 42.432 46.240 26.269 1.00 0.06 A +ATOM 642 CA PRO A 62 43.755 45.976 25.683 1.00 0.06 A +ATOM 643 C PRO A 62 44.066 46.999 24.574 1.00 0.07 A +ATOM 644 O PRO A 62 45.111 46.948 23.959 1.00 0.07 A +ATOM 645 CB PRO A 62 43.679 44.581 25.038 1.00 0.05 A +ATOM 646 CG PRO A 62 42.193 44.301 24.871 1.00 0.06 A +ATOM 647 CD PRO A 62 41.397 45.423 25.597 1.00 0.06 A +ATOM 648 HA PRO A 62 44.512 45.990 26.452 1.00 0.06 A +ATOM 649 1HB PRO A 62 44.184 44.567 24.081 1.00 0.06 A +ATOM 650 2HB PRO A 62 44.114 43.845 25.692 1.00 0.05 A +ATOM 651 1HG PRO A 62 41.935 44.287 23.817 1.00 0.06 A +ATOM 652 2HG PRO A 62 41.944 43.342 25.311 1.00 0.05 A +ATOM 653 1HD PRO A 62 40.860 46.022 24.876 1.00 0.07 A +ATOM 654 2HD PRO A 62 40.719 44.991 26.313 1.00 0.06 A +ATOM 655 N VAL A 63 43.138 47.896 24.302 1.00 0.08 A +ATOM 656 CA VAL A 63 43.319 48.897 23.230 1.00 0.09 A +ATOM 657 C VAL A 63 42.415 50.097 23.442 1.00 0.10 A +ATOM 658 O VAL A 63 41.448 50.042 24.178 1.00 0.10 A +ATOM 659 CB VAL A 63 43.003 48.369 21.817 1.00 0.09 A +ATOM 660 CG1 VAL A 63 43.818 47.114 21.503 1.00 0.09 A +ATOM 661 CG2 VAL A 63 41.508 48.055 21.709 1.00 0.09 A +ATOM 662 H VAL A 63 42.306 47.899 24.820 1.00 0.08 A +ATOM 663 HA VAL A 63 44.347 49.230 23.247 1.00 0.09 A +ATOM 664 HB VAL A 63 43.252 49.135 21.096 1.00 0.10 A +ATOM 665 1HG1 VAL A 63 43.698 46.865 20.457 1.00 0.09 A +ATOM 666 2HG1 VAL A 63 43.466 46.294 22.109 1.00 0.08 A +ATOM 667 3HG1 VAL A 63 44.860 47.299 21.707 1.00 0.09 A +ATOM 668 1HG2 VAL A 63 40.964 48.975 21.585 1.00 0.10 A +ATOM 669 2HG2 VAL A 63 41.174 47.560 22.606 1.00 0.09 A +ATOM 670 3HG2 VAL A 63 41.330 47.414 20.867 1.00 0.09 A +ATOM 671 N ASP A 64 42.708 51.169 22.735 1.00 0.11 A +ATOM 672 CA ASP A 64 41.847 52.343 22.767 1.00 0.12 A +ATOM 673 C ASP A 64 40.735 51.996 21.791 1.00 0.12 A +ATOM 674 O ASP A 64 40.979 51.554 20.685 1.00 0.12 A +ATOM 675 CB ASP A 64 42.570 53.649 22.472 1.00 0.13 A +ATOM 676 CG ASP A 64 43.757 53.886 23.407 1.00 0.13 A +ATOM 677 OD1 ASP A 64 43.758 53.367 24.508 1.00 0.12 A +ATOM 678 OD2 ASP A 64 44.659 54.594 22.986 1.00 0.13 A +ATOM 679 H ASP A 64 43.494 51.166 22.150 1.00 0.11 A +ATOM 680 HA ASP A 64 41.407 52.414 23.751 1.00 0.11 A +ATOM 681 1HB ASP A 64 42.936 53.621 21.457 1.00 0.13 A +ATOM 682 2HB ASP A 64 41.871 54.468 22.570 1.00 0.13 A +ATOM 683 N GLY A 65 39.517 52.108 22.234 1.00 0.12 A +ATOM 684 CA GLY A 65 38.385 51.714 21.424 1.00 0.12 A +ATOM 685 C GLY A 65 37.103 51.805 22.216 1.00 0.12 A +ATOM 686 O GLY A 65 37.014 52.544 23.179 1.00 0.12 A +ATOM 687 H GLY A 65 39.363 52.439 23.143 1.00 0.12 A +ATOM 688 1HA GLY A 65 38.305 52.376 20.575 1.00 0.13 A +ATOM 689 2HA GLY A 65 38.529 50.702 21.078 1.00 0.12 A +ATOM 690 N THR A 66 36.090 51.081 21.795 1.00 0.13 A +ATOM 691 CA THR A 66 34.809 51.167 22.473 1.00 0.13 A +ATOM 692 C THR A 66 34.346 49.805 22.951 1.00 0.12 A +ATOM 693 O THR A 66 34.398 48.843 22.209 1.00 0.12 A +ATOM 694 CB THR A 66 33.791 51.680 21.429 1.00 0.14 A +ATOM 695 OG1 THR A 66 34.241 52.927 20.930 1.00 0.15 A +ATOM 696 CG2 THR A 66 32.403 51.847 22.051 1.00 0.14 A +ATOM 697 H THR A 66 36.197 50.502 21.011 1.00 0.13 A +ATOM 698 HA THR A 66 34.872 51.855 23.303 1.00 0.13 A +ATOM 699 HB THR A 66 33.729 50.973 20.614 1.00 0.14 A +ATOM 700 HG1 THR A 66 34.729 52.761 20.121 1.00 0.15 A +ATOM 701 1HG2 THR A 66 31.764 52.379 21.359 1.00 0.15 A +ATOM 702 2HG2 THR A 66 32.482 52.406 22.970 1.00 0.14 A +ATOM 703 3HG2 THR A 66 31.980 50.874 22.253 1.00 0.14 A +ATOM 704 N ILE A 67 33.865 49.698 24.170 1.00 0.12 A +ATOM 705 CA ILE A 67 33.400 48.379 24.603 1.00 0.11 A +ATOM 706 C ILE A 67 32.165 48.060 23.817 1.00 0.12 A +ATOM 707 O ILE A 67 31.323 48.910 23.603 1.00 0.13 A +ATOM 708 CB ILE A 67 32.975 48.289 26.069 1.00 0.10 A +ATOM 709 CG1 ILE A 67 34.148 48.553 27.064 1.00 0.10 A +ATOM 710 CG2 ILE A 67 32.332 46.912 26.330 1.00 0.10 A +ATOM 711 CD1 ILE A 67 35.526 48.301 26.445 1.00 0.09 A +ATOM 712 H ILE A 67 33.816 50.472 24.768 1.00 0.12 A +ATOM 713 HA ILE A 67 34.200 47.673 24.444 1.00 0.10 A +ATOM 714 HB ILE A 67 32.209 49.040 26.234 1.00 0.11 A +ATOM 715 1HG1 ILE A 67 34.106 49.579 27.390 1.00 0.10 A +ATOM 716 2HG1 ILE A 67 34.032 47.912 27.926 1.00 0.09 A +ATOM 717 1HG2 ILE A 67 31.309 46.923 25.975 1.00 0.11 A +ATOM 718 2HG2 ILE A 67 32.340 46.701 27.386 1.00 0.10 A +ATOM 719 3HG2 ILE A 67 32.881 46.147 25.802 1.00 0.10 A +ATOM 720 1HD1 ILE A 67 35.590 47.283 26.093 1.00 0.09 A +ATOM 721 2HD1 ILE A 67 36.287 48.466 27.190 1.00 0.09 A +ATOM 722 3HD1 ILE A 67 35.677 48.984 25.623 1.00 0.10 A +ATOM 723 N GLY A 68 32.043 46.847 23.422 1.00 0.12 A +ATOM 724 CA GLY A 68 30.906 46.409 22.664 1.00 0.13 A +ATOM 725 C GLY A 68 29.880 45.657 23.465 1.00 0.13 A +ATOM 726 O GLY A 68 28.741 46.063 23.598 1.00 0.13 A +ATOM 727 H GLY A 68 32.747 46.200 23.638 1.00 0.11 A +ATOM 728 1HA GLY A 68 30.432 47.277 22.231 1.00 0.13 A +ATOM 729 2HA GLY A 68 31.253 45.757 21.876 1.00 0.13 A +ATOM 730 N LYS A 69 30.264 44.542 23.959 1.00 0.12 A +ATOM 731 CA LYS A 69 29.359 43.724 24.698 1.00 0.12 A +ATOM 732 C LYS A 69 30.026 43.072 25.879 1.00 0.11 A +ATOM 733 O LYS A 69 31.116 42.569 25.821 1.00 0.11 A +ATOM 734 CB LYS A 69 28.559 42.766 23.808 1.00 0.13 A +ATOM 735 CG LYS A 69 27.458 42.034 24.639 1.00 0.13 A +ATOM 736 CD LYS A 69 27.688 40.514 24.625 1.00 1.43 A +ATOM 737 CE LYS A 69 26.566 39.820 25.402 1.00 1.48 A +ATOM 738 NZ LYS A 69 25.251 40.133 24.770 1.00 2.16 A +ATOM 739 H LYS A 69 31.188 44.246 23.820 1.00 0.11 A +ATOM 740 HA LYS A 69 28.666 44.365 25.225 1.00 0.12 A +ATOM 741 1HB LYS A 69 28.096 43.333 23.010 1.00 0.15 A +ATOM 742 2HB LYS A 69 29.237 42.046 23.381 1.00 0.17 A +ATOM 743 1HG LYS A 69 27.472 42.375 25.661 1.00 1.01 A +ATOM 744 2HG LYS A 69 26.482 42.244 24.220 1.00 0.97 A +ATOM 745 1HD LYS A 69 27.697 40.156 23.607 1.00 2.12 A +ATOM 746 2HD LYS A 69 28.635 40.290 25.092 1.00 2.13 A +ATOM 747 1HE LYS A 69 26.727 38.753 25.389 1.00 1.66 A +ATOM 748 2HE LYS A 69 26.567 40.172 26.423 1.00 1.84 A +ATOM 749 1HZ LYS A 69 24.664 39.276 24.746 1.00 2.66 A +ATOM 750 2HZ LYS A 69 25.404 40.478 23.800 1.00 2.64 A +ATOM 751 3HZ LYS A 69 24.766 40.866 25.326 1.00 2.46 A +ATOM 752 N ILE A 70 29.287 43.116 26.978 1.00 0.11 A +ATOM 753 CA ILE A 70 29.698 42.559 28.238 1.00 0.11 A +ATOM 754 C ILE A 70 28.705 41.448 28.535 1.00 0.11 A +ATOM 755 O ILE A 70 27.504 41.651 28.511 1.00 0.12 A +ATOM 756 CB ILE A 70 29.740 43.624 29.331 1.00 0.10 A +ATOM 757 CG1 ILE A 70 30.772 44.689 28.924 1.00 0.10 A +ATOM 758 CG2 ILE A 70 30.139 42.986 30.662 1.00 0.10 A +ATOM 759 CD1 ILE A 70 30.833 45.831 29.941 1.00 0.10 A +ATOM 760 H ILE A 70 28.392 43.511 26.920 1.00 0.12 A +ATOM 761 HA ILE A 70 30.683 42.129 28.129 1.00 0.10 A +ATOM 762 HB ILE A 70 28.766 44.080 29.429 1.00 0.11 A +ATOM 763 1HG1 ILE A 70 31.744 44.229 28.854 1.00 0.09 A +ATOM 764 2HG1 ILE A 70 30.505 45.088 27.964 1.00 0.11 A +ATOM 765 1HG2 ILE A 70 30.072 43.724 31.447 1.00 0.09 A +ATOM 766 2HG2 ILE A 70 31.152 42.620 30.596 1.00 0.09 A +ATOM 767 3HG2 ILE A 70 29.473 42.166 30.884 1.00 0.10 A +ATOM 768 1HD1 ILE A 70 31.642 46.498 29.674 1.00 0.09 A +ATOM 769 2HD1 ILE A 70 31.010 45.432 30.927 1.00 0.09 A +ATOM 770 3HD1 ILE A 70 29.902 46.378 29.932 1.00 0.10 A +ATOM 771 N PHE A 71 29.203 40.266 28.772 1.00 0.11 A +ATOM 772 CA PHE A 71 28.329 39.132 29.053 1.00 0.12 A +ATOM 773 C PHE A 71 27.553 39.433 30.351 1.00 0.12 A +ATOM 774 O PHE A 71 28.035 40.082 31.258 1.00 0.11 A +ATOM 775 CB PHE A 71 29.169 37.845 29.165 1.00 0.12 A +ATOM 776 CG PHE A 71 29.326 37.209 27.797 1.00 0.12 A +ATOM 777 CD1 PHE A 71 29.833 37.965 26.723 1.00 0.14 A +ATOM 778 CD2 PHE A 71 28.957 35.863 27.596 1.00 0.18 A +ATOM 779 CE1 PHE A 71 29.972 37.377 25.450 1.00 0.15 A +ATOM 780 CE2 PHE A 71 29.097 35.276 26.324 1.00 0.21 A +ATOM 781 CZ PHE A 71 29.604 36.033 25.252 1.00 0.16 A +ATOM 782 H PHE A 71 30.173 40.135 28.757 1.00 0.10 A +ATOM 783 HA PHE A 71 27.613 39.025 28.252 1.00 0.13 A +ATOM 784 1HB PHE A 71 30.144 38.089 29.560 1.00 0.11 A +ATOM 785 2HB PHE A 71 28.677 37.150 29.831 1.00 0.12 A +ATOM 786 HD1 PHE A 71 30.117 38.996 26.875 1.00 0.19 A +ATOM 787 HD2 PHE A 71 28.567 35.282 28.417 1.00 0.24 A +ATOM 788 HE1 PHE A 71 30.358 37.957 24.627 1.00 0.18 A +ATOM 789 HE2 PHE A 71 28.815 34.245 26.172 1.00 0.28 A +ATOM 790 HZ PHE A 71 29.711 35.583 24.276 1.00 0.18 A +ATOM 791 N GLU A 72 26.340 38.977 30.395 1.00 0.13 A +ATOM 792 CA GLU A 72 25.439 39.189 31.517 1.00 0.13 A +ATOM 793 C GLU A 72 26.018 38.543 32.809 1.00 0.13 A +ATOM 794 O GLU A 72 25.596 38.839 33.909 1.00 0.13 A +ATOM 795 CB GLU A 72 23.982 38.713 31.244 1.00 0.15 A +ATOM 796 CG GLU A 72 23.351 39.613 30.181 1.00 0.15 A +ATOM 797 CD GLU A 72 21.882 39.233 29.992 1.00 0.20 A +ATOM 798 OE1 GLU A 72 21.504 38.164 30.442 1.00 0.20 A +ATOM 799 OE2 GLU A 72 21.160 40.023 29.408 1.00 0.40 A +ATOM 800 H GLU A 72 26.006 38.472 29.626 1.00 0.14 A +ATOM 801 HA GLU A 72 25.418 40.245 31.742 1.00 0.13 A +ATOM 802 1HB GLU A 72 23.996 37.692 30.892 1.00 0.18 A +ATOM 803 2HB GLU A 72 23.405 38.774 32.155 1.00 0.17 A +ATOM 804 1HG GLU A 72 23.419 40.644 30.496 1.00 0.15 A +ATOM 805 2HG GLU A 72 23.876 39.487 29.246 1.00 0.18 A +ATOM 806 N THR A 73 26.992 37.696 32.662 1.00 0.13 A +ATOM 807 CA THR A 73 27.683 37.015 33.772 1.00 0.12 A +ATOM 808 C THR A 73 28.957 37.756 34.087 1.00 0.11 A +ATOM 809 O THR A 73 29.737 37.413 34.948 1.00 0.11 A +ATOM 810 CB THR A 73 27.918 35.516 33.548 1.00 0.13 A +ATOM 811 OG1 THR A 73 28.602 35.327 32.319 1.00 0.14 A +ATOM 812 CG2 THR A 73 26.576 34.777 33.505 1.00 0.15 A +ATOM 813 H THR A 73 27.298 37.495 31.754 1.00 0.13 A +ATOM 814 HA THR A 73 27.086 37.133 34.664 1.00 0.13 A +ATOM 815 HB THR A 73 28.515 35.121 34.356 1.00 0.13 A +ATOM 816 HG1 THR A 73 27.978 35.482 31.606 1.00 0.88 A +ATOM 817 1HG2 THR A 73 26.742 33.724 33.677 1.00 1.02 A +ATOM 818 2HG2 THR A 73 26.120 34.915 32.537 1.00 1.03 A +ATOM 819 3HG2 THR A 73 25.920 35.165 34.271 1.00 1.03 A +ATOM 820 N ASN A 74 29.092 38.818 33.422 1.00 0.11 A +ATOM 821 CA ASN A 74 30.179 39.745 33.613 1.00 0.10 A +ATOM 822 C ASN A 74 31.530 39.067 33.600 1.00 0.09 A +ATOM 823 O ASN A 74 32.365 39.352 34.438 1.00 0.09 A +ATOM 824 CB ASN A 74 29.936 40.411 34.967 1.00 0.10 A +ATOM 825 CG ASN A 74 28.553 41.025 35.040 1.00 0.10 A +ATOM 826 OD1 ASN A 74 27.800 40.738 35.954 1.00 0.11 A +ATOM 827 ND2 ASN A 74 28.195 41.884 34.130 1.00 0.11 A +ATOM 828 H ASN A 74 28.404 39.049 32.766 1.00 0.11 A +ATOM 829 HA ASN A 74 30.182 40.486 32.827 1.00 0.10 A +ATOM 830 1HB ASN A 74 30.038 39.672 35.747 1.00 0.10 A +ATOM 831 2HB ASN A 74 30.674 41.186 35.115 1.00 0.09 A +ATOM 832 N HIS A 75 31.758 38.167 32.668 1.00 0.09 A +ATOM 833 CA HIS A 75 33.001 37.465 32.653 1.00 0.09 A +ATOM 834 C HIS A 75 33.742 37.541 31.293 1.00 0.08 A +ATOM 835 O HIS A 75 34.825 37.010 31.144 1.00 0.08 A +ATOM 836 CB HIS A 75 32.757 36.006 33.049 1.00 0.10 A +ATOM 837 CG HIS A 75 32.243 35.218 31.873 1.00 0.11 A +ATOM 838 ND1 HIS A 75 30.894 35.144 31.561 1.00 0.18 A +ATOM 839 CD2 HIS A 75 32.888 34.457 30.928 1.00 0.16 A +ATOM 840 CE1 HIS A 75 30.770 34.363 30.472 1.00 0.16 A +ATOM 841 NE2 HIS A 75 31.955 33.922 30.048 1.00 0.13 A +ATOM 842 H HIS A 75 31.059 37.956 32.016 1.00 0.10 A +ATOM 843 HA HIS A 75 33.684 37.922 33.355 1.00 0.08 A +ATOM 844 1HB HIS A 75 33.684 35.570 33.391 1.00 0.10 A +ATOM 845 2HB HIS A 75 32.030 35.971 33.848 1.00 0.10 A +ATOM 846 HD2 HIS A 75 33.955 34.300 30.876 1.00 0.27 A +ATOM 847 HE1 HIS A 75 29.829 34.121 30.003 1.00 0.23 A +ATOM 848 HE2 HIS A 75 32.130 33.341 29.278 1.00 0.17 A +ATOM 849 N ALA A 76 33.181 38.178 30.324 1.00 0.09 A +ATOM 850 CA ALA A 76 33.778 38.299 29.051 1.00 0.08 A +ATOM 851 C ALA A 76 33.306 39.548 28.345 1.00 0.09 A +ATOM 852 O ALA A 76 32.212 40.026 28.574 1.00 0.09 A +ATOM 853 CB ALA A 76 33.344 37.093 28.273 1.00 0.09 A +ATOM 854 H ALA A 76 32.296 38.575 30.471 1.00 0.09 A +ATOM 855 HA ALA A 76 34.854 38.318 29.142 1.00 0.08 A +ATOM 856 1HB ALA A 76 32.267 37.086 28.191 1.00 0.10 A +ATOM 857 2HB ALA A 76 33.673 36.199 28.783 1.00 0.09 A +ATOM 858 3HB ALA A 76 33.780 37.126 27.286 1.00 0.09 A +ATOM 859 N PHE A 77 34.110 40.089 27.466 1.00 0.08 A +ATOM 860 CA PHE A 77 33.667 41.265 26.769 1.00 0.08 A +ATOM 861 C PHE A 77 34.299 41.422 25.389 1.00 0.09 A +ATOM 862 O PHE A 77 35.258 40.769 25.019 1.00 0.08 A +ATOM 863 CB PHE A 77 33.925 42.500 27.619 1.00 0.08 A +ATOM 864 CG PHE A 77 35.399 42.843 27.671 1.00 0.07 A +ATOM 865 CD1 PHE A 77 35.969 43.669 26.690 1.00 0.07 A +ATOM 866 CD2 PHE A 77 36.187 42.371 28.723 1.00 0.06 A +ATOM 867 CE1 PHE A 77 37.322 44.022 26.769 1.00 0.06 A +ATOM 868 CE2 PHE A 77 37.541 42.719 28.798 1.00 0.05 A +ATOM 869 CZ PHE A 77 38.108 43.548 27.825 1.00 0.06 A +ATOM 870 H PHE A 77 34.989 39.698 27.279 1.00 0.08 A +ATOM 871 HA PHE A 77 32.610 41.186 26.569 1.00 0.09 A +ATOM 872 1HB PHE A 77 33.383 43.335 27.202 1.00 0.09 A +ATOM 873 2HB PHE A 77 33.572 42.316 28.623 1.00 0.08 A +ATOM 874 HD1 PHE A 77 35.363 44.039 25.878 1.00 0.08 A +ATOM 875 HD2 PHE A 77 35.754 41.728 29.473 1.00 0.06 A +ATOM 876 HE1 PHE A 77 37.763 44.650 26.008 1.00 0.07 A +ATOM 877 HE2 PHE A 77 38.147 42.353 29.613 1.00 0.05 A +ATOM 878 HZ PHE A 77 39.148 43.828 27.893 1.00 0.05 A +ATOM 879 N SER A 78 33.697 42.321 24.640 1.00 0.09 A +ATOM 880 CA SER A 78 34.082 42.642 23.291 1.00 0.10 A +ATOM 881 C SER A 78 34.502 44.100 23.209 1.00 0.10 A +ATOM 882 O SER A 78 33.832 44.949 23.762 1.00 0.10 A +ATOM 883 CB SER A 78 32.836 42.581 22.404 1.00 0.11 A +ATOM 884 OG SER A 78 32.516 41.228 22.141 1.00 0.11 A +ATOM 885 H SER A 78 32.942 42.810 25.028 1.00 0.10 A +ATOM 886 HA SER A 78 34.814 41.930 22.941 1.00 0.09 A +ATOM 887 1HB SER A 78 32.010 43.045 22.910 1.00 0.11 A +ATOM 888 2HB SER A 78 33.019 43.099 21.470 1.00 0.12 A +ATOM 889 HG SER A 78 33.094 40.920 21.439 1.00 0.11 A +ATOM 890 N ILE A 79 35.532 44.414 22.477 1.00 0.10 A +ATOM 891 CA ILE A 79 35.912 45.804 22.297 1.00 0.10 A +ATOM 892 C ILE A 79 36.407 45.963 20.875 1.00 0.11 A +ATOM 893 O ILE A 79 36.941 45.038 20.294 1.00 0.10 A +ATOM 894 CB ILE A 79 37.006 46.218 23.273 1.00 0.09 A +ATOM 895 CG1 ILE A 79 37.588 47.602 22.949 1.00 0.10 A +ATOM 896 CG2 ILE A 79 38.107 45.178 23.244 1.00 0.08 A +ATOM 897 CD1 ILE A 79 38.417 48.111 24.142 1.00 0.09 A +ATOM 898 H ILE A 79 36.041 43.712 22.021 1.00 0.09 A +ATOM 899 HA ILE A 79 35.046 46.428 22.457 1.00 0.10 A +ATOM 900 HB ILE A 79 36.585 46.237 24.267 1.00 0.09 A +ATOM 901 1HG1 ILE A 79 38.222 47.531 22.080 1.00 0.10 A +ATOM 902 2HG1 ILE A 79 36.783 48.294 22.757 1.00 0.10 A +ATOM 903 1HG2 ILE A 79 37.692 44.209 23.483 1.00 0.08 A +ATOM 904 2HG2 ILE A 79 38.857 45.435 23.969 1.00 0.08 A +ATOM 905 3HG2 ILE A 79 38.542 45.155 22.263 1.00 0.09 A +ATOM 906 1HD1 ILE A 79 39.125 48.855 23.803 1.00 0.09 A +ATOM 907 2HD1 ILE A 79 38.948 47.293 24.602 1.00 0.08 A +ATOM 908 3HD1 ILE A 79 37.761 48.552 24.864 1.00 0.09 A +ATOM 909 N GLU A 80 36.231 47.127 20.318 1.00 0.11 A +ATOM 910 CA GLU A 80 36.698 47.421 18.975 1.00 0.12 A +ATOM 911 C GLU A 80 37.686 48.529 19.126 1.00 0.12 A +ATOM 912 O GLU A 80 37.411 49.491 19.790 1.00 0.12 A +ATOM 913 CB GLU A 80 35.554 47.799 18.031 1.00 0.13 A +ATOM 914 CG GLU A 80 36.100 47.977 16.613 1.00 0.18 A +ATOM 915 CD GLU A 80 34.977 48.454 15.690 1.00 0.47 A +ATOM 916 OE1 GLU A 80 33.875 48.641 16.178 1.00 0.84 A +ATOM 917 OE2 GLU A 80 35.238 48.623 14.510 1.00 0.56 A +ATOM 918 H GLU A 80 35.779 47.833 20.825 1.00 0.12 A +ATOM 919 HA GLU A 80 37.198 46.549 18.582 1.00 0.12 A +ATOM 920 1HB GLU A 80 34.811 47.015 18.035 1.00 0.15 A +ATOM 921 2HB GLU A 80 35.105 48.724 18.361 1.00 0.17 A +ATOM 922 1HG GLU A 80 36.894 48.709 16.623 1.00 0.41 A +ATOM 923 2HG GLU A 80 36.483 47.034 16.253 1.00 0.52 A +ATOM 924 N SER A 81 38.846 48.400 18.559 1.00 0.12 A +ATOM 925 CA SER A 81 39.819 49.429 18.757 1.00 0.12 A +ATOM 926 C SER A 81 39.515 50.543 17.823 1.00 0.13 A +ATOM 927 O SER A 81 38.755 50.388 16.884 1.00 0.14 A +ATOM 928 CB SER A 81 41.185 48.957 18.353 1.00 0.12 A +ATOM 929 OG SER A 81 41.147 48.769 16.947 1.00 0.12 A +ATOM 930 H SER A 81 39.049 47.607 18.021 1.00 0.12 A +ATOM 931 HA SER A 81 39.835 49.706 19.801 1.00 0.12 A +ATOM 932 1HB SER A 81 41.927 49.698 18.601 1.00 0.12 A +ATOM 933 2HB SER A 81 41.420 48.028 18.832 1.00 0.11 A +ATOM 934 HG SER A 81 40.223 48.846 16.671 1.00 0.13 A +ATOM 935 N ASP A 82 40.123 51.646 18.029 1.00 0.14 A +ATOM 936 CA ASP A 82 39.894 52.747 17.111 1.00 0.15 A +ATOM 937 C ASP A 82 40.511 52.374 15.746 1.00 0.15 A +ATOM 938 O ASP A 82 40.033 52.776 14.701 1.00 0.16 A +ATOM 939 CB ASP A 82 40.434 54.112 17.606 1.00 0.15 A +ATOM 940 CG ASP A 82 39.735 54.603 18.874 1.00 0.15 A +ATOM 941 OD1 ASP A 82 38.593 54.223 19.086 1.00 0.15 A +ATOM 942 OD2 ASP A 82 40.353 55.373 19.602 1.00 0.15 A +ATOM 943 H ASP A 82 40.733 51.745 18.789 1.00 0.13 A +ATOM 944 HA ASP A 82 38.830 52.842 16.955 1.00 0.15 A +ATOM 945 1HB ASP A 82 41.490 54.017 17.803 1.00 0.15 A +ATOM 946 2HB ASP A 82 40.291 54.843 16.823 1.00 0.16 A +ATOM 947 N SER A 83 41.570 51.598 15.798 1.00 0.15 A +ATOM 948 CA SER A 83 42.317 51.125 14.651 1.00 0.15 A +ATOM 949 C SER A 83 41.526 50.095 13.833 1.00 0.15 A +ATOM 950 O SER A 83 42.036 49.508 12.896 1.00 0.15 A +ATOM 951 CB SER A 83 43.627 50.470 15.061 1.00 0.14 A +ATOM 952 OG SER A 83 43.562 50.103 16.432 1.00 0.13 A +ATOM 953 H SER A 83 41.891 51.327 16.683 1.00 0.14 A +ATOM 954 HA SER A 83 42.533 51.963 14.006 1.00 0.16 A +ATOM 955 1HB SER A 83 43.817 49.586 14.470 1.00 0.14 A +ATOM 956 2HB SER A 83 44.442 51.169 14.913 1.00 0.15 A +ATOM 957 HG SER A 83 42.838 49.485 16.540 1.00 0.13 A +ATOM 958 N GLY A 84 40.325 49.878 14.218 1.00 0.15 A +ATOM 959 CA GLY A 84 39.414 48.918 13.594 1.00 0.15 A +ATOM 960 C GLY A 84 39.603 47.429 13.946 1.00 0.14 A +ATOM 961 O GLY A 84 39.040 46.587 13.269 1.00 0.14 A +ATOM 962 H GLY A 84 39.992 50.377 14.992 1.00 0.15 A +ATOM 963 1HA GLY A 84 38.412 49.188 13.890 1.00 0.15 A +ATOM 964 2HA GLY A 84 39.517 49.026 12.525 1.00 0.16 A +ATOM 965 N VAL A 85 40.336 47.062 14.962 1.00 0.13 A +ATOM 966 CA VAL A 85 40.448 45.637 15.287 1.00 0.12 A +ATOM 967 C VAL A 85 39.368 45.219 16.331 1.00 0.12 A +ATOM 968 O VAL A 85 39.185 45.866 17.344 1.00 0.12 A +ATOM 969 CB VAL A 85 41.852 45.293 15.855 1.00 0.11 A +ATOM 970 CG1 VAL A 85 41.990 43.788 16.135 1.00 0.11 A +ATOM 971 CG2 VAL A 85 42.915 45.752 14.854 1.00 0.12 A +ATOM 972 H VAL A 85 40.797 47.735 15.504 1.00 0.13 A +ATOM 973 HA VAL A 85 40.280 45.059 14.391 1.00 0.13 A +ATOM 974 HB VAL A 85 41.984 45.829 16.787 1.00 0.11 A +ATOM 975 1HG1 VAL A 85 41.280 43.492 16.890 1.00 0.10 A +ATOM 976 2HG1 VAL A 85 42.994 43.584 16.487 1.00 0.10 A +ATOM 977 3HG1 VAL A 85 41.811 43.232 15.228 1.00 0.11 A +ATOM 978 1HG2 VAL A 85 42.469 46.343 14.070 1.00 0.13 A +ATOM 979 2HG2 VAL A 85 43.375 44.894 14.415 1.00 0.12 A +ATOM 980 3HG2 VAL A 85 43.648 46.353 15.369 1.00 0.12 A +ATOM 981 N GLU A 86 38.677 44.104 16.077 1.00 0.12 A +ATOM 982 CA GLU A 86 37.674 43.557 17.011 1.00 0.12 A +ATOM 983 C GLU A 86 38.302 42.449 17.877 1.00 0.11 A +ATOM 984 O GLU A 86 38.826 41.474 17.374 1.00 0.11 A +ATOM 985 CB GLU A 86 36.476 42.971 16.256 1.00 0.13 A +ATOM 986 CG GLU A 86 35.777 44.086 15.474 1.00 0.25 A +ATOM 987 CD GLU A 86 34.583 43.509 14.712 1.00 0.94 A +ATOM 988 OE1 GLU A 86 34.522 42.300 14.574 1.00 1.70 A +ATOM 989 OE2 GLU A 86 33.750 44.288 14.279 1.00 1.05 A +ATOM 990 H GLU A 86 38.858 43.617 15.248 1.00 0.12 A +ATOM 991 HA GLU A 86 37.330 44.346 17.661 1.00 0.12 A +ATOM 992 1HB GLU A 86 36.820 42.209 15.571 1.00 0.20 A +ATOM 993 2HB GLU A 86 35.783 42.537 16.960 1.00 0.18 A +ATOM 994 1HG GLU A 86 35.434 44.846 16.161 1.00 0.89 A +ATOM 995 2HG GLU A 86 36.472 44.523 14.772 1.00 0.93 A +ATOM 996 N LEU A 87 38.263 42.620 19.185 1.00 0.10 A +ATOM 997 CA LEU A 87 38.838 41.667 20.119 1.00 0.09 A +ATOM 998 C LEU A 87 37.765 41.055 20.993 1.00 0.09 A +ATOM 999 O LEU A 87 36.707 41.618 21.205 1.00 0.09 A +ATOM 1000 CB LEU A 87 39.801 42.345 21.125 1.00 0.08 A +ATOM 1001 CG LEU A 87 41.183 42.838 20.650 1.00 0.08 A +ATOM 1002 CD1 LEU A 87 41.826 41.874 19.689 1.00 0.08 A +ATOM 1003 CD2 LEU A 87 41.077 44.229 20.039 1.00 0.09 A +ATOM 1004 H LEU A 87 37.858 43.437 19.544 1.00 0.10 A +ATOM 1005 HA LEU A 87 39.384 40.920 19.562 1.00 0.09 A +ATOM 1006 1HB LEU A 87 39.287 43.187 21.534 1.00 0.08 A +ATOM 1007 2HB LEU A 87 39.969 41.643 21.940 1.00 0.07 A +ATOM 1008 HG LEU A 87 41.824 42.910 21.523 1.00 0.07 A +ATOM 1009 1HD1 LEU A 87 41.264 41.857 18.781 1.00 0.09 A +ATOM 1010 2HD1 LEU A 87 41.841 40.895 20.139 1.00 0.07 A +ATOM 1011 3HD1 LEU A 87 42.841 42.194 19.488 1.00 0.08 A +ATOM 1012 1HD2 LEU A 87 40.418 44.203 19.190 1.00 0.09 A +ATOM 1013 2HD2 LEU A 87 42.059 44.558 19.734 1.00 0.09 A +ATOM 1014 3HD2 LEU A 87 40.686 44.910 20.783 1.00 0.08 A +ATOM 1015 N PHE A 88 38.069 39.920 21.545 1.00 0.08 A +ATOM 1016 CA PHE A 88 37.146 39.270 22.441 1.00 0.08 A +ATOM 1017 C PHE A 88 37.920 38.580 23.573 1.00 0.08 A +ATOM 1018 O PHE A 88 38.624 37.606 23.395 1.00 0.08 A +ATOM 1019 CB PHE A 88 36.217 38.306 21.700 1.00 0.10 A +ATOM 1020 CG PHE A 88 35.195 37.751 22.665 1.00 0.11 A +ATOM 1021 CD1 PHE A 88 34.236 38.608 23.236 1.00 0.15 A +ATOM 1022 CD2 PHE A 88 35.198 36.380 22.992 1.00 0.12 A +ATOM 1023 CE1 PHE A 88 33.280 38.097 24.134 1.00 0.18 A +ATOM 1024 CE2 PHE A 88 34.241 35.868 23.889 1.00 0.15 A +ATOM 1025 CZ PHE A 88 33.282 36.727 24.460 1.00 0.18 A +ATOM 1026 H PHE A 88 38.934 39.505 21.350 1.00 0.08 A +ATOM 1027 HA PHE A 88 36.548 40.021 22.932 1.00 0.09 A +ATOM 1028 1HB PHE A 88 35.712 38.835 20.905 1.00 0.11 A +ATOM 1029 2HB PHE A 88 36.797 37.497 21.282 1.00 0.10 A +ATOM 1030 HD1 PHE A 88 34.233 39.658 22.986 1.00 0.16 A +ATOM 1031 HD2 PHE A 88 35.934 35.722 22.553 1.00 0.13 A +ATOM 1032 HE1 PHE A 88 32.546 38.756 24.572 1.00 0.22 A +ATOM 1033 HE2 PHE A 88 34.242 34.818 24.139 1.00 0.16 A +ATOM 1034 HZ PHE A 88 32.549 36.335 25.150 1.00 0.21 A +ATOM 1035 N VAL A 89 37.742 39.127 24.754 1.00 0.07 A +ATOM 1036 CA VAL A 89 38.356 38.646 25.987 1.00 0.06 A +ATOM 1037 C VAL A 89 37.377 37.849 26.818 1.00 0.07 A +ATOM 1038 O VAL A 89 36.374 38.345 27.292 1.00 0.07 A +ATOM 1039 CB VAL A 89 38.877 39.844 26.725 1.00 0.05 A +ATOM 1040 CG1 VAL A 89 39.703 39.424 27.945 1.00 0.05 A +ATOM 1041 CG2 VAL A 89 39.737 40.622 25.730 1.00 0.05 A +ATOM 1042 H VAL A 89 37.143 39.897 24.824 1.00 0.07 A +ATOM 1043 HA VAL A 89 39.168 37.971 25.757 1.00 0.06 A +ATOM 1044 HB VAL A 89 38.049 40.460 27.043 1.00 0.06 A +ATOM 1045 1HG1 VAL A 89 40.226 40.285 28.337 1.00 0.04 A +ATOM 1046 2HG1 VAL A 89 40.417 38.669 27.656 1.00 0.05 A +ATOM 1047 3HG1 VAL A 89 39.045 39.028 28.705 1.00 0.05 A +ATOM 1048 1HG2 VAL A 89 39.090 41.153 25.045 1.00 0.06 A +ATOM 1049 2HG2 VAL A 89 40.359 39.932 25.170 1.00 0.05 A +ATOM 1050 3HG2 VAL A 89 40.361 41.322 26.254 1.00 0.05 A +ATOM 1051 N HIS A 90 37.677 36.573 26.984 1.00 0.07 A +ATOM 1052 CA HIS A 90 36.797 35.720 27.737 1.00 0.08 A +ATOM 1053 C HIS A 90 37.548 35.048 28.923 1.00 0.08 A +ATOM 1054 O HIS A 90 38.296 34.127 28.744 1.00 0.08 A +ATOM 1055 CB HIS A 90 36.172 34.677 26.766 1.00 0.09 A +ATOM 1056 CG HIS A 90 35.330 33.706 27.547 1.00 0.10 A +ATOM 1057 ND1 HIS A 90 35.881 32.806 28.445 1.00 0.16 A +ATOM 1058 CD2 HIS A 90 33.975 33.483 27.576 1.00 0.16 A +ATOM 1059 CE1 HIS A 90 34.871 32.089 28.972 1.00 0.15 A +ATOM 1060 NE2 HIS A 90 33.688 32.461 28.476 1.00 0.15 A +ATOM 1061 H HIS A 90 38.489 36.207 26.573 1.00 0.07 A +ATOM 1062 HA HIS A 90 36.013 36.312 28.189 1.00 0.08 A +ATOM 1063 1HB HIS A 90 35.555 35.186 26.041 1.00 0.10 A +ATOM 1064 2HB HIS A 90 36.960 34.142 26.256 1.00 0.10 A +ATOM 1065 HD1 HIS A 90 36.832 32.709 28.658 1.00 0.22 A +ATOM 1066 HD2 HIS A 90 33.244 34.019 26.989 1.00 0.24 A +ATOM 1067 HE1 HIS A 90 35.001 31.308 29.706 1.00 0.20 A +ATOM 1068 N PHE A 91 37.322 35.505 30.162 1.00 0.08 A +ATOM 1069 CA PHE A 91 37.981 34.887 31.299 1.00 0.08 A +ATOM 1070 C PHE A 91 37.629 33.397 31.586 1.00 0.09 A +ATOM 1071 O PHE A 91 36.490 33.050 31.828 1.00 0.10 A +ATOM 1072 CB PHE A 91 37.615 35.640 32.583 1.00 0.08 A +ATOM 1073 CG PHE A 91 38.570 35.251 33.687 1.00 0.08 A +ATOM 1074 CD1 PHE A 91 38.322 34.107 34.466 1.00 0.09 A +ATOM 1075 CD2 PHE A 91 39.712 36.037 33.935 1.00 0.07 A +ATOM 1076 CE1 PHE A 91 39.217 33.746 35.493 1.00 0.09 A +ATOM 1077 CE2 PHE A 91 40.606 35.678 34.961 1.00 0.08 A +ATOM 1078 CZ PHE A 91 40.359 34.532 35.740 1.00 0.09 A +ATOM 1079 H PHE A 91 36.698 36.248 30.307 1.00 0.07 A +ATOM 1080 HA PHE A 91 39.051 34.920 31.156 1.00 0.07 A +ATOM 1081 1HB PHE A 91 37.686 36.702 32.405 1.00 0.07 A +ATOM 1082 2HB PHE A 91 36.605 35.392 32.876 1.00 0.08 A +ATOM 1083 HD1 PHE A 91 37.448 33.507 34.277 1.00 0.09 A +ATOM 1084 HD2 PHE A 91 39.900 36.916 33.338 1.00 0.07 A +ATOM 1085 HE1 PHE A 91 39.026 32.867 36.091 1.00 0.10 A +ATOM 1086 HE2 PHE A 91 41.482 36.281 35.150 1.00 0.08 A +ATOM 1087 HZ PHE A 91 41.044 34.255 36.527 1.00 0.09 A +ATOM 1088 N GLY A 92 38.652 32.527 31.637 1.00 0.09 A +ATOM 1089 CA GLY A 92 38.442 31.136 31.983 1.00 0.10 A +ATOM 1090 C GLY A 92 37.692 30.329 30.931 1.00 0.11 A +ATOM 1091 O GLY A 92 37.345 30.803 29.868 1.00 0.11 A +ATOM 1092 H GLY A 92 39.565 32.836 31.455 1.00 0.09 A +ATOM 1093 1HA GLY A 92 39.407 30.681 32.148 1.00 0.10 A +ATOM 1094 2HA GLY A 92 37.866 31.100 32.896 1.00 0.11 A +ATOM 1095 N ILE A 93 37.429 29.084 31.290 1.00 0.12 A +ATOM 1096 CA ILE A 93 36.724 28.149 30.462 1.00 0.13 A +ATOM 1097 C ILE A 93 35.432 27.729 31.165 1.00 0.14 A +ATOM 1098 O ILE A 93 35.381 27.439 32.344 1.00 0.14 A +ATOM 1099 CB ILE A 93 37.626 26.986 30.060 1.00 0.14 A +ATOM 1100 CG1 ILE A 93 38.890 27.508 29.368 1.00 0.13 A +ATOM 1101 CG2 ILE A 93 36.887 25.990 29.164 1.00 0.15 A +ATOM 1102 CD1 ILE A 93 38.541 28.334 28.130 1.00 0.12 A +ATOM 1103 H ILE A 93 37.720 28.785 32.176 1.00 0.12 A +ATOM 1104 HA ILE A 93 36.380 28.654 29.572 1.00 0.13 A +ATOM 1105 HB ILE A 93 37.913 26.465 30.955 1.00 0.14 A +ATOM 1106 1HG1 ILE A 93 39.437 28.129 30.061 1.00 0.12 A +ATOM 1107 2HG1 ILE A 93 39.505 26.672 29.076 1.00 0.13 A +ATOM 1108 1HG2 ILE A 93 36.551 26.482 28.267 1.00 0.14 A +ATOM 1109 2HG2 ILE A 93 36.037 25.591 29.700 1.00 0.15 A +ATOM 1110 3HG2 ILE A 93 37.555 25.179 28.906 1.00 0.15 A +ATOM 1111 1HD1 ILE A 93 37.736 27.863 27.587 1.00 0.13 A +ATOM 1112 2HD1 ILE A 93 39.402 28.400 27.505 1.00 0.12 A +ATOM 1113 3HD1 ILE A 93 38.251 29.324 28.419 1.00 0.12 A +ATOM 1114 N ASP A 94 34.373 27.766 30.401 1.00 0.14 A +ATOM 1115 CA ASP A 94 33.061 27.469 30.883 1.00 0.15 A +ATOM 1116 C ASP A 94 32.701 28.346 32.105 1.00 0.15 A +ATOM 1117 O ASP A 94 31.893 27.959 32.926 1.00 0.15 A +ATOM 1118 CB ASP A 94 32.843 26.015 31.315 1.00 0.16 A +ATOM 1119 CG ASP A 94 32.968 25.097 30.098 1.00 0.17 A +ATOM 1120 OD1 ASP A 94 32.946 25.608 28.990 1.00 0.17 A +ATOM 1121 OD2 ASP A 94 33.082 23.898 30.293 1.00 0.18 A +ATOM 1122 H ASP A 94 34.480 28.023 29.463 1.00 0.14 A +ATOM 1123 HA ASP A 94 32.357 27.694 30.096 1.00 0.15 A +ATOM 1124 1HB ASP A 94 33.587 25.743 32.050 1.00 0.16 A +ATOM 1125 2HB ASP A 94 31.857 25.909 31.743 1.00 0.17 A +ATOM 1126 N THR A 95 33.282 29.503 32.244 1.00 0.14 A +ATOM 1127 CA THR A 95 32.988 30.350 33.364 1.00 0.13 A +ATOM 1128 C THR A 95 31.528 30.879 33.436 1.00 0.14 A +ATOM 1129 O THR A 95 31.080 31.254 34.507 1.00 0.14 A +ATOM 1130 CB THR A 95 34.054 31.455 33.419 1.00 0.12 A +ATOM 1131 OG1 THR A 95 34.344 31.849 32.087 1.00 0.12 A +ATOM 1132 CG2 THR A 95 35.317 30.900 34.061 1.00 0.12 A +ATOM 1133 H THR A 95 33.952 29.801 31.595 1.00 0.13 A +ATOM 1134 HA THR A 95 33.011 29.773 34.277 1.00 0.14 A +ATOM 1135 HB THR A 95 33.688 32.301 33.978 1.00 0.12 A +ATOM 1136 HG1 THR A 95 35.167 32.339 32.096 1.00 0.11 A +ATOM 1137 1HG2 THR A 95 35.657 30.042 33.498 1.00 0.12 A +ATOM 1138 2HG2 THR A 95 35.107 30.606 35.077 1.00 0.12 A +ATOM 1139 3HG2 THR A 95 36.075 31.658 34.058 1.00 0.11 A +ATOM 1140 N VAL A 96 30.782 30.891 32.381 1.00 0.14 A +ATOM 1141 CA VAL A 96 29.381 31.348 32.449 1.00 0.14 A +ATOM 1142 C VAL A 96 28.626 30.511 33.479 1.00 0.15 A +ATOM 1143 O VAL A 96 27.717 30.980 34.136 1.00 0.15 A +ATOM 1144 CB VAL A 96 28.584 31.190 31.131 1.00 0.15 A +ATOM 1145 CG1 VAL A 96 28.409 29.705 30.786 1.00 0.17 A +ATOM 1146 CG2 VAL A 96 27.207 31.845 31.279 1.00 0.17 A +ATOM 1147 H VAL A 96 31.158 30.599 31.524 1.00 0.14 A +ATOM 1148 HA VAL A 96 29.383 32.393 32.720 1.00 0.14 A +ATOM 1149 HB VAL A 96 29.126 31.676 30.332 1.00 0.14 A +ATOM 1150 1HG1 VAL A 96 28.132 29.608 29.746 1.00 1.00 A +ATOM 1151 2HG1 VAL A 96 27.633 29.278 31.405 1.00 1.04 A +ATOM 1152 3HG1 VAL A 96 29.338 29.183 30.961 1.00 1.02 A +ATOM 1153 1HG2 VAL A 96 27.330 32.874 31.583 1.00 1.02 A +ATOM 1154 2HG2 VAL A 96 26.631 31.316 32.023 1.00 1.03 A +ATOM 1155 3HG2 VAL A 96 26.690 31.810 30.332 1.00 1.03 A +ATOM 1156 N GLU A 97 28.993 29.262 33.611 1.00 0.16 A +ATOM 1157 CA GLU A 97 28.307 28.401 34.562 1.00 0.17 A +ATOM 1158 C GLU A 97 28.385 28.958 36.024 1.00 0.17 A +ATOM 1159 O GLU A 97 27.562 28.608 36.847 1.00 0.17 A +ATOM 1160 CB GLU A 97 28.741 26.911 34.483 1.00 0.18 A +ATOM 1161 CG GLU A 97 28.385 26.340 33.107 1.00 0.19 A +ATOM 1162 CD GLU A 97 26.865 26.325 32.931 1.00 0.21 A +ATOM 1163 OE1 GLU A 97 26.171 26.412 33.930 1.00 0.20 A +ATOM 1164 OE2 GLU A 97 26.421 26.226 31.799 1.00 0.24 A +ATOM 1165 H GLU A 97 29.741 28.908 33.086 1.00 0.16 A +ATOM 1166 HA GLU A 97 27.247 28.458 34.369 1.00 0.17 A +ATOM 1167 1HB GLU A 97 29.808 26.839 34.637 1.00 0.18 A +ATOM 1168 2HB GLU A 97 28.229 26.347 35.248 1.00 0.18 A +ATOM 1169 1HG GLU A 97 28.831 26.954 32.338 1.00 0.21 A +ATOM 1170 2HG GLU A 97 28.764 25.332 33.027 1.00 0.19 A +ATOM 1171 N LEU A 98 29.308 29.828 36.357 1.00 0.16 A +ATOM 1172 CA LEU A 98 29.363 30.382 37.694 1.00 0.15 A +ATOM 1173 C LEU A 98 28.312 31.510 37.955 1.00 0.15 A +ATOM 1174 O LEU A 98 28.220 32.041 39.045 1.00 0.15 A +ATOM 1175 CB LEU A 98 30.741 30.978 37.954 1.00 0.15 A +ATOM 1176 CG LEU A 98 31.698 29.928 38.520 1.00 0.15 A +ATOM 1177 CD1 LEU A 98 31.504 28.595 37.792 1.00 0.16 A +ATOM 1178 CD2 LEU A 98 33.135 30.420 38.330 1.00 0.14 A +ATOM 1179 H LEU A 98 29.962 30.114 35.687 1.00 0.15 A +ATOM 1180 HA LEU A 98 29.168 29.599 38.412 1.00 0.16 A +ATOM 1181 1HB LEU A 98 31.138 31.353 37.021 1.00 0.14 A +ATOM 1182 2HB LEU A 98 30.666 31.797 38.659 1.00 0.14 A +ATOM 1183 HG LEU A 98 31.500 29.799 39.575 1.00 0.15 A +ATOM 1184 1HD1 LEU A 98 30.591 28.125 38.117 1.00 0.17 A +ATOM 1185 2HD1 LEU A 98 32.328 27.943 38.011 1.00 0.16 A +ATOM 1186 3HD1 LEU A 98 31.453 28.776 36.728 1.00 0.15 A +ATOM 1187 1HD2 LEU A 98 33.328 30.570 37.277 1.00 0.14 A +ATOM 1188 2HD2 LEU A 98 33.824 29.690 38.723 1.00 0.14 A +ATOM 1189 3HD2 LEU A 98 33.261 31.355 38.852 1.00 0.14 A +ATOM 1190 N LYS A 99 27.577 31.863 36.971 1.00 0.15 A +ATOM 1191 CA LYS A 99 26.555 32.901 37.008 1.00 0.15 A +ATOM 1192 C LYS A 99 26.975 34.234 37.619 1.00 0.14 A +ATOM 1193 O LYS A 99 26.239 34.837 38.374 1.00 0.14 A +ATOM 1194 CB LYS A 99 25.223 32.439 37.615 1.00 0.16 A +ATOM 1195 CG LYS A 99 24.651 31.293 36.776 1.00 1.40 A +ATOM 1196 CD LYS A 99 23.216 30.990 37.224 1.00 1.78 A +ATOM 1197 CE LYS A 99 23.211 30.462 38.665 1.00 2.52 A +ATOM 1198 NZ LYS A 99 23.257 31.609 39.615 1.00 3.21 A +ATOM 1199 H LYS A 99 27.716 31.406 36.116 1.00 0.15 A +ATOM 1200 HA LYS A 99 26.371 33.233 35.998 1.00 0.15 A +ATOM 1201 1HB LYS A 99 25.390 32.098 38.626 1.00 1.00 A +ATOM 1202 2HB LYS A 99 24.525 33.262 37.622 1.00 1.01 A +ATOM 1203 1HG LYS A 99 24.650 31.579 35.734 1.00 2.08 A +ATOM 1204 2HG LYS A 99 25.261 30.412 36.906 1.00 2.05 A +ATOM 1205 1HD LYS A 99 22.627 31.894 37.172 1.00 2.10 A +ATOM 1206 2HD LYS A 99 22.788 30.245 36.570 1.00 2.16 A +ATOM 1207 1HE LYS A 99 22.308 29.894 38.835 1.00 2.93 A +ATOM 1208 2HE LYS A 99 24.069 29.826 38.826 1.00 2.92 A +ATOM 1209 1HZ LYS A 99 24.115 31.544 40.197 1.00 3.61 A +ATOM 1210 2HZ LYS A 99 22.417 31.584 40.230 1.00 3.56 A +ATOM 1211 3HZ LYS A 99 23.270 32.502 39.082 1.00 3.54 A +ATOM 1212 N GLY A 100 28.118 34.736 37.243 1.00 0.13 A +ATOM 1213 CA GLY A 100 28.547 36.049 37.723 1.00 0.13 A +ATOM 1214 C GLY A 100 29.380 36.040 39.021 1.00 0.12 A +ATOM 1215 O GLY A 100 29.981 37.037 39.387 1.00 0.12 A +ATOM 1216 H GLY A 100 28.699 34.228 36.640 1.00 0.13 A +ATOM 1217 1HA GLY A 100 29.138 36.505 36.943 1.00 0.12 A +ATOM 1218 2HA GLY A 100 27.661 36.640 37.897 1.00 0.13 A +ATOM 1219 N GLU A 101 29.409 34.955 39.706 1.00 0.13 A +ATOM 1220 CA GLU A 101 30.155 34.843 40.952 1.00 0.13 A +ATOM 1221 C GLU A 101 31.670 35.057 40.741 1.00 0.12 A +ATOM 1222 O GLU A 101 32.304 34.329 40.002 1.00 0.12 A +ATOM 1223 CB GLU A 101 29.936 33.470 41.602 1.00 0.14 A +ATOM 1224 CG GLU A 101 29.601 33.592 43.122 1.00 0.15 A +ATOM 1225 CD GLU A 101 30.363 32.545 43.942 1.00 0.15 A +ATOM 1226 OE1 GLU A 101 30.358 31.390 43.543 1.00 0.16 A +ATOM 1227 OE2 GLU A 101 30.925 32.918 44.965 1.00 0.15 A +ATOM 1228 H GLU A 101 28.914 34.176 39.376 1.00 0.14 A +ATOM 1229 HA GLU A 101 29.824 35.613 41.632 1.00 0.13 A +ATOM 1230 1HB GLU A 101 29.112 32.981 41.099 1.00 0.15 A +ATOM 1231 2HB GLU A 101 30.823 32.861 41.477 1.00 0.14 A +ATOM 1232 1HG GLU A 101 29.866 34.570 43.487 1.00 0.14 A +ATOM 1233 2HG GLU A 101 28.542 33.438 43.262 1.00 0.15 A +ATOM 1234 N GLY A 102 32.242 36.057 41.425 1.00 0.12 A +ATOM 1235 CA GLY A 102 33.663 36.346 41.348 1.00 0.11 A +ATOM 1236 C GLY A 102 34.037 37.460 40.386 1.00 0.10 A +ATOM 1237 O GLY A 102 35.165 37.871 40.347 1.00 0.10 A +ATOM 1238 H GLY A 102 31.682 36.624 41.996 1.00 0.12 A +ATOM 1239 1HA GLY A 102 33.995 36.628 42.336 1.00 0.12 A +ATOM 1240 2HA GLY A 102 34.166 35.440 41.042 1.00 0.12 A +ATOM 1241 N PHE A 103 33.101 37.932 39.646 1.00 0.10 A +ATOM 1242 CA PHE A 103 33.278 39.036 38.705 1.00 0.09 A +ATOM 1243 C PHE A 103 32.430 40.259 39.120 1.00 0.09 A +ATOM 1244 O PHE A 103 31.382 40.132 39.721 1.00 0.10 A +ATOM 1245 CB PHE A 103 32.807 38.647 37.280 1.00 0.09 A +ATOM 1246 CG PHE A 103 33.515 37.392 36.833 1.00 0.09 A +ATOM 1247 CD1 PHE A 103 34.812 37.464 36.328 1.00 0.09 A +ATOM 1248 CD2 PHE A 103 32.862 36.158 36.911 1.00 0.10 A +ATOM 1249 CE1 PHE A 103 35.458 36.300 35.894 1.00 0.09 A +ATOM 1250 CE2 PHE A 103 33.506 34.994 36.483 1.00 0.10 A +ATOM 1251 CZ PHE A 103 34.804 35.065 35.971 1.00 0.10 A +ATOM 1252 H PHE A 103 32.212 37.532 39.728 1.00 0.11 A +ATOM 1253 HA PHE A 103 34.322 39.302 38.669 1.00 0.09 A +ATOM 1254 1HB PHE A 103 31.740 38.477 37.287 1.00 0.10 A +ATOM 1255 2HB PHE A 103 33.038 39.453 36.605 1.00 0.09 A +ATOM 1256 HD1 PHE A 103 35.316 38.415 36.270 1.00 0.08 A +ATOM 1257 HD2 PHE A 103 31.863 36.104 37.312 1.00 0.11 A +ATOM 1258 HE1 PHE A 103 36.462 36.355 35.505 1.00 0.08 A +ATOM 1259 HE2 PHE A 103 32.998 34.043 36.545 1.00 0.11 A +ATOM 1260 HZ PHE A 103 35.301 34.169 35.630 1.00 0.10 A +ATOM 1261 N LYS A 104 32.896 41.432 38.742 1.00 0.09 A +ATOM 1262 CA LYS A 104 32.228 42.690 38.968 1.00 0.09 A +ATOM 1263 C LYS A 104 32.422 43.580 37.763 1.00 0.08 A +ATOM 1264 O LYS A 104 33.520 44.017 37.472 1.00 0.08 A +ATOM 1265 CB LYS A 104 32.642 43.452 40.217 1.00 0.09 A +ATOM 1266 CG LYS A 104 32.857 42.506 41.420 1.00 0.09 A +ATOM 1267 CD LYS A 104 34.239 41.818 41.348 1.00 0.09 A +ATOM 1268 CE LYS A 104 34.229 40.470 42.093 1.00 0.10 A +ATOM 1269 NZ LYS A 104 35.477 39.704 41.796 1.00 0.10 A +ATOM 1270 H LYS A 104 33.746 41.454 38.257 1.00 0.08 A +ATOM 1271 HA LYS A 104 31.169 42.492 39.039 1.00 0.09 A +ATOM 1272 1HB LYS A 104 33.563 43.985 40.022 1.00 0.09 A +ATOM 1273 2HB LYS A 104 31.870 44.167 40.468 1.00 0.09 A +ATOM 1274 1HG LYS A 104 32.807 43.090 42.329 1.00 0.10 A +ATOM 1275 2HG LYS A 104 32.079 41.764 41.431 1.00 0.10 A +ATOM 1276 1HD LYS A 104 34.494 41.649 40.334 1.00 0.09 A +ATOM 1277 2HD LYS A 104 34.984 42.460 41.795 1.00 0.09 A +ATOM 1278 1HE LYS A 104 34.168 40.647 43.153 1.00 0.10 A +ATOM 1279 2HE LYS A 104 33.376 39.889 41.775 1.00 0.10 A +ATOM 1280 1HZ LYS A 104 35.295 39.028 41.025 1.00 0.10 A +ATOM 1281 2HZ LYS A 104 35.773 39.182 42.648 1.00 0.10 A +ATOM 1282 3HZ LYS A 104 36.234 40.356 41.510 1.00 0.09 A +ATOM 1283 N ARG A 105 31.345 43.858 37.070 1.00 0.09 A +ATOM 1284 CA ARG A 105 31.422 44.722 35.913 1.00 0.08 A +ATOM 1285 C ARG A 105 31.755 46.083 36.329 1.00 0.08 A +ATOM 1286 O ARG A 105 31.069 46.672 37.144 1.00 0.09 A +ATOM 1287 CB ARG A 105 30.170 44.662 35.063 1.00 0.09 A +ATOM 1288 CG ARG A 105 29.981 45.853 34.129 1.00 0.09 A +ATOM 1289 CD ARG A 105 28.582 45.813 33.476 1.00 0.10 A +ATOM 1290 NE ARG A 105 28.176 44.391 33.193 1.00 0.10 A +ATOM 1291 CZ ARG A 105 27.284 44.106 32.274 1.00 0.11 A +ATOM 1292 NH1 ARG A 105 26.790 45.062 31.516 1.00 0.12 A +ATOM 1293 NH2 ARG A 105 26.890 42.873 32.087 1.00 0.12 A +ATOM 1294 H ARG A 105 30.481 43.483 37.339 1.00 0.09 A +ATOM 1295 HA ARG A 105 32.265 44.421 35.310 1.00 0.08 A +ATOM 1296 1HB ARG A 105 30.206 43.766 34.463 1.00 0.09 A +ATOM 1297 2HB ARG A 105 29.316 44.599 35.722 1.00 0.10 A +ATOM 1298 1HG ARG A 105 30.065 46.771 34.687 1.00 0.09 A +ATOM 1299 2HG ARG A 105 30.733 45.827 33.360 1.00 0.09 A +ATOM 1300 1HD ARG A 105 27.859 46.233 34.127 1.00 0.11 A +ATOM 1301 2HD ARG A 105 28.612 46.423 32.572 1.00 0.10 A +ATOM 1302 1HH1 ARG A 105 27.086 46.009 31.643 1.00 0.12 A +ATOM 1303 2HH1 ARG A 105 26.132 44.838 30.794 1.00 0.12 A +ATOM 1304 1HH2 ARG A 105 27.257 42.138 32.649 1.00 0.11 A +ATOM 1305 2HH2 ARG A 105 26.231 42.666 31.363 1.00 0.12 A +ATOM 1306 N ILE A 106 32.834 46.629 35.785 1.00 0.08 A +ATOM 1307 CA ILE A 106 33.127 47.940 36.226 1.00 0.08 A +ATOM 1308 C ILE A 106 32.774 48.896 35.118 1.00 0.09 A +ATOM 1309 O ILE A 106 32.323 49.999 35.369 1.00 0.09 A +ATOM 1310 CB ILE A 106 34.587 48.049 36.605 1.00 0.08 A +ATOM 1311 CG1 ILE A 106 34.931 47.101 37.746 1.00 0.08 A +ATOM 1312 CG2 ILE A 106 34.973 49.502 36.933 1.00 0.09 A +ATOM 1313 CD1 ILE A 106 34.335 47.554 39.080 1.00 0.08 A +ATOM 1314 H ILE A 106 33.386 46.148 35.134 1.00 0.08 A +ATOM 1315 HA ILE A 106 32.516 48.173 37.085 1.00 0.09 A +ATOM 1316 HB ILE A 106 35.170 47.753 35.740 1.00 0.08 A +ATOM 1317 1HG1 ILE A 106 34.560 46.115 37.510 1.00 0.08 A +ATOM 1318 2HG1 ILE A 106 35.995 47.072 37.830 1.00 0.08 A +ATOM 1319 1HG2 ILE A 106 35.221 50.026 36.018 1.00 0.09 A +ATOM 1320 2HG2 ILE A 106 35.834 49.509 37.588 1.00 0.09 A +ATOM 1321 3HG2 ILE A 106 34.149 50.000 37.418 1.00 0.09 A +ATOM 1322 1HD1 ILE A 106 34.447 48.618 39.195 1.00 0.09 A +ATOM 1323 2HD1 ILE A 106 34.859 47.055 39.883 1.00 0.09 A +ATOM 1324 3HD1 ILE A 106 33.291 47.291 39.115 1.00 0.09 A +ATOM 1325 N ALA A 107 32.968 48.498 33.880 1.00 0.09 A +ATOM 1326 CA ALA A 107 32.652 49.400 32.809 1.00 0.09 A +ATOM 1327 C ALA A 107 31.241 49.164 32.249 1.00 0.10 A +ATOM 1328 O ALA A 107 30.533 48.272 32.683 1.00 0.10 A +ATOM 1329 CB ALA A 107 33.688 49.282 31.697 1.00 0.09 A +ATOM 1330 H ALA A 107 33.335 47.607 33.700 1.00 0.08 A +ATOM 1331 HA ALA A 107 32.646 50.412 33.184 1.00 0.10 A +ATOM 1332 1HB ALA A 107 33.636 48.298 31.257 1.00 0.08 A +ATOM 1333 2HB ALA A 107 34.670 49.448 32.107 1.00 0.09 A +ATOM 1334 3HB ALA A 107 33.488 50.027 30.941 1.00 0.09 A +ATOM 1335 N GLU A 108 30.832 49.981 31.266 1.00 0.10 A +ATOM 1336 CA GLU A 108 29.516 49.819 30.654 1.00 0.11 A +ATOM 1337 C GLU A 108 29.598 49.502 29.161 1.00 0.12 A +ATOM 1338 O GLU A 108 30.503 49.943 28.485 1.00 0.11 A +ATOM 1339 CB GLU A 108 28.666 51.102 30.727 1.00 0.12 A +ATOM 1340 CG GLU A 108 28.699 51.805 32.080 1.00 0.12 A +ATOM 1341 CD GLU A 108 27.819 53.060 31.992 1.00 0.13 A +ATOM 1342 OE1 GLU A 108 27.467 53.447 30.883 1.00 0.14 A +ATOM 1343 OE2 GLU A 108 27.503 53.607 33.039 1.00 0.13 A +ATOM 1344 H GLU A 108 31.438 50.677 30.935 1.00 0.11 A +ATOM 1345 HA GLU A 108 28.991 49.027 31.167 1.00 0.11 A +ATOM 1346 1HB GLU A 108 29.017 51.801 29.981 1.00 0.13 A +ATOM 1347 2HB GLU A 108 27.642 50.842 30.499 1.00 0.13 A +ATOM 1348 1HG GLU A 108 28.313 51.151 32.845 1.00 0.12 A +ATOM 1349 2HG GLU A 108 29.710 52.096 32.318 1.00 0.12 A +ATOM 1350 N GLU A 109 28.613 48.790 28.621 1.00 0.12 A +ATOM 1351 CA GLU A 109 28.624 48.563 27.164 1.00 0.12 A +ATOM 1352 C GLU A 109 28.551 49.935 26.469 1.00 0.13 A +ATOM 1353 O GLU A 109 27.810 50.815 26.861 1.00 0.14 A +ATOM 1354 CB GLU A 109 27.573 47.598 26.537 1.00 0.13 A +ATOM 1355 CG GLU A 109 27.709 46.212 27.140 1.00 0.16 A +ATOM 1356 CD GLU A 109 26.631 45.298 26.557 1.00 1.02 A +ATOM 1357 OE1 GLU A 109 25.843 45.778 25.758 1.00 1.60 A +ATOM 1358 OE2 GLU A 109 26.604 44.137 26.926 1.00 1.25 A +ATOM 1359 H GLU A 109 27.882 48.441 29.174 1.00 0.12 A +ATOM 1360 HA GLU A 109 29.600 48.173 26.914 1.00 0.12 A +ATOM 1361 1HB GLU A 109 26.580 47.976 26.730 1.00 0.16 A +ATOM 1362 2HB GLU A 109 27.733 47.541 25.470 1.00 0.15 A +ATOM 1363 1HG GLU A 109 28.678 45.826 26.897 1.00 0.73 A +ATOM 1364 2HG GLU A 109 27.595 46.266 28.210 1.00 0.65 A +ATOM 1365 N GLY A 110 29.344 50.106 25.433 1.00 0.13 A +ATOM 1366 CA GLY A 110 29.399 51.366 24.668 1.00 0.14 A +ATOM 1367 C GLY A 110 30.417 52.318 25.239 1.00 0.14 A +ATOM 1368 O GLY A 110 30.672 53.377 24.691 1.00 0.14 A +ATOM 1369 H GLY A 110 29.916 49.366 25.145 1.00 0.13 A +ATOM 1370 1HA GLY A 110 29.657 51.137 23.645 1.00 0.14 A +ATOM 1371 2HA GLY A 110 28.425 51.831 24.698 1.00 0.15 A +ATOM 1372 N GLN A 111 31.000 51.967 26.333 1.00 0.13 A +ATOM 1373 CA GLN A 111 31.983 52.848 26.895 1.00 0.13 A +ATOM 1374 C GLN A 111 33.220 52.993 26.017 1.00 0.13 A +ATOM 1375 O GLN A 111 33.776 52.043 25.495 1.00 0.12 A +ATOM 1376 CB GLN A 111 32.432 52.339 28.287 1.00 0.12 A +ATOM 1377 CG GLN A 111 33.037 53.489 29.104 1.00 0.12 A +ATOM 1378 CD GLN A 111 33.268 53.040 30.542 1.00 0.11 A +ATOM 1379 OE1 GLN A 111 32.370 52.527 31.192 1.00 0.11 A +ATOM 1380 NE2 GLN A 111 34.451 53.223 31.064 1.00 0.11 A +ATOM 1381 H GLN A 111 30.772 51.120 26.767 1.00 0.12 A +ATOM 1382 HA GLN A 111 31.560 53.836 26.998 1.00 0.13 A +ATOM 1383 1HB GLN A 111 31.579 51.945 28.813 1.00 0.12 A +ATOM 1384 2HB GLN A 111 33.170 51.561 28.168 1.00 0.11 A +ATOM 1385 1HG GLN A 111 33.982 53.776 28.672 1.00 0.12 A +ATOM 1386 2HG GLN A 111 32.365 54.333 29.098 1.00 0.13 A +ATOM 1387 1HE2 GLN A 111 35.157 53.646 30.529 1.00 0.11 A +ATOM 1388 2HE2 GLN A 111 34.640 52.931 31.980 1.00 0.11 A +ATOM 1389 N ARG A 112 33.671 54.218 25.927 1.00 0.13 A +ATOM 1390 CA ARG A 112 34.866 54.540 25.229 1.00 0.14 A +ATOM 1391 C ARG A 112 35.998 54.363 26.183 1.00 0.13 A +ATOM 1392 O ARG A 112 35.928 54.792 27.322 1.00 0.13 A +ATOM 1393 CB ARG A 112 34.852 55.918 24.588 1.00 0.15 A +ATOM 1394 CG ARG A 112 35.198 55.803 23.085 1.00 0.15 A +ATOM 1395 CD ARG A 112 34.867 57.120 22.329 1.00 0.16 A +ATOM 1396 NE ARG A 112 36.005 57.637 21.512 1.00 0.17 A +ATOM 1397 CZ ARG A 112 36.794 56.891 20.836 1.00 0.16 A +ATOM 1398 NH1 ARG A 112 36.488 55.623 20.643 1.00 0.16 A +ATOM 1399 NH2 ARG A 112 37.852 57.402 20.268 1.00 0.17 A +ATOM 1400 H ARG A 112 33.186 54.932 26.392 1.00 0.14 A +ATOM 1401 HA ARG A 112 35.014 53.805 24.453 1.00 0.13 A +ATOM 1402 1HB ARG A 112 33.866 56.348 24.694 1.00 0.15 A +ATOM 1403 2HB ARG A 112 35.575 56.562 25.070 1.00 0.15 A +ATOM 1404 1HG ARG A 112 36.251 55.594 22.995 1.00 0.15 A +ATOM 1405 2HG ARG A 112 34.634 54.994 22.645 1.00 0.15 A +ATOM 1406 1HD ARG A 112 33.945 56.945 21.731 1.00 0.17 A +ATOM 1407 2HD ARG A 112 34.711 57.906 23.003 1.00 0.17 A +ATOM 1408 1HH1 ARG A 112 35.640 55.250 21.025 1.00 0.16 A +ATOM 1409 2HH1 ARG A 112 37.094 55.034 20.107 1.00 0.15 A +ATOM 1410 1HH2 ARG A 112 38.045 58.379 20.360 1.00 0.18 A +ATOM 1411 2HH2 ARG A 112 38.463 56.821 19.729 1.00 0.17 A +ATOM 1412 N VAL A 113 37.042 53.689 25.755 1.00 0.12 A +ATOM 1413 CA VAL A 113 38.113 53.455 26.693 1.00 0.12 A +ATOM 1414 C VAL A 113 39.448 53.595 26.089 1.00 0.12 A +ATOM 1415 O VAL A 113 39.660 53.456 24.897 1.00 0.12 A +ATOM 1416 CB VAL A 113 38.091 52.029 27.244 1.00 0.10 A +ATOM 1417 CG1 VAL A 113 36.789 51.764 27.999 1.00 0.10 A +ATOM 1418 CG2 VAL A 113 38.256 51.019 26.111 1.00 0.10 A +ATOM 1419 H VAL A 113 37.076 53.345 24.839 1.00 0.12 A +ATOM 1420 HA VAL A 113 38.014 54.149 27.516 1.00 0.12 A +ATOM 1421 HB VAL A 113 38.911 51.911 27.924 1.00 0.10 A +ATOM 1422 1HG1 VAL A 113 35.965 51.732 27.304 1.00 0.11 A +ATOM 1423 2HG1 VAL A 113 36.626 52.551 28.721 1.00 0.11 A +ATOM 1424 3HG1 VAL A 113 36.863 50.816 28.515 1.00 0.09 A +ATOM 1425 1HG2 VAL A 113 37.614 51.286 25.287 1.00 0.11 A +ATOM 1426 2HG2 VAL A 113 37.996 50.041 26.477 1.00 0.09 A +ATOM 1427 3HG2 VAL A 113 39.287 51.015 25.782 1.00 0.10 A +ATOM 1428 N LYS A 114 40.358 53.787 26.977 1.00 0.12 A +ATOM 1429 CA LYS A 114 41.739 53.839 26.635 1.00 0.12 A +ATOM 1430 C LYS A 114 42.414 52.614 27.195 1.00 0.11 A +ATOM 1431 O LYS A 114 41.971 52.030 28.169 1.00 0.10 A +ATOM 1432 CB LYS A 114 42.454 55.038 27.227 1.00 0.13 A +ATOM 1433 CG LYS A 114 41.910 56.369 26.670 1.00 0.14 A +ATOM 1434 CD LYS A 114 41.487 57.340 27.796 1.00 0.14 A +ATOM 1435 CE LYS A 114 40.492 56.687 28.779 1.00 0.14 A +ATOM 1436 NZ LYS A 114 40.461 57.426 30.075 1.00 0.14 A +ATOM 1437 H LYS A 114 40.094 53.874 27.917 1.00 0.11 A +ATOM 1438 HA LYS A 114 41.826 53.885 25.559 1.00 0.12 A +ATOM 1439 1HB LYS A 114 42.378 55.003 28.292 1.00 0.12 A +ATOM 1440 2HB LYS A 114 43.505 54.958 26.977 1.00 0.13 A +ATOM 1441 1HG LYS A 114 42.694 56.845 26.090 1.00 0.14 A +ATOM 1442 2HG LYS A 114 41.068 56.180 26.024 1.00 0.14 A +ATOM 1443 1HD LYS A 114 42.363 57.664 28.333 1.00 0.15 A +ATOM 1444 2HD LYS A 114 41.013 58.196 27.340 1.00 0.15 A +ATOM 1445 1HE LYS A 114 39.509 56.689 28.348 1.00 0.14 A +ATOM 1446 2HE LYS A 114 40.777 55.689 28.974 1.00 0.13 A +ATOM 1447 1HZ LYS A 114 39.564 57.939 30.159 1.00 0.14 A +ATOM 1448 2HZ LYS A 114 41.255 58.096 30.118 1.00 0.15 A +ATOM 1449 3HZ LYS A 114 40.541 56.745 30.860 1.00 0.13 A +ATOM 1450 N VAL A 115 43.507 52.259 26.616 1.00 0.11 A +ATOM 1451 CA VAL A 115 44.274 51.158 27.108 1.00 0.10 A +ATOM 1452 C VAL A 115 44.437 51.218 28.626 1.00 0.10 A +ATOM 1453 O VAL A 115 44.738 52.250 29.194 1.00 0.10 A +ATOM 1454 CB VAL A 115 45.653 51.216 26.494 1.00 0.10 A +ATOM 1455 CG1 VAL A 115 46.467 49.992 26.928 1.00 0.09 A +ATOM 1456 CG2 VAL A 115 45.512 51.219 24.954 1.00 0.10 A +ATOM 1457 H VAL A 115 43.827 52.763 25.840 1.00 0.11 A +ATOM 1458 HA VAL A 115 43.794 50.229 26.834 1.00 0.09 A +ATOM 1459 HB VAL A 115 46.156 52.115 26.821 1.00 0.11 A +ATOM 1460 1HG1 VAL A 115 45.901 49.094 26.727 1.00 0.08 A +ATOM 1461 2HG1 VAL A 115 46.691 50.054 27.979 1.00 0.09 A +ATOM 1462 3HG1 VAL A 115 47.387 49.965 26.365 1.00 0.10 A +ATOM 1463 1HG2 VAL A 115 44.474 51.088 24.677 1.00 0.10 A +ATOM 1464 2HG2 VAL A 115 46.090 50.412 24.526 1.00 0.10 A +ATOM 1465 3HG2 VAL A 115 45.866 52.158 24.559 1.00 0.11 A +ATOM 1466 N GLY A 116 44.263 50.094 29.283 1.00 0.09 A +ATOM 1467 CA GLY A 116 44.437 50.039 30.711 1.00 0.09 A +ATOM 1468 C GLY A 116 43.170 50.347 31.516 1.00 0.09 A +ATOM 1469 O GLY A 116 43.124 50.096 32.703 1.00 0.08 A +ATOM 1470 H GLY A 116 44.025 49.278 28.793 1.00 0.08 A +ATOM 1471 1HA GLY A 116 44.769 49.046 30.970 1.00 0.08 A +ATOM 1472 2HA GLY A 116 45.197 50.757 30.982 1.00 0.09 A +ATOM 1473 N ASP A 117 42.155 50.866 30.907 1.00 0.09 A +ATOM 1474 CA ASP A 117 40.906 51.163 31.638 1.00 0.09 A +ATOM 1475 C ASP A 117 40.301 49.874 32.169 1.00 0.08 A +ATOM 1476 O ASP A 117 40.273 48.866 31.494 1.00 0.07 A +ATOM 1477 CB ASP A 117 39.916 51.977 30.757 1.00 0.10 A +ATOM 1478 CG ASP A 117 40.290 53.445 30.606 1.00 0.11 A +ATOM 1479 OD1 ASP A 117 41.131 53.929 31.350 1.00 0.11 A +ATOM 1480 OD2 ASP A 117 39.689 54.066 29.741 1.00 0.11 A +ATOM 1481 H ASP A 117 42.211 51.061 29.949 1.00 0.09 A +ATOM 1482 HA ASP A 117 41.144 51.734 32.523 1.00 0.09 A +ATOM 1483 1HB ASP A 117 39.898 51.529 29.789 1.00 0.09 A +ATOM 1484 2HB ASP A 117 38.928 51.909 31.193 1.00 0.09 A +ATOM 1485 N THR A 118 39.840 49.898 33.418 1.00 0.08 A +ATOM 1486 CA THR A 118 39.283 48.667 34.016 1.00 0.07 A +ATOM 1487 C THR A 118 37.904 48.393 33.499 1.00 0.07 A +ATOM 1488 O THR A 118 37.035 49.247 33.442 1.00 0.08 A +ATOM 1489 CB THR A 118 39.280 48.644 35.577 1.00 0.08 A +ATOM 1490 OG1 THR A 118 40.573 48.983 36.052 1.00 0.08 A +ATOM 1491 CG2 THR A 118 38.881 47.270 36.127 1.00 0.07 A +ATOM 1492 H THR A 118 39.877 50.726 33.941 1.00 0.09 A +ATOM 1493 HA THR A 118 39.869 47.830 33.668 1.00 0.07 A +ATOM 1494 HB THR A 118 38.571 49.377 35.935 1.00 0.08 A +ATOM 1495 HG1 THR A 118 40.475 49.380 36.920 1.00 0.08 A +ATOM 1496 1HG2 THR A 118 37.833 47.093 35.933 1.00 0.07 A +ATOM 1497 2HG2 THR A 118 39.052 47.253 37.196 1.00 0.07 A +ATOM 1498 3HG2 THR A 118 39.472 46.501 35.658 1.00 0.06 A +ATOM 1499 N VAL A 119 37.729 47.154 33.115 1.00 0.06 A +ATOM 1500 CA VAL A 119 36.503 46.699 32.601 1.00 0.07 A +ATOM 1501 C VAL A 119 35.812 45.846 33.639 1.00 0.06 A +ATOM 1502 O VAL A 119 34.637 46.013 33.916 1.00 0.07 A +ATOM 1503 CB VAL A 119 36.746 45.897 31.302 1.00 0.06 A +ATOM 1504 CG1 VAL A 119 35.407 45.478 30.686 1.00 0.07 A +ATOM 1505 CG2 VAL A 119 37.548 46.716 30.287 1.00 0.06 A +ATOM 1506 H VAL A 119 38.477 46.527 33.195 1.00 0.06 A +ATOM 1507 HA VAL A 119 35.866 47.546 32.386 1.00 0.07 A +ATOM 1508 HB VAL A 119 37.307 45.005 31.548 1.00 0.06 A +ATOM 1509 1HG1 VAL A 119 34.789 46.348 30.529 1.00 0.07 A +ATOM 1510 2HG1 VAL A 119 34.903 44.794 31.352 1.00 0.07 A +ATOM 1511 3HG1 VAL A 119 35.584 44.987 29.739 1.00 0.07 A +ATOM 1512 1HG2 VAL A 119 37.742 46.108 29.413 1.00 0.06 A +ATOM 1513 2HG2 VAL A 119 38.486 47.017 30.726 1.00 0.06 A +ATOM 1514 3HG2 VAL A 119 36.987 47.590 29.997 1.00 0.07 A +ATOM 1515 N ILE A 120 36.539 44.928 34.199 1.00 0.06 A +ATOM 1516 CA ILE A 120 35.997 44.014 35.157 1.00 0.06 A +ATOM 1517 C ILE A 120 36.964 43.577 36.189 1.00 0.06 A +ATOM 1518 O ILE A 120 38.118 43.318 35.893 1.00 0.06 A +ATOM 1519 CB ILE A 120 35.564 42.765 34.443 1.00 0.06 A +ATOM 1520 CG1 ILE A 120 34.228 42.991 33.688 1.00 0.07 A +ATOM 1521 CG2 ILE A 120 35.419 41.584 35.433 1.00 0.07 A +ATOM 1522 CD1 ILE A 120 34.138 42.129 32.422 1.00 0.07 A +ATOM 1523 H ILE A 120 37.483 44.857 33.945 1.00 0.06 A +ATOM 1524 HA ILE A 120 35.147 44.465 35.649 1.00 0.07 A +ATOM 1525 HB ILE A 120 36.328 42.511 33.727 1.00 0.06 A +ATOM 1526 1HG1 ILE A 120 33.409 42.739 34.331 1.00 0.07 A +ATOM 1527 2HG1 ILE A 120 34.139 44.009 33.400 1.00 0.07 A +ATOM 1528 1HG2 ILE A 120 34.970 41.937 36.350 1.00 0.07 A +ATOM 1529 2HG2 ILE A 120 36.399 41.172 35.646 1.00 0.06 A +ATOM 1530 3HG2 ILE A 120 34.801 40.818 35.000 1.00 0.07 A +ATOM 1531 1HD1 ILE A 120 33.226 42.375 31.894 1.00 0.07 A +ATOM 1532 2HD1 ILE A 120 34.126 41.086 32.691 1.00 0.07 A +ATOM 1533 3HD1 ILE A 120 34.984 42.331 31.781 1.00 0.06 A +ATOM 1534 N GLU A 121 36.480 43.404 37.412 1.00 0.07 A +ATOM 1535 CA GLU A 121 37.392 42.893 38.402 1.00 0.07 A +ATOM 1536 C GLU A 121 36.933 41.529 38.763 1.00 0.07 A +ATOM 1537 O GLU A 121 35.761 41.230 38.715 1.00 0.08 A +ATOM 1538 CB GLU A 121 37.539 43.810 39.621 1.00 0.08 A +ATOM 1539 CG GLU A 121 37.782 45.230 39.136 1.00 0.08 A +ATOM 1540 CD GLU A 121 37.721 46.193 40.316 1.00 0.08 A +ATOM 1541 OE1 GLU A 121 37.022 45.874 41.268 1.00 0.09 A +ATOM 1542 OE2 GLU A 121 38.371 47.225 40.255 1.00 0.09 A +ATOM 1543 H GLU A 121 35.546 43.613 37.626 1.00 0.07 A +ATOM 1544 HA GLU A 121 38.362 42.770 37.944 1.00 0.07 A +ATOM 1545 1HB GLU A 121 36.638 43.773 40.214 1.00 0.08 A +ATOM 1546 2HB GLU A 121 38.380 43.487 40.217 1.00 0.08 A +ATOM 1547 1HG GLU A 121 38.747 45.294 38.658 1.00 0.07 A +ATOM 1548 2HG GLU A 121 37.023 45.479 38.432 1.00 0.07 A +ATOM 1549 N PHE A 122 37.864 40.682 39.079 1.00 0.08 A +ATOM 1550 CA PHE A 122 37.530 39.336 39.427 1.00 0.08 A +ATOM 1551 C PHE A 122 38.257 38.884 40.709 1.00 0.09 A +ATOM 1552 O PHE A 122 39.232 39.469 41.138 1.00 0.09 A +ATOM 1553 CB PHE A 122 37.927 38.408 38.240 1.00 0.08 A +ATOM 1554 CG PHE A 122 39.362 38.595 37.783 1.00 0.07 A +ATOM 1555 CD1 PHE A 122 40.398 37.866 38.379 1.00 0.08 A +ATOM 1556 CD2 PHE A 122 39.645 39.440 36.703 1.00 0.07 A +ATOM 1557 CE1 PHE A 122 41.710 37.983 37.898 1.00 0.08 A +ATOM 1558 CE2 PHE A 122 40.956 39.562 36.229 1.00 0.06 A +ATOM 1559 CZ PHE A 122 41.988 38.832 36.823 1.00 0.07 A +ATOM 1560 H PHE A 122 38.801 40.967 39.071 1.00 0.08 A +ATOM 1561 HA PHE A 122 36.468 39.258 39.611 1.00 0.09 A +ATOM 1562 1HB PHE A 122 37.799 37.386 38.546 1.00 0.09 A +ATOM 1563 2HB PHE A 122 37.270 38.608 37.412 1.00 0.08 A +ATOM 1564 HD1 PHE A 122 40.188 37.217 39.213 1.00 0.09 A +ATOM 1565 HD2 PHE A 122 38.853 40.011 36.247 1.00 0.06 A +ATOM 1566 HE1 PHE A 122 42.507 37.412 38.352 1.00 0.08 A +ATOM 1567 HE2 PHE A 122 41.167 40.200 35.392 1.00 0.06 A +ATOM 1568 HZ PHE A 122 43.000 38.926 36.452 1.00 0.07 A +ATOM 1569 N ASP A 123 37.753 37.805 41.274 1.00 0.10 A +ATOM 1570 CA ASP A 123 38.306 37.148 42.458 1.00 0.11 A +ATOM 1571 C ASP A 123 39.124 35.922 42.037 1.00 0.11 A +ATOM 1572 O ASP A 123 38.567 34.873 41.780 1.00 0.12 A +ATOM 1573 CB ASP A 123 37.167 36.627 43.320 1.00 0.12 A +ATOM 1574 CG ASP A 123 37.636 36.259 44.727 1.00 0.13 A +ATOM 1575 OD1 ASP A 123 38.572 35.494 44.837 1.00 0.13 A +ATOM 1576 OD2 ASP A 123 37.024 36.726 45.676 1.00 0.13 A +ATOM 1577 H ASP A 123 36.968 37.393 40.858 1.00 0.10 A +ATOM 1578 HA ASP A 123 38.894 37.856 43.024 1.00 0.11 A +ATOM 1579 1HB ASP A 123 36.414 37.397 43.394 1.00 0.11 A +ATOM 1580 2HB ASP A 123 36.725 35.769 42.846 1.00 0.12 A +ATOM 1581 N LEU A 124 40.408 36.025 41.937 1.00 0.11 A +ATOM 1582 CA LEU A 124 41.177 34.891 41.456 1.00 0.11 A +ATOM 1583 C LEU A 124 41.061 33.622 42.262 1.00 0.12 A +ATOM 1584 O LEU A 124 40.787 32.556 41.727 1.00 0.13 A +ATOM 1585 CB LEU A 124 42.671 35.275 41.319 1.00 0.11 A +ATOM 1586 CG LEU A 124 43.506 34.374 40.342 1.00 0.11 A +ATOM 1587 CD1 LEU A 124 42.709 33.855 39.142 1.00 0.11 A +ATOM 1588 CD2 LEU A 124 44.698 35.182 39.800 1.00 0.11 A +ATOM 1589 H LEU A 124 40.855 36.872 42.140 1.00 0.11 A +ATOM 1590 HA LEU A 124 40.798 34.586 40.491 1.00 0.11 A +ATOM 1591 1HB LEU A 124 42.724 36.293 40.971 1.00 0.11 A +ATOM 1592 2HB LEU A 124 43.148 35.227 42.271 1.00 0.12 A +ATOM 1593 HG LEU A 124 43.893 33.530 40.893 1.00 0.12 A +ATOM 1594 1HD1 LEU A 124 42.184 34.670 38.673 1.00 0.10 A +ATOM 1595 2HD1 LEU A 124 42.008 33.110 39.467 1.00 0.11 A +ATOM 1596 3HD1 LEU A 124 43.389 33.411 38.430 1.00 0.11 A +ATOM 1597 1HD2 LEU A 124 44.335 35.994 39.186 1.00 0.10 A +ATOM 1598 2HD2 LEU A 124 45.327 34.536 39.204 1.00 0.11 A +ATOM 1599 3HD2 LEU A 124 45.272 35.581 40.622 1.00 0.11 A +ATOM 1600 N PRO A 125 41.317 33.692 43.480 1.00 0.13 A +ATOM 1601 CA PRO A 125 41.324 32.514 44.319 1.00 0.14 A +ATOM 1602 C PRO A 125 39.962 31.809 44.233 1.00 0.15 A +ATOM 1603 O PRO A 125 39.886 30.604 44.076 1.00 0.15 A +ATOM 1604 CB PRO A 125 41.611 33.060 45.712 1.00 0.15 A +ATOM 1605 CG PRO A 125 42.125 34.455 45.560 1.00 0.14 A +ATOM 1606 CD PRO A 125 41.571 34.943 44.249 1.00 0.13 A +ATOM 1607 HA PRO A 125 42.097 31.826 44.010 1.00 0.15 A +ATOM 1608 1HB PRO A 125 40.703 33.064 46.305 1.00 0.15 A +ATOM 1609 2HB PRO A 125 42.358 32.448 46.203 1.00 0.16 A +ATOM 1610 1HG PRO A 125 41.773 35.081 46.374 1.00 0.14 A +ATOM 1611 2HG PRO A 125 43.206 34.463 45.527 1.00 0.14 A +ATOM 1612 1HD PRO A 125 40.659 35.485 44.405 1.00 0.13 A +ATOM 1613 2HD PRO A 125 42.273 35.568 43.768 1.00 0.13 A +ATOM 1614 N LEU A 126 38.891 32.568 44.304 1.00 0.14 A +ATOM 1615 CA LEU A 126 37.557 31.995 44.183 1.00 0.14 A +ATOM 1616 C LEU A 126 37.449 31.246 42.841 1.00 0.14 A +ATOM 1617 O LEU A 126 37.058 30.091 42.795 1.00 0.15 A +ATOM 1618 CB LEU A 126 36.423 33.047 44.393 1.00 0.14 A +ATOM 1619 CG LEU A 126 35.045 32.742 43.758 1.00 0.14 A +ATOM 1620 CD1 LEU A 126 34.663 31.304 43.892 1.00 0.15 A +ATOM 1621 CD2 LEU A 126 33.954 33.569 44.457 1.00 0.14 A +ATOM 1622 H LEU A 126 38.991 33.536 44.426 1.00 0.14 A +ATOM 1623 HA LEU A 126 37.448 31.218 44.925 1.00 0.15 A +ATOM 1624 1HB LEU A 126 36.280 33.173 45.454 1.00 0.15 A +ATOM 1625 2HB LEU A 126 36.775 33.970 43.998 1.00 0.13 A +ATOM 1626 HG LEU A 126 35.066 33.005 42.714 1.00 0.13 A +ATOM 1627 1HD1 LEU A 126 33.596 31.199 43.721 1.00 0.15 A +ATOM 1628 2HD1 LEU A 126 34.912 30.933 44.874 1.00 0.16 A +ATOM 1629 3HD1 LEU A 126 35.179 30.758 43.155 1.00 0.15 A +ATOM 1630 1HD2 LEU A 126 33.094 33.638 43.807 1.00 0.14 A +ATOM 1631 2HD2 LEU A 126 34.327 34.553 44.674 1.00 0.14 A +ATOM 1632 3HD2 LEU A 126 33.664 33.080 45.381 1.00 0.15 A +ATOM 1633 N LEU A 127 37.800 31.870 41.779 1.00 0.13 A +ATOM 1634 CA LEU A 127 37.708 31.261 40.455 1.00 0.13 A +ATOM 1635 C LEU A 127 38.689 30.140 40.281 1.00 0.14 A +ATOM 1636 O LEU A 127 38.451 29.195 39.551 1.00 0.14 A +ATOM 1637 CB LEU A 127 38.013 32.319 39.392 1.00 0.12 A +ATOM 1638 CG LEU A 127 37.016 33.458 39.454 1.00 0.11 A +ATOM 1639 CD1 LEU A 127 37.561 34.632 38.642 1.00 0.10 A +ATOM 1640 CD2 LEU A 127 35.699 32.990 38.839 1.00 0.12 A +ATOM 1641 H LEU A 127 38.140 32.784 41.860 1.00 0.13 A +ATOM 1642 HA LEU A 127 36.711 30.873 40.303 1.00 0.13 A +ATOM 1643 1HB LEU A 127 39.009 32.705 39.561 1.00 0.12 A +ATOM 1644 2HB LEU A 127 37.980 31.859 38.415 1.00 0.12 A +ATOM 1645 HG LEU A 127 36.868 33.760 40.482 1.00 0.12 A +ATOM 1646 1HD1 LEU A 127 37.930 34.272 37.694 1.00 0.10 A +ATOM 1647 2HD1 LEU A 127 38.367 35.105 39.186 1.00 0.10 A +ATOM 1648 3HD1 LEU A 127 36.770 35.343 38.473 1.00 0.10 A +ATOM 1649 1HD2 LEU A 127 35.043 33.832 38.705 1.00 0.11 A +ATOM 1650 2HD2 LEU A 127 35.234 32.275 39.491 1.00 0.13 A +ATOM 1651 3HD2 LEU A 127 35.893 32.531 37.879 1.00 0.12 A +ATOM 1652 N GLU A 128 39.796 30.230 40.913 1.00 0.14 A +ATOM 1653 CA GLU A 128 40.757 29.171 40.770 1.00 0.14 A +ATOM 1654 C GLU A 128 40.135 27.936 41.376 1.00 0.16 A +ATOM 1655 O GLU A 128 40.266 26.837 40.872 1.00 0.16 A +ATOM 1656 CB GLU A 128 42.055 29.531 41.454 1.00 0.14 A +ATOM 1657 CG GLU A 128 43.001 30.188 40.444 1.00 0.14 A +ATOM 1658 CD GLU A 128 44.366 30.420 41.068 1.00 0.14 A +ATOM 1659 OE1 GLU A 128 44.452 30.421 42.286 1.00 0.15 A +ATOM 1660 OE2 GLU A 128 45.311 30.582 40.306 1.00 0.14 A +ATOM 1661 H GLU A 128 39.982 31.005 41.485 1.00 0.14 A +ATOM 1662 HA GLU A 128 40.944 29.001 39.721 1.00 0.14 A +ATOM 1663 1HB GLU A 128 41.856 30.220 42.262 1.00 0.14 A +ATOM 1664 2HB GLU A 128 42.525 28.640 41.849 1.00 0.15 A +ATOM 1665 1HG GLU A 128 43.119 29.545 39.585 1.00 0.14 A +ATOM 1666 2HG GLU A 128 42.589 31.122 40.134 1.00 0.13 A +ATOM 1667 N GLU A 129 39.423 28.142 42.446 1.00 0.16 A +ATOM 1668 CA GLU A 129 38.732 27.050 43.099 1.00 0.17 A +ATOM 1669 C GLU A 129 37.481 26.600 42.359 1.00 0.17 A +ATOM 1670 O GLU A 129 37.204 25.416 42.284 1.00 0.18 A +ATOM 1671 CB GLU A 129 38.267 27.444 44.497 1.00 0.17 A +ATOM 1672 CG GLU A 129 37.519 26.265 45.158 1.00 0.19 A +ATOM 1673 CD GLU A 129 37.663 26.311 46.681 1.00 0.19 A +ATOM 1674 OE1 GLU A 129 38.697 25.888 47.180 1.00 0.20 A +ATOM 1675 OE2 GLU A 129 36.720 26.756 47.321 1.00 0.19 A +ATOM 1676 H GLU A 129 39.337 29.051 42.805 1.00 0.16 A +ATOM 1677 HA GLU A 129 39.401 26.205 43.176 1.00 0.18 A +ATOM 1678 1HB GLU A 129 39.128 27.712 45.093 1.00 0.18 A +ATOM 1679 2HB GLU A 129 37.603 28.294 44.426 1.00 0.17 A +ATOM 1680 1HG GLU A 129 36.471 26.329 44.910 1.00 0.19 A +ATOM 1681 2HG GLU A 129 37.916 25.329 44.791 1.00 0.19 A +ATOM 1682 N LYS A 130 36.688 27.514 41.863 1.00 0.16 A +ATOM 1683 CA LYS A 130 35.447 27.115 41.235 1.00 0.17 A +ATOM 1684 C LYS A 130 35.480 26.941 39.729 1.00 0.16 A +ATOM 1685 O LYS A 130 34.707 26.168 39.194 1.00 0.17 A +ATOM 1686 CB LYS A 130 34.311 28.041 41.596 1.00 0.16 A +ATOM 1687 CG LYS A 130 34.255 28.297 43.102 1.00 0.17 A +ATOM 1688 CD LYS A 130 32.902 27.866 43.741 1.00 0.18 A +ATOM 1689 CE LYS A 130 33.114 26.771 44.808 1.00 0.19 A +ATOM 1690 NZ LYS A 130 32.239 25.609 44.524 1.00 0.20 A +ATOM 1691 H LYS A 130 36.927 28.461 41.934 1.00 0.16 A +ATOM 1692 HA LYS A 130 35.199 26.114 41.557 1.00 0.18 A +ATOM 1693 1HB LYS A 130 34.446 28.976 41.062 1.00 0.16 A +ATOM 1694 2HB LYS A 130 33.395 27.587 41.260 1.00 0.17 A +ATOM 1695 1HG LYS A 130 35.082 27.828 43.594 1.00 0.17 A +ATOM 1696 2HG LYS A 130 34.354 29.301 43.234 1.00 0.16 A +ATOM 1697 1HD LYS A 130 32.443 28.733 44.211 1.00 0.17 A +ATOM 1698 2HD LYS A 130 32.228 27.498 42.987 1.00 0.18 A +ATOM 1699 1HE LYS A 130 34.135 26.432 44.809 1.00 0.19 A +ATOM 1700 2HE LYS A 130 32.873 27.168 45.780 1.00 0.19 A +ATOM 1701 1HZ LYS A 130 31.244 25.903 44.564 1.00 0.20 A +ATOM 1702 2HZ LYS A 130 32.416 24.873 45.237 1.00 0.20 A +ATOM 1703 3HZ LYS A 130 32.453 25.235 43.577 1.00 0.20 A +ATOM 1704 N ALA A 131 36.285 27.625 39.039 1.00 0.15 A +ATOM 1705 CA ALA A 131 36.276 27.522 37.604 1.00 0.15 A +ATOM 1706 C ALA A 131 36.974 26.294 37.033 1.00 0.16 A +ATOM 1707 O ALA A 131 37.992 25.851 37.521 1.00 0.16 A +ATOM 1708 CB ALA A 131 36.850 28.805 37.039 1.00 0.14 A +ATOM 1709 H ALA A 131 36.895 28.253 39.481 1.00 0.15 A +ATOM 1710 HA ALA A 131 35.265 27.386 37.251 1.00 0.15 A +ATOM 1711 1HB ALA A 131 36.697 28.828 35.970 1.00 0.13 A +ATOM 1712 2HB ALA A 131 37.907 28.850 37.253 1.00 0.14 A +ATOM 1713 3HB ALA A 131 36.354 29.651 37.491 1.00 0.13 A +ATOM 1714 N LYS A 132 36.390 25.746 35.944 1.00 0.16 A +ATOM 1715 CA LYS A 132 36.988 24.567 35.292 1.00 0.17 A +ATOM 1716 C LYS A 132 38.448 24.904 34.918 1.00 0.16 A +ATOM 1717 O LYS A 132 39.345 24.091 35.030 1.00 0.16 A +ATOM 1718 CB LYS A 132 36.184 24.095 34.078 1.00 0.17 A +ATOM 1719 CG LYS A 132 36.069 22.541 33.942 1.00 0.18 A +ATOM 1720 CD LYS A 132 36.634 21.736 35.167 1.00 0.19 A +ATOM 1721 CE LYS A 132 37.474 20.526 34.743 1.00 0.19 A +ATOM 1722 NZ LYS A 132 38.781 20.535 35.478 1.00 0.19 A +ATOM 1723 H LYS A 132 35.572 26.137 35.569 1.00 0.16 A +ATOM 1724 HA LYS A 132 37.037 23.763 36.009 1.00 0.17 A +ATOM 1725 1HB LYS A 132 35.190 24.513 34.151 1.00 0.17 A +ATOM 1726 2HB LYS A 132 36.648 24.490 33.181 1.00 0.16 A +ATOM 1727 1HG LYS A 132 35.020 22.291 33.828 1.00 0.19 A +ATOM 1728 2HG LYS A 132 36.581 22.246 33.042 1.00 0.18 A +ATOM 1729 1HD LYS A 132 37.267 22.343 35.757 1.00 0.18 A +ATOM 1730 2HD LYS A 132 35.808 21.405 35.778 1.00 0.19 A +ATOM 1731 1HE LYS A 132 36.942 19.625 34.982 1.00 0.20 A +ATOM 1732 2HE LYS A 132 37.674 20.557 33.689 1.00 0.19 A +ATOM 1733 1HZ LYS A 132 39.407 19.816 35.066 1.00 0.20 A +ATOM 1734 2HZ LYS A 132 38.619 20.319 36.484 1.00 0.20 A +ATOM 1735 3HZ LYS A 132 39.230 21.470 35.394 1.00 0.18 A +ATOM 1736 N SER A 133 38.647 26.115 34.502 1.00 0.15 A +ATOM 1737 CA SER A 133 39.931 26.663 34.132 1.00 0.14 A +ATOM 1738 C SER A 133 39.870 28.195 34.077 1.00 0.13 A +ATOM 1739 O SER A 133 38.878 28.786 33.696 1.00 0.12 A +ATOM 1740 CB SER A 133 40.509 26.060 32.859 1.00 0.14 A +ATOM 1741 OG SER A 133 41.475 26.946 32.315 1.00 0.13 A +ATOM 1742 H SER A 133 37.871 26.707 34.436 1.00 0.14 A +ATOM 1743 HA SER A 133 40.624 26.484 34.941 1.00 0.14 A +ATOM 1744 1HB SER A 133 40.984 25.119 33.087 1.00 0.15 A +ATOM 1745 2HB SER A 133 39.720 25.893 32.149 1.00 0.14 A +ATOM 1746 HG SER A 133 41.725 26.614 31.450 1.00 0.13 A +ATOM 1747 N THR A 134 40.979 28.815 34.491 1.00 0.12 A +ATOM 1748 CA THR A 134 41.150 30.260 34.516 1.00 0.11 A +ATOM 1749 C THR A 134 41.865 30.736 33.256 1.00 0.10 A +ATOM 1750 O THR A 134 42.072 31.925 33.054 1.00 0.09 A +ATOM 1751 CB THR A 134 41.874 30.775 35.794 1.00 0.11 A +ATOM 1752 OG1 THR A 134 43.184 30.245 35.892 1.00 0.11 A +ATOM 1753 CG2 THR A 134 41.063 30.398 37.029 1.00 0.12 A +ATOM 1754 H THR A 134 41.737 28.267 34.779 1.00 0.13 A +ATOM 1755 HA THR A 134 40.174 30.721 34.467 1.00 0.11 A +ATOM 1756 HB THR A 134 41.926 31.838 35.746 1.00 0.10 A +ATOM 1757 HG1 THR A 134 43.686 30.814 36.488 1.00 0.11 A +ATOM 1758 1HG2 THR A 134 40.051 30.762 36.916 1.00 0.12 A +ATOM 1759 2HG2 THR A 134 41.509 30.853 37.902 1.00 0.12 A +ATOM 1760 3HG2 THR A 134 41.051 29.327 37.145 1.00 0.13 A +ATOM 1761 N LEU A 135 42.206 29.818 32.401 1.00 0.11 A +ATOM 1762 CA LEU A 135 42.851 30.172 31.114 1.00 0.10 A +ATOM 1763 C LEU A 135 41.913 31.153 30.389 1.00 0.09 A +ATOM 1764 O LEU A 135 40.726 30.939 30.301 1.00 0.10 A +ATOM 1765 CB LEU A 135 43.095 28.940 30.251 1.00 0.11 A +ATOM 1766 CG LEU A 135 44.416 28.300 30.651 1.00 0.11 A +ATOM 1767 CD1 LEU A 135 44.591 26.988 29.885 1.00 0.12 A +ATOM 1768 CD2 LEU A 135 45.557 29.279 30.307 1.00 0.10 A +ATOM 1769 H LEU A 135 42.028 28.877 32.613 1.00 0.11 A +ATOM 1770 HA LEU A 135 43.797 30.651 31.317 1.00 0.09 A +ATOM 1771 1HB LEU A 135 42.291 28.233 30.401 1.00 0.11 A +ATOM 1772 2HB LEU A 135 43.131 29.221 29.208 1.00 0.10 A +ATOM 1773 HG LEU A 135 44.409 28.100 31.714 1.00 0.12 A +ATOM 1774 1HD1 LEU A 135 43.843 26.280 30.210 1.00 0.13 A +ATOM 1775 2HD1 LEU A 135 45.574 26.590 30.079 1.00 0.12 A +ATOM 1776 3HD1 LEU A 135 44.477 27.175 28.828 1.00 0.12 A +ATOM 1777 1HD2 LEU A 135 45.250 29.938 29.503 1.00 0.10 A +ATOM 1778 2HD2 LEU A 135 46.433 28.738 30.008 1.00 0.11 A +ATOM 1779 3HD2 LEU A 135 45.791 29.873 31.175 1.00 0.10 A +ATOM 1780 N THR A 136 42.473 32.242 29.937 1.00 0.08 A +ATOM 1781 CA THR A 136 41.782 33.346 29.344 1.00 0.07 A +ATOM 1782 C THR A 136 42.107 33.703 27.925 1.00 0.07 A +ATOM 1783 O THR A 136 43.071 34.393 27.654 1.00 0.06 A +ATOM 1784 CB THR A 136 41.979 34.564 30.264 1.00 0.07 A +ATOM 1785 OG1 THR A 136 41.442 34.245 31.535 1.00 0.07 A +ATOM 1786 CG2 THR A 136 41.284 35.808 29.710 1.00 0.06 A +ATOM 1787 H THR A 136 43.440 32.338 30.048 1.00 0.08 A +ATOM 1788 HA THR A 136 40.731 33.119 29.255 1.00 0.08 A +ATOM 1789 HB THR A 136 43.036 34.767 30.368 1.00 0.06 A +ATOM 1790 HG1 THR A 136 41.946 33.506 31.887 1.00 0.08 A +ATOM 1791 1HG2 THR A 136 41.915 36.273 28.969 1.00 0.05 A +ATOM 1792 2HG2 THR A 136 41.107 36.503 30.513 1.00 0.05 A +ATOM 1793 3HG2 THR A 136 40.343 35.532 29.264 1.00 0.06 A +ATOM 1794 N PRO A 137 41.300 33.226 26.972 1.00 0.08 A +ATOM 1795 CA PRO A 137 41.627 33.557 25.602 1.00 0.07 A +ATOM 1796 C PRO A 137 41.482 35.037 25.259 1.00 0.07 A +ATOM 1797 O PRO A 137 40.543 35.699 25.661 1.00 0.06 A +ATOM 1798 CB PRO A 137 40.575 32.831 24.752 1.00 0.08 A +ATOM 1799 CG PRO A 137 39.806 31.908 25.652 1.00 0.09 A +ATOM 1800 CD PRO A 137 40.193 32.244 27.090 1.00 0.09 A +ATOM 1801 HA PRO A 137 42.621 33.210 25.355 1.00 0.07 A +ATOM 1802 1HB PRO A 137 39.894 33.542 24.291 1.00 0.08 A +ATOM 1803 2HB PRO A 137 41.066 32.259 23.974 1.00 0.09 A +ATOM 1804 1HG PRO A 137 38.738 32.056 25.514 1.00 0.10 A +ATOM 1805 2HG PRO A 137 40.053 30.875 25.434 1.00 0.10 A +ATOM 1806 1HD PRO A 137 39.359 32.640 27.615 1.00 0.09 A +ATOM 1807 2HD PRO A 137 40.562 31.352 27.586 1.00 0.09 A +ATOM 1808 N VAL A 138 42.378 35.502 24.445 1.00 0.06 A +ATOM 1809 CA VAL A 138 42.320 36.835 23.901 1.00 0.06 A +ATOM 1810 C VAL A 138 42.399 36.658 22.428 1.00 0.06 A +ATOM 1811 O VAL A 138 43.421 36.318 21.880 1.00 0.06 A +ATOM 1812 CB VAL A 138 43.214 37.878 24.539 1.00 0.05 A +ATOM 1813 CG1 VAL A 138 43.769 37.357 25.865 1.00 0.04 A +ATOM 1814 CG2 VAL A 138 44.313 38.336 23.583 1.00 0.05 A +ATOM 1815 H VAL A 138 43.114 34.918 24.169 1.00 0.06 A +ATOM 1816 HA VAL A 138 41.301 37.179 23.991 1.00 0.06 A +ATOM 1817 HB VAL A 138 42.608 38.752 24.768 1.00 0.05 A +ATOM 1818 1HG1 VAL A 138 42.970 37.330 26.595 1.00 0.04 A +ATOM 1819 2HG1 VAL A 138 44.550 38.012 26.217 1.00 0.04 A +ATOM 1820 3HG1 VAL A 138 44.152 36.366 25.737 1.00 0.05 A +ATOM 1821 1HG2 VAL A 138 43.854 38.782 22.708 1.00 0.05 A +ATOM 1822 2HG2 VAL A 138 44.905 37.499 23.286 1.00 0.05 A +ATOM 1823 3HG2 VAL A 138 44.930 39.074 24.070 1.00 0.04 A +ATOM 1824 N VAL A 139 41.243 36.821 21.765 1.00 0.07 A +ATOM 1825 CA VAL A 139 41.244 36.590 20.358 1.00 0.08 A +ATOM 1826 C VAL A 139 40.768 37.743 19.486 1.00 0.08 A +ATOM 1827 O VAL A 139 40.067 38.649 19.901 1.00 0.08 A +ATOM 1828 CB VAL A 139 40.539 35.280 19.995 1.00 0.09 A +ATOM 1829 CG1 VAL A 139 41.143 34.120 20.758 1.00 0.09 A +ATOM 1830 CG2 VAL A 139 39.051 35.382 20.312 1.00 0.10 A +ATOM 1831 H VAL A 139 40.422 37.066 22.240 1.00 0.07 A +ATOM 1832 HA VAL A 139 42.266 36.545 20.012 1.00 0.08 A +ATOM 1833 HB VAL A 139 40.659 35.103 18.935 1.00 0.10 A +ATOM 1834 1HG1 VAL A 139 40.849 33.202 20.276 1.00 0.10 A +ATOM 1835 2HG1 VAL A 139 40.788 34.128 21.780 1.00 0.09 A +ATOM 1836 3HG1 VAL A 139 42.218 34.207 20.748 1.00 0.08 A +ATOM 1837 1HG2 VAL A 139 38.584 36.071 19.625 1.00 0.10 A +ATOM 1838 2HG2 VAL A 139 38.920 35.734 21.323 1.00 0.09 A +ATOM 1839 3HG2 VAL A 139 38.597 34.407 20.207 1.00 0.10 A +ATOM 1840 N ILE A 140 41.200 37.661 18.208 1.00 0.09 A +ATOM 1841 CA ILE A 140 40.839 38.640 17.215 1.00 0.10 A +ATOM 1842 C ILE A 140 39.691 38.029 16.485 1.00 0.11 A +ATOM 1843 O ILE A 140 39.773 36.909 16.028 1.00 0.11 A +ATOM 1844 CB ILE A 140 41.989 39.038 16.255 1.00 0.10 A +ATOM 1845 CG1 ILE A 140 42.891 40.102 16.887 1.00 0.09 A +ATOM 1846 CG2 ILE A 140 41.420 39.645 14.972 1.00 0.11 A +ATOM 1847 CD1 ILE A 140 43.617 39.570 18.119 1.00 0.08 A +ATOM 1848 H ILE A 140 41.740 36.889 17.938 1.00 0.09 A +ATOM 1849 HA ILE A 140 40.503 39.530 17.726 1.00 0.10 A +ATOM 1850 HB ILE A 140 42.576 38.164 16.014 1.00 0.10 A +ATOM 1851 1HG1 ILE A 140 43.621 40.416 16.159 1.00 0.09 A +ATOM 1852 2HG1 ILE A 140 42.291 40.943 17.157 1.00 0.09 A +ATOM 1853 1HG2 ILE A 140 40.957 38.875 14.375 1.00 0.12 A +ATOM 1854 2HG2 ILE A 140 42.214 40.113 14.405 1.00 0.11 A +ATOM 1855 3HG2 ILE A 140 40.690 40.382 15.240 1.00 0.11 A +ATOM 1856 1HD1 ILE A 140 42.914 39.416 18.916 1.00 0.08 A +ATOM 1857 2HD1 ILE A 140 44.360 40.292 18.429 1.00 0.08 A +ATOM 1858 3HD1 ILE A 140 44.101 38.637 17.881 1.00 0.08 A +ATOM 1859 N SER A 141 38.606 38.735 16.420 1.00 0.11 A +ATOM 1860 CA SER A 141 37.412 38.192 15.816 1.00 0.12 A +ATOM 1861 C SER A 141 37.215 38.653 14.333 1.00 0.13 A +ATOM 1862 O SER A 141 36.312 38.250 13.626 1.00 0.14 A +ATOM 1863 CB SER A 141 36.167 38.436 16.665 1.00 0.12 A +ATOM 1864 OG SER A 141 35.786 39.801 16.558 1.00 0.12 A +ATOM 1865 H SER A 141 38.594 39.637 16.804 1.00 0.11 A +ATOM 1866 HA SER A 141 37.542 37.128 15.687 1.00 0.13 A +ATOM 1867 1HB SER A 141 35.361 37.814 16.313 1.00 0.13 A +ATOM 1868 2HB SER A 141 36.383 38.192 17.697 1.00 0.12 A +ATOM 1869 HG SER A 141 34.903 39.834 16.182 1.00 0.12 A +ATOM 1870 N ASN A 142 38.075 39.484 13.944 1.00 0.13 A +ATOM 1871 CA ASN A 142 38.226 40.144 12.655 1.00 0.14 A +ATOM 1872 C ASN A 142 39.261 39.480 11.712 1.00 0.14 A +ATOM 1873 O ASN A 142 39.740 40.123 10.795 1.00 0.15 A +ATOM 1874 CB ASN A 142 39.006 41.423 13.072 1.00 0.13 A +ATOM 1875 CG ASN A 142 38.203 42.661 12.706 1.00 0.14 A +ATOM 1876 OD1 ASN A 142 38.670 43.768 12.863 1.00 0.14 A +ATOM 1877 ND2 ASN A 142 36.997 42.519 12.235 1.00 0.15 A +ATOM 1878 H ASN A 142 38.712 39.778 14.620 1.00 0.12 A +ATOM 1879 HA ASN A 142 37.270 40.388 12.218 1.00 0.15 A +ATOM 1880 1HB ASN A 142 39.149 41.435 14.137 1.00 0.13 A +ATOM 1881 2HB ASN A 142 39.975 41.485 12.592 1.00 0.13 A +ATOM 1882 N MET A 143 39.670 38.294 11.973 1.00 0.14 A +ATOM 1883 CA MET A 143 40.724 37.675 11.198 1.00 0.14 A +ATOM 1884 C MET A 143 40.762 38.056 9.693 1.00 0.15 A +ATOM 1885 O MET A 143 41.817 38.359 9.160 1.00 0.15 A +ATOM 1886 CB MET A 143 40.833 36.159 11.443 1.00 0.14 A +ATOM 1887 CG MET A 143 41.387 35.772 12.829 1.00 0.13 A +ATOM 1888 SD MET A 143 42.837 36.758 13.309 1.00 0.12 A +ATOM 1889 CE MET A 143 44.113 35.861 12.380 1.00 0.12 A +ATOM 1890 H MET A 143 39.276 37.802 12.724 1.00 0.13 A +ATOM 1891 HA MET A 143 41.663 38.135 11.463 1.00 0.13 A +ATOM 1892 1HB MET A 143 39.850 35.728 11.341 1.00 0.14 A +ATOM 1893 2HB MET A 143 41.473 35.736 10.681 1.00 0.14 A +ATOM 1894 1HG MET A 143 40.615 35.894 13.566 1.00 0.13 A +ATOM 1895 2HG MET A 143 41.673 34.727 12.793 1.00 0.13 A +ATOM 1896 1HE MET A 143 43.742 35.616 11.400 1.00 0.13 A +ATOM 1897 2HE MET A 143 44.377 34.956 12.897 1.00 0.12 A +ATOM 1898 3HE MET A 143 44.990 36.479 12.290 1.00 0.12 A +ATOM 1899 N ASP A 144 39.701 38.073 9.029 1.00 0.16 A +ATOM 1900 CA ASP A 144 39.682 38.433 7.618 1.00 0.17 A +ATOM 1901 C ASP A 144 40.100 39.857 7.366 1.00 0.17 A +ATOM 1902 O ASP A 144 40.334 40.192 6.221 1.00 0.17 A +ATOM 1903 CB ASP A 144 38.320 38.115 6.946 1.00 0.18 A +ATOM 1904 CG ASP A 144 38.117 36.599 6.895 1.00 0.19 A +ATOM 1905 OD1 ASP A 144 39.075 35.885 7.142 1.00 0.18 A +ATOM 1906 OD2 ASP A 144 37.008 36.179 6.609 1.00 0.24 A +ATOM 1907 H ASP A 144 38.864 37.820 9.475 1.00 0.16 A +ATOM 1908 HA ASP A 144 40.458 37.881 7.109 1.00 0.17 A +ATOM 1909 1HB ASP A 144 37.522 38.566 7.518 1.00 0.17 A +ATOM 1910 2HB ASP A 144 38.312 38.512 5.942 1.00 0.19 A +ATOM 1911 N GLU A 145 40.218 40.717 8.354 1.00 0.16 A +ATOM 1912 CA GLU A 145 40.632 42.069 8.015 1.00 0.16 A +ATOM 1913 C GLU A 145 42.035 42.322 8.408 1.00 0.16 A +ATOM 1914 O GLU A 145 42.451 43.469 8.423 1.00 0.16 A +ATOM 1915 CB GLU A 145 39.708 43.156 8.624 1.00 0.16 A +ATOM 1916 CG GLU A 145 38.232 42.752 8.480 1.00 0.17 A +ATOM 1917 CD GLU A 145 37.345 43.689 9.311 1.00 0.17 A +ATOM 1918 OE1 GLU A 145 37.840 44.728 9.730 1.00 0.17 A +ATOM 1919 OE2 GLU A 145 36.188 43.349 9.521 1.00 0.17 A +ATOM 1920 H GLU A 145 40.013 40.450 9.274 1.00 0.16 A +ATOM 1921 HA GLU A 145 40.623 42.172 6.940 1.00 0.17 A +ATOM 1922 1HB GLU A 145 39.944 43.278 9.671 1.00 0.16 A +ATOM 1923 2HB GLU A 145 39.873 44.091 8.109 1.00 0.17 A +ATOM 1924 1HG GLU A 145 37.943 42.820 7.444 1.00 0.18 A +ATOM 1925 2HG GLU A 145 38.101 41.740 8.826 1.00 0.17 A +ATOM 1926 N ILE A 146 42.798 41.309 8.750 1.00 0.15 A +ATOM 1927 CA ILE A 146 44.132 41.641 9.181 1.00 0.14 A +ATOM 1928 C ILE A 146 45.224 41.015 8.339 1.00 0.14 A +ATOM 1929 O ILE A 146 45.151 39.886 7.894 1.00 0.15 A +ATOM 1930 CB ILE A 146 44.322 41.388 10.685 1.00 0.13 A +ATOM 1931 CG1 ILE A 146 44.518 39.888 10.947 1.00 0.13 A +ATOM 1932 CG2 ILE A 146 43.131 41.888 11.516 1.00 0.13 A +ATOM 1933 CD1 ILE A 146 45.441 39.715 12.134 1.00 0.12 A +ATOM 1934 H ILE A 146 42.454 40.391 8.756 1.00 0.15 A +ATOM 1935 HA ILE A 146 44.316 42.685 8.976 1.00 0.15 A +ATOM 1936 HB ILE A 146 45.204 41.926 11.006 1.00 0.13 A +ATOM 1937 1HG1 ILE A 146 43.570 39.425 11.162 1.00 0.13 A +ATOM 1938 2HG1 ILE A 146 44.958 39.400 10.101 1.00 0.13 A +ATOM 1939 1HG2 ILE A 146 42.988 42.943 11.352 1.00 0.13 A +ATOM 1940 2HG2 ILE A 146 43.340 41.713 12.565 1.00 0.12 A +ATOM 1941 3HG2 ILE A 146 42.241 41.348 11.236 1.00 0.13 A +ATOM 1942 1HD1 ILE A 146 46.426 40.087 11.883 1.00 0.12 A +ATOM 1943 2HD1 ILE A 146 45.495 38.679 12.359 1.00 0.11 A +ATOM 1944 3HD1 ILE A 146 45.052 40.259 12.979 1.00 0.11 A +ATOM 1945 N LYS A 147 46.267 41.806 8.113 1.00 0.15 A +ATOM 1946 CA LYS A 147 47.392 41.323 7.309 1.00 0.15 A +ATOM 1947 C LYS A 147 48.220 40.338 8.121 1.00 0.14 A +ATOM 1948 O LYS A 147 48.397 39.207 7.693 1.00 0.14 A +ATOM 1949 CB LYS A 147 48.194 42.424 6.592 1.00 0.15 A +ATOM 1950 CG LYS A 147 48.813 41.956 5.239 1.00 0.16 A +ATOM 1951 CD LYS A 147 47.756 41.372 4.248 1.00 0.17 A +ATOM 1952 CE LYS A 147 48.376 41.134 2.853 1.00 0.18 A +ATOM 1953 NZ LYS A 147 47.694 39.996 2.150 1.00 0.18 A +ATOM 1954 H LYS A 147 46.288 42.715 8.482 1.00 0.14 A +ATOM 1955 HA LYS A 147 47.005 40.648 6.559 1.00 0.15 A +ATOM 1956 1HB LYS A 147 47.569 43.226 6.397 1.00 0.16 A +ATOM 1957 2HB LYS A 147 48.994 42.748 7.240 1.00 0.15 A +ATOM 1958 1HG LYS A 147 49.272 42.816 4.770 1.00 0.17 A +ATOM 1959 2HG LYS A 147 49.571 41.218 5.432 1.00 0.16 A +ATOM 1960 1HD LYS A 147 47.398 40.430 4.614 1.00 0.16 A +ATOM 1961 2HD LYS A 147 46.932 42.063 4.158 1.00 0.17 A +ATOM 1962 1HE LYS A 147 48.270 42.025 2.257 1.00 0.18 A +ATOM 1963 2HE LYS A 147 49.423 40.899 2.962 1.00 0.17 A +ATOM 1964 1HZ LYS A 147 46.689 39.964 2.413 1.00 0.18 A +ATOM 1965 2HZ LYS A 147 48.150 39.098 2.413 1.00 0.18 A +ATOM 1966 3HZ LYS A 147 47.774 40.131 1.120 1.00 0.19 A +ATOM 1967 N GLU A 148 48.692 40.671 9.274 1.00 0.13 A +ATOM 1968 CA GLU A 148 49.415 39.676 10.028 1.00 0.12 A +ATOM 1969 C GLU A 148 49.258 39.805 11.526 1.00 0.11 A +ATOM 1970 O GLU A 148 49.166 40.857 12.099 1.00 0.11 A +ATOM 1971 CB GLU A 148 50.905 39.513 9.649 1.00 0.12 A +ATOM 1972 CG GLU A 148 51.255 38.040 9.229 1.00 0.12 A +ATOM 1973 CD GLU A 148 51.972 37.967 7.866 1.00 0.13 A +ATOM 1974 OE1 GLU A 148 52.606 38.936 7.475 1.00 0.14 A +ATOM 1975 OE2 GLU A 148 51.868 36.915 7.238 1.00 0.14 A +ATOM 1976 H GLU A 148 48.552 41.575 9.624 1.00 0.13 A +ATOM 1977 HA GLU A 148 48.927 38.725 9.878 1.00 0.12 A +ATOM 1978 1HB GLU A 148 51.124 40.180 8.827 1.00 0.13 A +ATOM 1979 2HB GLU A 148 51.526 39.795 10.492 1.00 0.12 A +ATOM 1980 1HG GLU A 148 51.899 37.603 9.974 1.00 0.12 A +ATOM 1981 2HG GLU A 148 50.359 37.446 9.162 1.00 0.13 A +ATOM 1982 N LEU A 149 49.258 38.620 12.107 1.00 0.11 A +ATOM 1983 CA LEU A 149 49.183 38.379 13.500 1.00 0.10 A +ATOM 1984 C LEU A 149 50.482 37.710 13.986 1.00 0.09 A +ATOM 1985 O LEU A 149 50.785 36.571 13.679 1.00 0.10 A +ATOM 1986 CB LEU A 149 47.959 37.504 13.799 1.00 0.10 A +ATOM 1987 CG LEU A 149 47.313 37.817 15.166 1.00 0.09 A +ATOM 1988 CD1 LEU A 149 45.790 37.715 15.048 1.00 0.09 A +ATOM 1989 CD2 LEU A 149 47.794 36.801 16.198 1.00 0.08 A +ATOM 1990 H LEU A 149 49.339 37.839 11.521 1.00 0.11 A +ATOM 1991 HA LEU A 149 49.091 39.319 14.024 1.00 0.10 A +ATOM 1992 1HB LEU A 149 47.245 37.656 13.017 1.00 0.10 A +ATOM 1993 2HB LEU A 149 48.261 36.463 13.775 1.00 0.10 A +ATOM 1994 HG LEU A 149 47.573 38.812 15.489 1.00 0.09 A +ATOM 1995 1HD1 LEU A 149 45.412 38.584 14.544 1.00 0.10 A +ATOM 1996 2HD1 LEU A 149 45.351 37.658 16.030 1.00 0.09 A +ATOM 1997 3HD1 LEU A 149 45.533 36.831 14.485 1.00 0.10 A +ATOM 1998 1HD2 LEU A 149 47.343 35.842 15.989 1.00 0.09 A +ATOM 1999 2HD2 LEU A 149 47.507 37.129 17.183 1.00 0.08 A +ATOM 2000 3HD2 LEU A 149 48.867 36.714 16.140 1.00 0.08 A +ATOM 2001 N ILE A 150 51.214 38.454 14.774 1.00 0.09 A +ATOM 2002 CA ILE A 150 52.468 38.014 15.396 1.00 0.09 A +ATOM 2003 C ILE A 150 52.210 37.832 16.902 1.00 0.08 A +ATOM 2004 O ILE A 150 51.965 38.778 17.624 1.00 0.08 A +ATOM 2005 CB ILE A 150 53.556 39.060 15.182 1.00 0.09 A +ATOM 2006 CG1 ILE A 150 53.688 39.309 13.671 1.00 0.10 A +ATOM 2007 CG2 ILE A 150 54.891 38.628 15.810 1.00 0.09 A +ATOM 2008 CD1 ILE A 150 54.722 40.399 13.371 1.00 0.11 A +ATOM 2009 H ILE A 150 50.898 39.358 14.974 1.00 0.09 A +ATOM 2010 HA ILE A 150 52.779 37.081 14.952 1.00 0.09 A +ATOM 2011 HB ILE A 150 53.249 39.978 15.661 1.00 0.09 A +ATOM 2012 1HG1 ILE A 150 53.980 38.396 13.181 1.00 0.10 A +ATOM 2013 2HG1 ILE A 150 52.727 39.626 13.287 1.00 0.10 A +ATOM 2014 1HG2 ILE A 150 55.175 37.655 15.444 1.00 0.09 A +ATOM 2015 2HG2 ILE A 150 54.785 38.591 16.886 1.00 0.09 A +ATOM 2016 3HG2 ILE A 150 55.658 39.348 15.557 1.00 0.10 A +ATOM 2017 1HD1 ILE A 150 54.778 40.551 12.301 1.00 0.11 A +ATOM 2018 2HD1 ILE A 150 55.688 40.094 13.740 1.00 0.11 A +ATOM 2019 3HD1 ILE A 150 54.427 41.322 13.847 1.00 0.11 A +ATOM 2020 N LYS A 151 52.260 36.604 17.342 1.00 0.08 A +ATOM 2021 CA LYS A 151 52.029 36.215 18.723 1.00 0.07 A +ATOM 2022 C LYS A 151 53.252 36.322 19.582 1.00 0.07 A +ATOM 2023 O LYS A 151 54.316 35.829 19.253 1.00 0.08 A +ATOM 2024 CB LYS A 151 51.425 34.806 18.827 1.00 0.07 A +ATOM 2025 CG LYS A 151 50.160 34.638 17.970 1.00 0.08 A +ATOM 2026 CD LYS A 151 49.438 33.319 18.349 1.00 0.08 A +ATOM 2027 CE LYS A 151 48.354 32.961 17.303 1.00 0.09 A +ATOM 2028 NZ LYS A 151 48.243 31.478 17.148 1.00 0.09 A +ATOM 2029 H LYS A 151 52.460 35.892 16.702 1.00 0.08 A +ATOM 2030 HA LYS A 151 51.350 36.921 19.176 1.00 0.07 A +ATOM 2031 1HB LYS A 151 52.162 34.088 18.502 1.00 0.08 A +ATOM 2032 2HB LYS A 151 51.179 34.610 19.860 1.00 0.07 A +ATOM 2033 1HG LYS A 151 49.497 35.471 18.137 1.00 0.07 A +ATOM 2034 2HG LYS A 151 50.442 34.601 16.931 1.00 0.08 A +ATOM 2035 1HD LYS A 151 50.156 32.518 18.409 1.00 0.08 A +ATOM 2036 2HD LYS A 151 48.965 33.445 19.315 1.00 0.08 A +ATOM 2037 1HE LYS A 151 47.401 33.349 17.625 1.00 0.09 A +ATOM 2038 2HE LYS A 151 48.608 33.392 16.349 1.00 0.09 A +ATOM 2039 1HZ LYS A 151 47.291 31.240 16.800 1.00 0.10 A +ATOM 2040 2HZ LYS A 151 48.404 31.014 18.064 1.00 0.09 A +ATOM 2041 3HZ LYS A 151 48.949 31.146 16.460 1.00 0.10 A +ATOM 2042 N LEU A 152 53.085 36.989 20.730 1.00 0.07 A +ATOM 2043 CA LEU A 152 54.188 37.156 21.603 1.00 0.07 A +ATOM 2044 C LEU A 152 54.241 36.105 22.653 1.00 0.07 A +ATOM 2045 O LEU A 152 53.429 35.204 22.721 1.00 0.07 A +ATOM 2046 CB LEU A 152 54.404 38.574 22.119 1.00 0.07 A +ATOM 2047 CG LEU A 152 54.400 39.558 20.974 1.00 0.08 A +ATOM 2048 CD1 LEU A 152 54.413 40.975 21.550 1.00 0.08 A +ATOM 2049 CD2 LEU A 152 55.651 39.314 20.125 1.00 0.08 A +ATOM 2050 H LEU A 152 52.208 37.362 20.961 1.00 0.06 A +ATOM 2051 HA LEU A 152 55.079 36.854 21.076 1.00 0.08 A +ATOM 2052 1HB LEU A 152 53.612 38.822 22.810 1.00 0.07 A +ATOM 2053 2HB LEU A 152 55.351 38.624 22.634 1.00 0.08 A +ATOM 2054 HG LEU A 152 53.511 39.415 20.376 1.00 0.07 A +ATOM 2055 1HD1 LEU A 152 54.266 41.690 20.757 1.00 0.08 A +ATOM 2056 2HD1 LEU A 152 55.362 41.159 22.032 1.00 0.08 A +ATOM 2057 3HD1 LEU A 152 53.618 41.077 22.277 1.00 0.07 A +ATOM 2058 1HD2 LEU A 152 55.544 38.387 19.584 1.00 0.08 A +ATOM 2059 2HD2 LEU A 152 56.518 39.257 20.767 1.00 0.09 A +ATOM 2060 3HD2 LEU A 152 55.776 40.120 19.426 1.00 0.09 A +ATOM 2061 N SER A 153 55.289 36.184 23.411 1.00 0.08 A +ATOM 2062 CA SER A 153 55.585 35.175 24.419 1.00 0.08 A +ATOM 2063 C SER A 153 55.921 35.736 25.815 1.00 0.09 A +ATOM 2064 O SER A 153 56.357 36.865 25.956 1.00 0.09 A +ATOM 2065 CB SER A 153 56.882 34.538 23.944 1.00 0.09 A +ATOM 2066 OG SER A 153 56.605 33.262 23.391 1.00 0.09 A +ATOM 2067 H SER A 153 55.904 36.940 23.305 1.00 0.08 A +ATOM 2068 HA SER A 153 54.795 34.441 24.469 1.00 0.08 A +ATOM 2069 1HB SER A 153 57.341 35.153 23.186 1.00 0.09 A +ATOM 2070 2HB SER A 153 57.582 34.423 24.768 1.00 0.10 A +ATOM 2071 HG SER A 153 56.013 33.384 22.649 1.00 0.09 A +ATOM 2072 N GLY A 154 55.803 34.890 26.850 1.00 0.09 A +ATOM 2073 CA GLY A 154 56.217 35.305 28.186 1.00 0.09 A +ATOM 2074 C GLY A 154 55.149 35.758 29.183 1.00 0.09 A +ATOM 2075 O GLY A 154 53.973 35.453 29.106 1.00 0.08 A +ATOM 2076 H GLY A 154 55.455 33.987 26.705 1.00 0.09 A +ATOM 2077 1HA GLY A 154 56.734 34.469 28.630 1.00 0.10 A +ATOM 2078 2HA GLY A 154 56.901 36.129 28.064 1.00 0.10 A +ATOM 2079 N SER A 155 55.657 36.509 30.152 1.00 0.10 A +ATOM 2080 CA SER A 155 54.883 37.062 31.250 1.00 0.10 A +ATOM 2081 C SER A 155 54.448 38.474 30.916 1.00 0.09 A +ATOM 2082 O SER A 155 55.174 39.219 30.291 1.00 0.09 A +ATOM 2083 CB SER A 155 55.730 37.023 32.509 1.00 0.11 A +ATOM 2084 OG SER A 155 56.849 36.179 32.280 1.00 0.11 A +ATOM 2085 H SER A 155 56.615 36.709 30.122 1.00 0.10 A +ATOM 2086 HA SER A 155 53.988 36.476 31.396 1.00 0.09 A +ATOM 2087 1HB SER A 155 56.084 38.013 32.757 1.00 0.11 A +ATOM 2088 2HB SER A 155 55.145 36.639 33.336 1.00 0.11 A +ATOM 2089 HG SER A 155 56.525 35.282 32.170 1.00 0.11 A +ATOM 2090 N VAL A 156 53.244 38.841 31.305 1.00 0.08 A +ATOM 2091 CA VAL A 156 52.757 40.152 30.971 1.00 0.08 A +ATOM 2092 C VAL A 156 52.195 40.793 32.155 1.00 0.08 A +ATOM 2093 O VAL A 156 51.825 40.167 33.132 1.00 0.08 A +ATOM 2094 CB VAL A 156 51.662 40.111 29.908 1.00 0.07 A +ATOM 2095 CG1 VAL A 156 52.306 39.681 28.564 1.00 0.07 A +ATOM 2096 CG2 VAL A 156 50.615 39.061 30.319 1.00 0.06 A +ATOM 2097 H VAL A 156 52.673 38.214 31.795 1.00 0.08 A +ATOM 2098 HA VAL A 156 53.580 40.744 30.600 1.00 0.08 A +ATOM 2099 HB VAL A 156 51.191 41.071 29.817 1.00 0.07 A +ATOM 2100 1HG1 VAL A 156 51.947 40.313 27.780 1.00 0.06 A +ATOM 2101 2HG1 VAL A 156 52.056 38.651 28.344 1.00 0.07 A +ATOM 2102 3HG1 VAL A 156 53.383 39.765 28.613 1.00 0.08 A +ATOM 2103 1HG2 VAL A 156 49.818 39.044 29.590 1.00 0.06 A +ATOM 2104 2HG2 VAL A 156 50.215 39.305 31.289 1.00 0.07 A +ATOM 2105 3HG2 VAL A 156 51.085 38.087 30.357 1.00 0.07 A +ATOM 2106 N THR A 157 52.128 42.060 32.043 1.00 0.08 A +ATOM 2107 CA THR A 157 51.621 42.854 33.086 1.00 0.09 A +ATOM 2108 C THR A 157 50.437 43.677 32.535 1.00 0.08 A +ATOM 2109 O THR A 157 50.551 44.402 31.568 1.00 0.08 A +ATOM 2110 CB THR A 157 52.814 43.687 33.679 1.00 0.10 A +ATOM 2111 OG1 THR A 157 53.704 42.823 34.376 1.00 0.11 A +ATOM 2112 CG2 THR A 157 52.306 44.782 34.617 1.00 0.10 A +ATOM 2113 H THR A 157 52.444 42.484 31.218 1.00 0.08 A +ATOM 2114 HA THR A 157 51.195 42.225 33.852 1.00 0.09 A +ATOM 2115 HB THR A 157 53.349 44.155 32.865 1.00 0.10 A +ATOM 2116 HG1 THR A 157 54.306 42.435 33.733 1.00 0.11 A +ATOM 2117 1HG2 THR A 157 51.697 45.478 34.059 1.00 0.10 A +ATOM 2118 2HG2 THR A 157 53.150 45.306 35.042 1.00 0.11 A +ATOM 2119 3HG2 THR A 157 51.721 44.342 35.408 1.00 0.10 A +ATOM 2120 N VAL A 158 49.287 43.519 33.190 1.00 0.08 A +ATOM 2121 CA VAL A 158 48.065 44.213 32.842 1.00 0.07 A +ATOM 2122 C VAL A 158 48.280 45.658 32.379 1.00 0.08 A +ATOM 2123 O VAL A 158 48.818 46.512 33.059 1.00 0.08 A +ATOM 2124 CB VAL A 158 47.008 44.118 33.989 1.00 0.07 A +ATOM 2125 CG1 VAL A 158 47.440 44.858 35.261 1.00 0.08 A +ATOM 2126 CG2 VAL A 158 45.663 44.681 33.534 1.00 0.06 A +ATOM 2127 H VAL A 158 49.271 42.917 33.962 1.00 0.08 A +ATOM 2128 HA VAL A 158 47.653 43.771 31.947 1.00 0.06 A +ATOM 2129 HB VAL A 158 46.872 43.074 34.234 1.00 0.07 A +ATOM 2130 1HG1 VAL A 158 47.578 45.905 35.048 1.00 0.08 A +ATOM 2131 2HG1 VAL A 158 48.360 44.437 35.635 1.00 0.08 A +ATOM 2132 3HG1 VAL A 158 46.666 44.745 36.013 1.00 0.08 A +ATOM 2133 1HG2 VAL A 158 45.734 45.752 33.431 1.00 0.07 A +ATOM 2134 2HG2 VAL A 158 44.913 44.441 34.276 1.00 0.06 A +ATOM 2135 3HG2 VAL A 158 45.386 44.240 32.589 1.00 0.06 A +ATOM 2136 N GLY A 159 47.774 45.894 31.171 1.00 0.07 A +ATOM 2137 CA GLY A 159 47.775 47.199 30.555 1.00 0.08 A +ATOM 2138 C GLY A 159 49.132 47.767 30.333 1.00 0.09 A +ATOM 2139 O GLY A 159 49.292 48.974 30.246 1.00 0.10 A +ATOM 2140 H GLY A 159 47.348 45.154 30.690 1.00 0.06 A +ATOM 2141 1HA GLY A 159 47.295 47.113 29.591 1.00 0.07 A +ATOM 2142 2HA GLY A 159 47.206 47.865 31.184 1.00 0.08 A +ATOM 2143 N GLU A 160 50.102 46.930 30.208 1.00 0.09 A +ATOM 2144 CA GLU A 160 51.429 47.415 29.968 1.00 0.10 A +ATOM 2145 C GLU A 160 52.148 46.603 28.893 1.00 0.09 A +ATOM 2146 O GLU A 160 52.697 47.132 27.949 1.00 0.10 A +ATOM 2147 CB GLU A 160 52.248 47.340 31.282 1.00 0.10 A +ATOM 2148 CG GLU A 160 53.327 48.453 31.361 1.00 0.12 A +ATOM 2149 CD GLU A 160 52.979 49.457 32.467 1.00 0.12 A +ATOM 2150 OE1 GLU A 160 53.191 49.135 33.627 1.00 0.13 A +ATOM 2151 OE2 GLU A 160 52.500 50.530 32.126 1.00 0.13 A +ATOM 2152 H GLU A 160 49.925 45.968 30.268 1.00 0.08 A +ATOM 2153 HA GLU A 160 51.383 48.439 29.628 1.00 0.10 A +ATOM 2154 1HB GLU A 160 51.566 47.432 32.116 1.00 0.10 A +ATOM 2155 2HB GLU A 160 52.731 46.372 31.344 1.00 0.10 A +ATOM 2156 1HG GLU A 160 54.285 48.006 31.585 1.00 0.12 A +ATOM 2157 2HG GLU A 160 53.395 48.977 30.423 1.00 0.12 A +ATOM 2158 N THR A 161 52.183 45.334 29.072 1.00 0.09 A +ATOM 2159 CA THR A 161 52.912 44.455 28.174 1.00 0.09 A +ATOM 2160 C THR A 161 52.121 44.024 26.943 1.00 0.08 A +ATOM 2161 O THR A 161 51.070 43.422 27.059 1.00 0.07 A +ATOM 2162 CB THR A 161 53.310 43.175 28.940 1.00 0.08 A +ATOM 2163 OG1 THR A 161 53.855 43.524 30.205 1.00 0.09 A +ATOM 2164 CG2 THR A 161 54.362 42.425 28.121 1.00 0.09 A +ATOM 2165 H THR A 161 51.729 44.949 29.849 1.00 0.08 A +ATOM 2166 HA THR A 161 53.800 44.957 27.819 1.00 0.09 A +ATOM 2167 HB THR A 161 52.453 42.561 29.072 1.00 0.08 A +ATOM 2168 HG1 THR A 161 53.956 44.478 30.232 1.00 0.10 A +ATOM 2169 1HG2 THR A 161 53.906 42.035 27.223 1.00 0.08 A +ATOM 2170 2HG2 THR A 161 54.765 41.614 28.705 1.00 0.09 A +ATOM 2171 3HG2 THR A 161 55.160 43.102 27.853 1.00 0.09 A +ATOM 2172 N PRO A 162 52.667 44.304 25.759 1.00 0.08 A +ATOM 2173 CA PRO A 162 52.054 43.911 24.481 1.00 0.08 A +ATOM 2174 C PRO A 162 51.973 42.376 24.394 1.00 0.07 A +ATOM 2175 O PRO A 162 52.879 41.690 24.826 1.00 0.07 A +ATOM 2176 CB PRO A 162 52.967 44.464 23.369 1.00 0.08 A +ATOM 2177 CG PRO A 162 54.053 45.268 24.027 1.00 0.09 A +ATOM 2178 CD PRO A 162 53.914 45.097 25.539 1.00 0.09 A +ATOM 2179 HA PRO A 162 51.064 44.334 24.397 1.00 0.07 A +ATOM 2180 1HB PRO A 162 53.402 43.650 22.797 1.00 0.08 A +ATOM 2181 2HB PRO A 162 52.390 45.096 22.709 1.00 0.09 A +ATOM 2182 1HG PRO A 162 55.029 44.913 23.706 1.00 0.10 A +ATOM 2183 2HG PRO A 162 53.954 46.317 23.768 1.00 0.10 A +ATOM 2184 1HD PRO A 162 54.778 44.578 25.936 1.00 0.09 A +ATOM 2185 2HD PRO A 162 53.813 46.075 26.003 1.00 0.10 A +ATOM 2186 N VAL A 163 50.898 41.839 23.845 1.00 0.06 A +ATOM 2187 CA VAL A 163 50.741 40.376 23.721 1.00 0.06 A +ATOM 2188 C VAL A 163 50.675 39.921 22.255 1.00 0.06 A +ATOM 2189 O VAL A 163 51.040 38.807 21.920 1.00 0.06 A +ATOM 2190 CB VAL A 163 49.513 39.870 24.450 1.00 0.05 A +ATOM 2191 CG1 VAL A 163 49.604 40.237 25.923 1.00 0.05 A +ATOM 2192 CG2 VAL A 163 48.247 40.480 23.839 1.00 0.05 A +ATOM 2193 H VAL A 163 50.183 42.421 23.515 1.00 0.06 A +ATOM 2194 HA VAL A 163 51.615 39.895 24.137 1.00 0.06 A +ATOM 2195 HB VAL A 163 49.465 38.795 24.356 1.00 0.05 A +ATOM 2196 1HG1 VAL A 163 49.658 41.309 26.028 1.00 0.05 A +ATOM 2197 2HG1 VAL A 163 50.483 39.791 26.331 1.00 0.05 A +ATOM 2198 3HG1 VAL A 163 48.738 39.863 26.444 1.00 0.04 A +ATOM 2199 1HG2 VAL A 163 48.333 41.556 23.821 1.00 0.05 A +ATOM 2200 2HG2 VAL A 163 47.389 40.198 24.433 1.00 0.04 A +ATOM 2201 3HG2 VAL A 163 48.118 40.113 22.833 1.00 0.05 A +ATOM 2202 N ILE A 164 50.212 40.773 21.405 1.00 0.06 A +ATOM 2203 CA ILE A 164 50.093 40.513 19.989 1.00 0.07 A +ATOM 2204 C ILE A 164 50.470 41.796 19.222 1.00 0.07 A +ATOM 2205 O ILE A 164 50.278 42.899 19.692 1.00 0.08 A +ATOM 2206 CB ILE A 164 48.668 40.084 19.615 1.00 0.06 A +ATOM 2207 CG1 ILE A 164 48.288 38.723 20.251 1.00 0.06 A +ATOM 2208 CG2 ILE A 164 48.507 39.982 18.100 1.00 0.07 A +ATOM 2209 CD1 ILE A 164 46.759 38.615 20.451 1.00 0.06 A +ATOM 2210 H ILE A 164 49.933 41.651 21.742 1.00 0.06 A +ATOM 2211 HA ILE A 164 50.779 39.724 19.718 1.00 0.07 A +ATOM 2212 HB ILE A 164 47.984 40.836 19.969 1.00 0.06 A +ATOM 2213 1HG1 ILE A 164 48.612 37.922 19.604 1.00 0.06 A +ATOM 2214 2HG1 ILE A 164 48.771 38.621 21.202 1.00 0.06 A +ATOM 2215 1HG2 ILE A 164 47.541 39.549 17.877 1.00 0.07 A +ATOM 2216 2HG2 ILE A 164 49.283 39.353 17.695 1.00 0.07 A +ATOM 2217 3HG2 ILE A 164 48.568 40.966 17.663 1.00 0.08 A +ATOM 2218 1HD1 ILE A 164 46.245 39.038 19.600 1.00 0.06 A +ATOM 2219 2HD1 ILE A 164 46.470 39.149 21.345 1.00 0.05 A +ATOM 2220 3HD1 ILE A 164 46.484 37.574 20.555 1.00 0.06 A +ATOM 2221 N ARG A 165 50.980 41.619 18.033 1.00 0.08 A +ATOM 2222 CA ARG A 165 51.338 42.683 17.127 1.00 0.09 A +ATOM 2223 C ARG A 165 50.615 42.385 15.841 1.00 0.09 A +ATOM 2224 O ARG A 165 50.642 41.263 15.363 1.00 0.09 A +ATOM 2225 CB ARG A 165 52.843 42.705 16.939 1.00 0.09 A +ATOM 2226 CG ARG A 165 53.457 43.926 17.644 1.00 0.10 A +ATOM 2227 CD ARG A 165 54.977 43.775 17.826 1.00 0.10 A +ATOM 2228 NE ARG A 165 55.430 44.678 18.923 1.00 0.10 A +ATOM 2229 CZ ARG A 165 56.251 44.285 19.856 1.00 0.10 A +ATOM 2230 NH1 ARG A 165 56.703 43.062 19.885 1.00 0.10 A +ATOM 2231 NH2 ARG A 165 56.599 45.114 20.801 1.00 0.11 A +ATOM 2232 H ARG A 165 51.111 40.700 17.722 1.00 0.08 A +ATOM 2233 HA ARG A 165 51.013 43.629 17.538 1.00 0.09 A +ATOM 2234 1HB ARG A 165 53.260 41.799 17.353 1.00 0.09 A +ATOM 2235 2HB ARG A 165 53.084 42.754 15.884 1.00 0.10 A +ATOM 2236 1HG ARG A 165 53.255 44.809 17.062 1.00 0.10 A +ATOM 2237 2HG ARG A 165 53.005 44.031 18.619 1.00 0.09 A +ATOM 2238 1HD ARG A 165 55.203 42.719 18.041 1.00 0.10 A +ATOM 2239 2HD ARG A 165 55.489 44.106 16.950 1.00 0.11 A +ATOM 2240 1HH1 ARG A 165 56.434 42.408 19.184 1.00 0.10 A +ATOM 2241 2HH1 ARG A 165 57.306 42.776 20.630 1.00 0.10 A +ATOM 2242 1HH2 ARG A 165 56.245 46.048 20.804 1.00 0.11 A +ATOM 2243 2HH2 ARG A 165 57.204 44.806 21.536 1.00 0.11 A +ATOM 2244 N ILE A 166 49.937 43.347 15.290 1.00 0.10 A +ATOM 2245 CA ILE A 166 49.193 43.076 14.070 1.00 0.11 A +ATOM 2246 C ILE A 166 49.545 44.092 13.025 1.00 0.12 A +ATOM 2247 O ILE A 166 49.914 45.199 13.332 1.00 0.12 A +ATOM 2248 CB ILE A 166 47.658 43.137 14.227 1.00 0.11 A +ATOM 2249 CG1 ILE A 166 47.271 44.427 14.763 1.00 0.11 A +ATOM 2250 CG2 ILE A 166 47.108 42.037 15.148 1.00 0.10 A +ATOM 2251 CD1 ILE A 166 45.762 44.553 14.734 1.00 0.11 A +ATOM 2252 H ILE A 166 49.915 44.234 15.707 1.00 0.10 A +ATOM 2253 HA ILE A 166 49.458 42.088 13.727 1.00 0.10 A +ATOM 2254 HB ILE A 166 47.207 43.007 13.252 1.00 0.11 A +ATOM 2255 1HG1 ILE A 166 47.632 44.502 15.778 1.00 0.10 A +ATOM 2256 2HG1 ILE A 166 47.704 45.181 14.156 1.00 0.11 A +ATOM 2257 1HG2 ILE A 166 46.036 41.962 14.990 1.00 0.10 A +ATOM 2258 2HG2 ILE A 166 47.293 42.295 16.181 1.00 0.09 A +ATOM 2259 3HG2 ILE A 166 47.569 41.094 14.916 1.00 0.10 A +ATOM 2260 1HD1 ILE A 166 45.441 44.642 13.702 1.00 0.12 A +ATOM 2261 2HD1 ILE A 166 45.474 45.419 15.288 1.00 0.11 A +ATOM 2262 3HD1 ILE A 166 45.297 43.698 15.177 1.00 0.10 A +ATOM 2263 N LYS A 167 49.368 43.722 11.796 1.00 0.12 A +ATOM 2264 CA LYS A 167 49.594 44.620 10.682 1.00 0.13 A +ATOM 2265 C LYS A 167 48.302 44.763 9.890 1.00 0.14 A +ATOM 2266 O LYS A 167 47.442 43.904 9.923 1.00 0.14 A +ATOM 2267 CB LYS A 167 50.776 44.251 9.778 1.00 0.14 A +ATOM 2268 CG LYS A 167 51.482 45.521 9.247 1.00 0.15 A +ATOM 2269 CD LYS A 167 52.981 45.240 8.945 1.00 0.15 A +ATOM 2270 CE LYS A 167 53.361 45.731 7.539 1.00 0.16 A +ATOM 2271 NZ LYS A 167 54.487 44.919 7.009 1.00 0.16 A +ATOM 2272 H LYS A 167 49.056 42.811 11.616 1.00 0.12 A +ATOM 2273 HA LYS A 167 49.774 45.608 11.080 1.00 0.13 A +ATOM 2274 1HB LYS A 167 51.473 43.658 10.352 1.00 0.13 A +ATOM 2275 2HB LYS A 167 50.421 43.665 8.942 1.00 0.14 A +ATOM 2276 1HG LYS A 167 50.972 45.848 8.358 1.00 0.15 A +ATOM 2277 2HG LYS A 167 51.422 46.309 9.984 1.00 0.14 A +ATOM 2278 1HD LYS A 167 53.589 45.765 9.674 1.00 0.15 A +ATOM 2279 2HD LYS A 167 53.189 44.184 9.017 1.00 0.14 A +ATOM 2280 1HE LYS A 167 52.521 45.628 6.871 1.00 0.16 A +ATOM 2281 2HE LYS A 167 53.659 46.767 7.588 1.00 0.16 A +ATOM 2282 1HZ LYS A 167 54.203 43.920 6.965 1.00 0.15 A +ATOM 2283 2HZ LYS A 167 55.313 45.022 7.631 1.00 0.16 A +ATOM 2284 3HZ LYS A 167 54.726 45.251 6.054 1.00 0.17 A +ATOM 2285 N LYS A 168 48.170 45.888 9.208 1.00 0.15 A +ATOM 2286 CA LYS A 168 46.969 46.212 8.440 1.00 0.16 A +ATOM 2287 C LYS A 168 45.738 45.676 9.191 1.00 0.15 A +ATOM 2288 CB LYS A 168 47.014 45.719 6.995 1.00 0.16 A +ATOM 2289 CG LYS A 168 45.594 45.584 6.346 1.00 0.17 A +ATOM 2290 CD LYS A 168 45.496 44.324 5.461 1.00 0.17 A +ATOM 2291 CE LYS A 168 44.107 44.222 4.824 1.00 0.18 A +ATOM 2292 NZ LYS A 168 43.803 42.803 4.459 1.00 0.18 A +ATOM 2293 H LYS A 168 48.906 46.534 9.217 1.00 0.15 A +ATOM 2294 HA LYS A 168 46.848 47.285 8.429 1.00 0.16 A +ATOM 2295 1HB LYS A 168 47.599 46.418 6.411 1.00 0.17 A +ATOM 2296 2HB LYS A 168 47.504 44.798 6.994 1.00 0.16 A +ATOM 2297 1HG LYS A 168 44.838 45.524 7.099 1.00 0.17 A +ATOM 2298 2HG LYS A 168 45.407 46.453 5.734 1.00 0.18 A +ATOM 2299 1HD LYS A 168 46.247 44.369 4.688 1.00 0.18 A +ATOM 2300 2HD LYS A 168 45.648 43.453 6.070 1.00 0.17 A +ATOM 2301 1HE LYS A 168 43.366 44.568 5.526 1.00 0.18 A +ATOM 2302 2HE LYS A 168 44.077 44.831 3.936 1.00 0.19 A +ATOM 2303 1HZ LYS A 168 42.829 42.575 4.745 1.00 0.18 A +ATOM 2304 2HZ LYS A 168 44.465 42.162 4.944 1.00 0.17 A +ATOM 2305 3HZ LYS A 168 43.894 42.682 3.430 1.00 0.19 A +TER 2306 LYS A 168 +ATOM 2307 N MET B 1 13.639 37.821 -0.846 1.00 0.21 B +ATOM 2308 CA MET B 1 14.123 37.656 0.530 1.00 0.20 B +ATOM 2309 C MET B 1 13.201 36.682 1.252 1.00 0.19 B +ATOM 2310 O MET B 1 12.049 36.500 0.900 1.00 0.19 B +ATOM 2311 CB MET B 1 14.116 39.022 1.227 1.00 0.20 B +ATOM 2312 CG MET B 1 13.755 38.872 2.711 1.00 0.18 B +ATOM 2313 SD MET B 1 13.906 40.480 3.509 1.00 0.19 B +ATOM 2314 CE MET B 1 15.668 40.712 3.151 1.00 0.19 B +ATOM 2315 HA MET B 1 15.128 37.258 0.518 1.00 0.19 B +ATOM 2316 1HB MET B 1 15.069 39.449 1.136 1.00 0.20 B +ATOM 2317 2HB MET B 1 13.398 39.668 0.750 1.00 0.21 B +ATOM 2318 1HG MET B 1 12.736 38.517 2.806 1.00 0.19 B +ATOM 2319 2HG MET B 1 14.429 38.167 3.178 1.00 0.17 B +ATOM 2320 1HE MET B 1 15.775 41.242 2.210 1.00 0.20 B +ATOM 2321 2HE MET B 1 16.153 39.748 3.076 1.00 0.18 B +ATOM 2322 3HE MET B 1 16.124 41.277 3.939 1.00 0.19 B +ATOM 2323 N PHE B 2 13.709 36.079 2.279 1.00 0.17 B +ATOM 2324 CA PHE B 2 12.907 35.138 3.066 1.00 0.17 B +ATOM 2325 C PHE B 2 13.306 35.323 4.540 1.00 0.15 B +ATOM 2326 O PHE B 2 14.460 35.552 4.851 1.00 0.15 B +ATOM 2327 CB PHE B 2 13.200 33.779 2.434 1.00 0.17 B +ATOM 2328 CG PHE B 2 12.433 32.720 3.155 1.00 0.16 B +ATOM 2329 CD1 PHE B 2 11.049 32.687 3.040 1.00 0.17 B +ATOM 2330 CD2 PHE B 2 13.098 31.779 3.926 1.00 0.16 B +ATOM 2331 CE1 PHE B 2 10.319 31.700 3.699 1.00 0.17 B +ATOM 2332 CE2 PHE B 2 12.381 30.780 4.586 1.00 0.16 B +ATOM 2333 CZ PHE B 2 10.989 30.741 4.471 1.00 0.16 B +ATOM 2334 H PHE B 2 14.640 36.251 2.541 1.00 0.17 B +ATOM 2335 HA PHE B 2 11.853 35.364 2.993 1.00 0.17 B +ATOM 2336 1HB PHE B 2 12.885 33.801 1.397 1.00 0.18 B +ATOM 2337 2HB PHE B 2 14.260 33.575 2.479 1.00 0.16 B +ATOM 2338 HD1 PHE B 2 10.543 33.426 2.439 1.00 0.18 B +ATOM 2339 HD2 PHE B 2 14.166 31.833 4.016 1.00 0.15 B +ATOM 2340 HE1 PHE B 2 9.242 31.675 3.614 1.00 0.18 B +ATOM 2341 HE2 PHE B 2 12.899 30.033 5.171 1.00 0.15 B +ATOM 2342 HZ PHE B 2 10.429 29.979 4.987 1.00 0.17 B +ATOM 2343 N GLN B 3 12.352 35.266 5.454 1.00 0.15 B +ATOM 2344 CA GLN B 3 12.674 35.459 6.891 1.00 0.14 B +ATOM 2345 C GLN B 3 11.679 34.676 7.745 1.00 0.14 B +ATOM 2346 O GLN B 3 10.579 34.357 7.327 1.00 0.15 B +ATOM 2347 CB GLN B 3 12.681 36.930 7.295 1.00 0.14 B +ATOM 2348 CG GLN B 3 11.407 37.762 7.085 1.00 0.16 B +ATOM 2349 CD GLN B 3 11.836 39.239 7.246 1.00 0.16 B +ATOM 2350 OE1 GLN B 3 11.476 39.903 8.199 1.00 0.16 B +ATOM 2351 NE2 GLN B 3 12.552 39.790 6.309 1.00 0.17 B +ATOM 2352 H GLN B 3 11.426 35.086 5.193 1.00 0.16 B +ATOM 2353 HA GLN B 3 13.676 35.072 7.066 1.00 0.13 B +ATOM 2354 1HB GLN B 3 12.922 36.978 8.339 1.00 0.13 B +ATOM 2355 2HB GLN B 3 13.464 37.394 6.747 1.00 0.14 B +ATOM 2356 1HG GLN B 3 11.006 37.596 6.101 1.00 0.16 B +ATOM 2357 2HG GLN B 3 10.683 37.521 7.841 1.00 0.15 B +ATOM 2358 1HE2 GLN B 3 12.736 39.297 5.488 1.00 0.17 B +ATOM 2359 2HE2 GLN B 3 13.019 40.629 6.484 1.00 0.17 B +ATOM 2360 N GLN B 4 12.076 34.372 8.937 1.00 0.13 B +ATOM 2361 CA GLN B 4 11.223 33.607 9.889 1.00 0.13 B +ATOM 2362 C GLN B 4 11.665 34.006 11.311 1.00 0.12 B +ATOM 2363 O GLN B 4 12.827 34.277 11.539 1.00 0.11 B +ATOM 2364 CB GLN B 4 11.427 32.077 9.744 1.00 0.13 B +ATOM 2365 CG GLN B 4 10.982 31.455 8.393 1.00 0.14 B +ATOM 2366 CD GLN B 4 9.480 31.254 8.482 1.00 0.15 B +ATOM 2367 OE1 GLN B 4 9.028 30.209 8.927 1.00 0.16 B +ATOM 2368 NE2 GLN B 4 8.689 32.120 7.931 1.00 0.16 B +ATOM 2369 H GLN B 4 12.962 34.659 9.228 1.00 0.12 B +ATOM 2370 HA GLN B 4 10.190 33.859 9.746 1.00 0.14 B +ATOM 2371 1HB GLN B 4 12.467 31.876 9.869 1.00 0.12 B +ATOM 2372 2HB GLN B 4 10.883 31.593 10.547 1.00 0.13 B +ATOM 2373 1HG GLN B 4 11.235 32.108 7.577 1.00 0.14 B +ATOM 2374 2HG GLN B 4 11.472 30.496 8.267 1.00 0.14 B +ATOM 2375 1HE2 GLN B 4 9.047 32.789 7.337 1.00 0.16 B +ATOM 2376 2HE2 GLN B 4 7.826 32.268 8.315 1.00 0.16 B +ATOM 2377 N GLU B 5 10.758 34.025 12.256 1.00 0.13 B +ATOM 2378 CA GLU B 5 11.095 34.358 13.653 1.00 0.12 B +ATOM 2379 C GLU B 5 11.365 33.050 14.409 1.00 0.12 B +ATOM 2380 O GLU B 5 10.768 32.028 14.115 1.00 0.13 B +ATOM 2381 CB GLU B 5 9.874 34.978 14.380 1.00 0.14 B +ATOM 2382 CG GLU B 5 9.987 36.511 14.541 1.00 0.14 B +ATOM 2383 CD GLU B 5 8.615 37.199 14.486 1.00 0.15 B +ATOM 2384 OE1 GLU B 5 7.900 37.012 13.513 1.00 0.16 B +ATOM 2385 OE2 GLU B 5 8.314 37.926 15.424 1.00 0.16 B +ATOM 2386 H GLU B 5 9.839 33.803 12.038 1.00 0.14 B +ATOM 2387 HA GLU B 5 11.926 35.038 13.673 1.00 0.12 B +ATOM 2388 1HB GLU B 5 8.987 34.746 13.815 1.00 0.14 B +ATOM 2389 2HB GLU B 5 9.776 34.536 15.369 1.00 0.14 B +ATOM 2390 1HG GLU B 5 10.415 36.723 15.494 1.00 0.14 B +ATOM 2391 2HG GLU B 5 10.616 36.916 13.775 1.00 0.14 B +ATOM 2392 N VAL B 6 12.181 33.091 15.425 1.00 0.12 B +ATOM 2393 CA VAL B 6 12.393 31.890 16.260 1.00 0.12 B +ATOM 2394 C VAL B 6 12.712 32.372 17.683 1.00 0.13 B +ATOM 2395 O VAL B 6 13.353 33.391 17.872 1.00 0.12 B +ATOM 2396 CB VAL B 6 13.500 30.972 15.693 1.00 0.12 B +ATOM 2397 CG1 VAL B 6 14.831 31.704 15.578 1.00 0.10 B +ATOM 2398 CG2 VAL B 6 13.694 29.733 16.589 1.00 0.13 B +ATOM 2399 H VAL B 6 12.626 33.929 15.660 1.00 0.11 B +ATOM 2400 HA VAL B 6 11.468 31.331 16.295 1.00 0.13 B +ATOM 2401 HB VAL B 6 13.202 30.641 14.709 1.00 0.12 B +ATOM 2402 1HG1 VAL B 6 14.693 32.622 15.030 1.00 0.10 B +ATOM 2403 2HG1 VAL B 6 15.534 31.072 15.051 1.00 0.10 B +ATOM 2404 3HG1 VAL B 6 15.212 31.919 16.564 1.00 0.11 B +ATOM 2405 1HG2 VAL B 6 14.070 30.036 17.555 1.00 0.13 B +ATOM 2406 2HG2 VAL B 6 14.404 29.063 16.123 1.00 0.13 B +ATOM 2407 3HG2 VAL B 6 12.751 29.222 16.712 1.00 0.14 B +ATOM 2408 N THR B 7 12.254 31.650 18.679 1.00 0.14 B +ATOM 2409 CA THR B 7 12.522 32.005 20.094 1.00 0.14 B +ATOM 2410 C THR B 7 13.772 31.253 20.603 1.00 0.14 B +ATOM 2411 O THR B 7 13.934 30.061 20.388 1.00 0.15 B +ATOM 2412 CB THR B 7 11.352 31.602 20.995 1.00 0.16 B +ATOM 2413 OG1 THR B 7 10.195 32.281 20.512 1.00 0.16 B +ATOM 2414 CG2 THR B 7 11.634 32.021 22.451 1.00 0.17 B +ATOM 2415 H THR B 7 11.736 30.852 18.488 1.00 0.14 B +ATOM 2416 HA THR B 7 12.661 33.066 20.166 1.00 0.14 B +ATOM 2417 HB THR B 7 11.195 30.533 20.944 1.00 0.16 B +ATOM 2418 HG1 THR B 7 9.859 32.844 21.213 1.00 0.17 B +ATOM 2419 1HG2 THR B 7 11.964 33.049 22.474 1.00 0.16 B +ATOM 2420 2HG2 THR B 7 12.406 31.389 22.872 1.00 0.17 B +ATOM 2421 3HG2 THR B 7 10.732 31.921 23.039 1.00 0.18 B +ATOM 2422 N ILE B 8 14.612 31.953 21.315 1.00 0.14 B +ATOM 2423 CA ILE B 8 15.832 31.383 21.916 1.00 0.14 B +ATOM 2424 C ILE B 8 15.367 30.802 23.254 1.00 0.16 B +ATOM 2425 O ILE B 8 14.911 31.511 24.138 1.00 0.16 B +ATOM 2426 CB ILE B 8 16.933 32.467 22.134 1.00 0.14 B +ATOM 2427 CG1 ILE B 8 17.465 32.868 20.746 1.00 0.12 B +ATOM 2428 CG2 ILE B 8 18.059 31.908 23.010 1.00 0.14 B +ATOM 2429 CD1 ILE B 8 18.523 33.974 20.835 1.00 0.12 B +ATOM 2430 H ILE B 8 14.409 32.880 21.482 1.00 0.14 B +ATOM 2431 HA ILE B 8 16.219 30.613 21.257 1.00 0.14 B +ATOM 2432 HB ILE B 8 16.503 33.329 22.621 1.00 0.14 B +ATOM 2433 1HG1 ILE B 8 17.902 32.002 20.273 1.00 0.12 B +ATOM 2434 2HG1 ILE B 8 16.639 33.220 20.146 1.00 0.12 B +ATOM 2435 1HG2 ILE B 8 18.860 32.631 23.064 1.00 0.14 B +ATOM 2436 2HG2 ILE B 8 18.430 30.986 22.594 1.00 0.14 B +ATOM 2437 3HG2 ILE B 8 17.678 31.721 23.996 1.00 0.15 B +ATOM 2438 1HD1 ILE B 8 18.998 34.086 19.869 1.00 0.11 B +ATOM 2439 2HD1 ILE B 8 19.268 33.711 21.570 1.00 0.12 B +ATOM 2440 3HD1 ILE B 8 18.053 34.905 21.111 1.00 0.12 B +ATOM 2441 N THR B 9 15.440 29.516 23.363 1.00 0.17 B +ATOM 2442 CA THR B 9 14.993 28.768 24.601 1.00 0.18 B +ATOM 2443 C THR B 9 16.152 28.218 25.476 1.00 0.19 B +ATOM 2444 O THR B 9 15.887 27.673 26.531 1.00 0.21 B +ATOM 2445 CB THR B 9 14.055 27.572 24.219 1.00 0.19 B +ATOM 2446 OG1 THR B 9 14.754 26.720 23.298 1.00 0.19 B +ATOM 2447 CG2 THR B 9 12.748 28.127 23.633 1.00 0.19 B +ATOM 2448 H THR B 9 15.779 29.020 22.604 1.00 0.16 B +ATOM 2449 HA THR B 9 14.457 29.446 25.229 1.00 0.19 B +ATOM 2450 HB THR B 9 13.818 27.008 25.113 1.00 0.21 B +ATOM 2451 HG1 THR B 9 14.133 26.349 22.674 1.00 0.19 B +ATOM 2452 1HG2 THR B 9 12.345 28.867 24.315 1.00 0.19 B +ATOM 2453 2HG2 THR B 9 12.030 27.329 23.515 1.00 0.20 B +ATOM 2454 3HG2 THR B 9 12.941 28.589 22.678 1.00 0.18 B +ATOM 2455 N ALA B 10 17.396 28.348 25.084 1.00 0.18 B +ATOM 2456 CA ALA B 10 18.534 27.840 25.896 1.00 0.19 B +ATOM 2457 C ALA B 10 18.738 28.706 27.151 1.00 0.20 B +ATOM 2458 O ALA B 10 18.656 29.907 27.052 1.00 0.19 B +ATOM 2459 CB ALA B 10 19.777 27.935 25.015 1.00 0.18 B +ATOM 2460 H ALA B 10 17.586 28.787 24.237 1.00 0.17 B +ATOM 2461 HA ALA B 10 18.359 26.819 26.164 1.00 0.20 B +ATOM 2462 1HB ALA B 10 19.522 27.647 24.011 1.00 0.18 B +ATOM 2463 2HB ALA B 10 20.543 27.277 25.395 1.00 0.19 B +ATOM 2464 3HB ALA B 10 20.144 28.952 25.010 1.00 0.18 B +ATOM 2465 N PRO B 11 19.025 28.117 28.314 1.00 0.21 B +ATOM 2466 CA PRO B 11 19.258 28.881 29.580 1.00 0.22 B +ATOM 2467 C PRO B 11 20.163 30.070 29.501 1.00 0.21 B +ATOM 2468 O PRO B 11 19.811 31.108 30.043 1.00 0.22 B +ATOM 2469 CB PRO B 11 19.774 27.791 30.541 1.00 0.24 B +ATOM 2470 CG PRO B 11 19.132 26.521 30.048 1.00 0.24 B +ATOM 2471 CD PRO B 11 19.132 26.630 28.515 1.00 0.23 B +ATOM 2472 HA PRO B 11 18.338 29.263 29.943 1.00 0.23 B +ATOM 2473 1HB PRO B 11 20.853 27.711 30.481 1.00 0.24 B +ATOM 2474 2HB PRO B 11 19.467 27.996 31.555 1.00 0.25 B +ATOM 2475 1HG PRO B 11 19.689 25.658 30.378 1.00 0.25 B +ATOM 2476 2HG PRO B 11 18.112 26.469 30.406 1.00 0.25 B +ATOM 2477 1HD PRO B 11 20.060 26.249 28.109 1.00 0.23 B +ATOM 2478 2HD PRO B 11 18.282 26.121 28.108 1.00 0.23 B +ATOM 2479 N ASN B 12 21.283 30.019 28.867 1.00 0.21 B +ATOM 2480 CA ASN B 12 22.086 31.288 28.855 1.00 0.20 B +ATOM 2481 C ASN B 12 21.915 31.914 27.477 1.00 0.19 B +ATOM 2482 O ASN B 12 22.793 32.599 26.989 1.00 0.18 B +ATOM 2483 CB ASN B 12 23.556 30.981 29.187 1.00 0.21 B +ATOM 2484 CG ASN B 12 23.659 30.470 30.625 1.00 0.30 B +ATOM 2485 OD1 ASN B 12 22.751 30.650 31.413 1.00 1.08 B +ATOM 2486 ND2 ASN B 12 24.735 29.836 31.004 1.00 0.68 B +ATOM 2487 H ASN B 12 21.587 29.197 28.402 1.00 0.21 B +ATOM 2488 HA ASN B 12 21.696 31.988 29.598 1.00 0.21 B +ATOM 2489 1HB ASN B 12 23.928 30.227 28.508 1.00 0.26 B +ATOM 2490 2HB ASN B 12 24.144 31.881 29.083 1.00 0.25 B +ATOM 2491 1HD2 ASN B 12 25.467 29.691 30.369 1.00 1.34 B +ATOM 2492 2HD2 ASN B 12 24.811 29.504 31.923 1.00 0.66 B +ATOM 2493 N GLY B 13 20.778 31.687 26.819 1.00 0.18 B +ATOM 2494 CA GLY B 13 20.626 32.301 25.471 1.00 0.16 B +ATOM 2495 C GLY B 13 21.721 31.822 24.526 1.00 0.16 B +ATOM 2496 O GLY B 13 22.197 30.695 24.605 1.00 0.16 B +ATOM 2497 H GLY B 13 20.057 31.124 27.203 1.00 0.19 B +ATOM 2498 1HA GLY B 13 19.675 32.025 25.055 1.00 0.16 B +ATOM 2499 2HA GLY B 13 20.686 33.369 25.553 1.00 0.16 B +ATOM 2500 N LEU B 14 22.117 32.662 23.597 1.00 0.14 B +ATOM 2501 CA LEU B 14 23.141 32.209 22.632 1.00 0.14 B +ATOM 2502 C LEU B 14 24.516 32.470 23.213 1.00 0.15 B +ATOM 2503 O LEU B 14 25.190 33.391 22.800 1.00 0.14 B +ATOM 2504 CB LEU B 14 22.910 32.956 21.312 1.00 0.12 B +ATOM 2505 CG LEU B 14 23.721 32.365 20.155 1.00 0.12 B +ATOM 2506 CD1 LEU B 14 23.130 31.034 19.682 1.00 0.12 B +ATOM 2507 CD2 LEU B 14 23.675 33.366 18.999 1.00 0.11 B +ATOM 2508 H LEU B 14 21.722 33.566 23.530 1.00 0.14 B +ATOM 2509 HA LEU B 14 23.039 31.153 22.470 1.00 0.14 B +ATOM 2510 1HB LEU B 14 21.861 32.906 21.062 1.00 0.12 B +ATOM 2511 2HB LEU B 14 23.189 33.991 21.447 1.00 0.12 B +ATOM 2512 HG LEU B 14 24.732 32.210 20.465 1.00 0.13 B +ATOM 2513 1HD1 LEU B 14 22.069 31.143 19.532 1.00 0.12 B +ATOM 2514 2HD1 LEU B 14 23.315 30.268 20.417 1.00 0.13 B +ATOM 2515 3HD1 LEU B 14 23.596 30.749 18.750 1.00 0.12 B +ATOM 2516 1HD2 LEU B 14 22.652 33.685 18.845 1.00 0.10 B +ATOM 2517 2HD2 LEU B 14 24.045 32.903 18.098 1.00 0.11 B +ATOM 2518 3HD2 LEU B 14 24.283 34.224 19.243 1.00 0.11 B +ATOM 2519 N HIS B 15 24.940 31.677 24.190 1.00 0.16 B +ATOM 2520 CA HIS B 15 26.285 31.936 24.792 1.00 0.17 B +ATOM 2521 C HIS B 15 27.427 31.625 23.834 1.00 0.17 B +ATOM 2522 O HIS B 15 27.237 31.345 22.669 1.00 0.16 B +ATOM 2523 CB HIS B 15 26.427 31.192 26.135 1.00 0.18 B +ATOM 2524 CG HIS B 15 26.055 29.743 25.976 1.00 0.37 B +ATOM 2525 ND1 HIS B 15 27.006 28.735 25.967 1.00 0.57 B +ATOM 2526 CD2 HIS B 15 24.842 29.115 25.848 1.00 0.59 B +ATOM 2527 CE1 HIS B 15 26.356 27.565 25.840 1.00 0.79 B +ATOM 2528 NE2 HIS B 15 25.034 27.739 25.762 1.00 0.81 B +ATOM 2529 H HIS B 15 24.375 30.941 24.532 1.00 0.16 B +ATOM 2530 HA HIS B 15 26.378 32.991 24.969 1.00 0.17 B +ATOM 2531 1HB HIS B 15 27.449 31.261 26.475 1.00 0.30 B +ATOM 2532 2HB HIS B 15 25.777 31.650 26.866 1.00 0.29 B +ATOM 2533 HD2 HIS B 15 23.884 29.611 25.823 1.00 0.67 B +ATOM 2534 HE1 HIS B 15 26.843 26.602 25.805 1.00 0.98 B +ATOM 2535 N THR B 16 28.623 31.796 24.323 1.00 0.18 B +ATOM 2536 CA THR B 16 29.847 31.650 23.470 1.00 0.18 B +ATOM 2537 C THR B 16 29.988 30.408 22.588 1.00 0.18 B +ATOM 2538 O THR B 16 30.137 30.563 21.388 1.00 0.17 B +ATOM 2539 CB THR B 16 31.127 31.844 24.346 1.00 0.19 B +ATOM 2540 OG1 THR B 16 30.907 32.899 25.272 1.00 0.21 B +ATOM 2541 CG2 THR B 16 32.318 32.197 23.452 1.00 0.19 B +ATOM 2542 H THR B 16 28.718 32.099 25.256 1.00 0.18 B +ATOM 2543 HA THR B 16 29.815 32.423 22.743 1.00 0.17 B +ATOM 2544 HB THR B 16 31.339 30.931 24.882 1.00 0.21 B +ATOM 2545 HG1 THR B 16 30.625 32.510 26.103 1.00 0.92 B +ATOM 2546 1HG2 THR B 16 32.279 31.615 22.543 1.00 1.05 B +ATOM 2547 2HG2 THR B 16 33.233 31.978 23.975 1.00 1.01 B +ATOM 2548 3HG2 THR B 16 32.286 33.248 23.208 1.00 1.01 B +ATOM 2549 N ARG B 17 30.014 29.219 23.068 1.00 0.19 B +ATOM 2550 CA ARG B 17 30.233 28.107 22.095 1.00 0.19 B +ATOM 2551 C ARG B 17 29.093 27.973 21.065 1.00 0.18 B +ATOM 2552 O ARG B 17 29.372 27.809 19.894 1.00 0.18 B +ATOM 2553 CB ARG B 17 30.550 26.827 22.900 1.00 0.20 B +ATOM 2554 CG ARG B 17 30.285 25.575 22.050 1.00 0.33 B +ATOM 2555 CD ARG B 17 30.674 24.322 22.839 1.00 0.26 B +ATOM 2556 NE ARG B 17 32.034 24.494 23.422 1.00 0.71 B +ATOM 2557 CZ ARG B 17 32.439 23.695 24.372 1.00 0.68 B +ATOM 2558 NH1 ARG B 17 31.654 22.749 24.808 1.00 1.24 B +ATOM 2559 NH2 ARG B 17 33.630 23.843 24.884 1.00 1.12 B +ATOM 2560 H ARG B 17 29.931 29.045 24.033 1.00 0.19 B +ATOM 2561 HA ARG B 17 31.087 28.352 21.481 1.00 0.19 B +ATOM 2562 1HB ARG B 17 31.591 26.843 23.191 1.00 0.33 B +ATOM 2563 2HB ARG B 17 29.939 26.794 23.787 1.00 0.29 B +ATOM 2564 1HG ARG B 17 29.235 25.521 21.801 1.00 0.61 B +ATOM 2565 2HG ARG B 17 30.869 25.623 21.144 1.00 0.58 B +ATOM 2566 1HD ARG B 17 29.960 24.163 23.634 1.00 0.62 B +ATOM 2567 2HD ARG B 17 30.672 23.467 22.179 1.00 0.38 B +ATOM 2568 HE ARG B 17 32.622 25.204 23.094 1.00 1.44 B +ATOM 2569 1HH1 ARG B 17 30.741 22.636 24.416 1.00 1.48 B +ATOM 2570 2HH1 ARG B 17 31.964 22.137 25.536 1.00 1.73 B +ATOM 2571 1HH2 ARG B 17 34.231 24.567 24.549 1.00 1.66 B +ATOM 2572 2HH2 ARG B 17 33.941 23.231 25.612 1.00 1.25 B +ATOM 2573 N PRO B 18 27.850 28.042 21.427 1.00 0.17 B +ATOM 2574 CA PRO B 18 26.784 27.922 20.414 1.00 0.16 B +ATOM 2575 C PRO B 18 26.758 29.130 19.461 1.00 0.15 B +ATOM 2576 O PRO B 18 26.369 29.011 18.316 1.00 0.14 B +ATOM 2577 CB PRO B 18 25.517 27.772 21.274 1.00 0.16 B +ATOM 2578 CG PRO B 18 25.871 28.154 22.721 1.00 0.18 B +ATOM 2579 CD PRO B 18 27.406 28.206 22.842 1.00 0.18 B +ATOM 2580 HA PRO B 18 26.938 27.035 19.827 1.00 0.17 B +ATOM 2581 1HB PRO B 18 24.738 28.425 20.897 1.00 0.15 B +ATOM 2582 2HB PRO B 18 25.171 26.746 21.244 1.00 0.18 B +ATOM 2583 1HG PRO B 18 25.449 29.125 22.957 1.00 0.19 B +ATOM 2584 2HG PRO B 18 25.476 27.415 23.404 1.00 0.22 B +ATOM 2585 1HD PRO B 18 27.721 29.149 23.247 1.00 0.17 B +ATOM 2586 2HD PRO B 18 27.768 27.390 23.443 1.00 0.20 B +ATOM 2587 N ALA B 19 27.171 30.284 19.911 1.00 0.14 B +ATOM 2588 CA ALA B 19 27.165 31.484 18.997 1.00 0.13 B +ATOM 2589 C ALA B 19 28.248 31.292 17.915 1.00 0.14 B +ATOM 2590 O ALA B 19 28.065 31.651 16.766 1.00 0.13 B +ATOM 2591 CB ALA B 19 27.330 32.766 19.838 1.00 0.13 B +ATOM 2592 H ALA B 19 27.471 30.370 20.843 1.00 0.15 B +ATOM 2593 HA ALA B 19 26.230 31.529 18.468 1.00 0.12 B +ATOM 2594 1HB ALA B 19 26.901 33.604 19.309 1.00 0.13 B +ATOM 2595 2HB ALA B 19 28.376 32.949 20.018 1.00 0.14 B +ATOM 2596 3HB ALA B 19 26.829 32.645 20.783 1.00 0.14 B +ATOM 2597 N ALA B 20 29.351 30.688 18.258 1.00 0.15 B +ATOM 2598 CA ALA B 20 30.425 30.414 17.262 1.00 0.15 B +ATOM 2599 C ALA B 20 29.951 29.302 16.314 1.00 0.15 B +ATOM 2600 O ALA B 20 30.199 29.337 15.119 1.00 0.15 B +ATOM 2601 CB ALA B 20 31.695 29.900 17.957 1.00 0.17 B +ATOM 2602 H ALA B 20 29.474 30.397 19.174 1.00 0.15 B +ATOM 2603 HA ALA B 20 30.650 31.325 16.720 1.00 0.15 B +ATOM 2604 1HB ALA B 20 32.466 29.778 17.215 1.00 0.17 B +ATOM 2605 2HB ALA B 20 31.492 28.945 18.420 1.00 0.18 B +ATOM 2606 3HB ALA B 20 32.015 30.607 18.707 1.00 0.18 B +ATOM 2607 N GLN B 21 29.265 28.295 16.836 1.00 0.16 B +ATOM 2608 CA GLN B 21 28.781 27.215 15.913 1.00 0.16 B +ATOM 2609 C GLN B 21 27.687 27.812 14.974 1.00 0.15 B +ATOM 2610 O GLN B 21 27.585 27.443 13.820 1.00 0.15 B +ATOM 2611 CB GLN B 21 28.198 26.016 16.676 1.00 0.17 B +ATOM 2612 CG GLN B 21 29.303 25.378 17.521 1.00 0.18 B +ATOM 2613 CD GLN B 21 28.721 24.242 18.364 1.00 1.15 B +ATOM 2614 OE1 GLN B 21 27.522 24.047 18.398 1.00 1.74 B +ATOM 2615 NE2 GLN B 21 29.527 23.482 19.054 1.00 1.63 B +ATOM 2616 H GLN B 21 29.059 28.269 17.801 1.00 0.16 B +ATOM 2617 HA GLN B 21 29.623 26.873 15.324 1.00 0.17 B +ATOM 2618 1HB GLN B 21 27.397 26.352 17.319 1.00 0.17 B +ATOM 2619 2HB GLN B 21 27.818 25.290 15.973 1.00 0.17 B +ATOM 2620 1HG GLN B 21 30.071 24.985 16.870 1.00 0.85 B +ATOM 2621 2HG GLN B 21 29.731 26.123 18.174 1.00 0.87 B +ATOM 2622 1HE2 GLN B 21 30.493 23.643 19.027 1.00 1.40 B +ATOM 2623 2HE2 GLN B 21 29.167 22.754 19.601 1.00 2.35 B +ATOM 2624 N PHE B 22 26.857 28.725 15.477 1.00 0.13 B +ATOM 2625 CA PHE B 22 25.774 29.334 14.662 1.00 0.12 B +ATOM 2626 C PHE B 22 26.409 30.135 13.525 1.00 0.12 B +ATOM 2627 O PHE B 22 26.008 30.066 12.374 1.00 0.12 B +ATOM 2628 CB PHE B 22 24.915 30.243 15.585 1.00 0.11 B +ATOM 2629 CG PHE B 22 23.824 30.953 14.793 1.00 0.10 B +ATOM 2630 CD1 PHE B 22 22.607 30.306 14.573 1.00 0.10 B +ATOM 2631 CD2 PHE B 22 24.022 32.249 14.290 1.00 0.09 B +ATOM 2632 CE1 PHE B 22 21.581 30.936 13.859 1.00 0.09 B +ATOM 2633 CE2 PHE B 22 23.000 32.883 13.574 1.00 0.09 B +ATOM 2634 CZ PHE B 22 21.780 32.230 13.358 1.00 0.09 B +ATOM 2635 H PHE B 22 26.949 28.994 16.408 1.00 0.13 B +ATOM 2636 HA PHE B 22 25.162 28.555 14.248 1.00 0.12 B +ATOM 2637 1HB PHE B 22 24.448 29.628 16.343 1.00 0.12 B +ATOM 2638 2HB PHE B 22 25.549 30.973 16.063 1.00 0.11 B +ATOM 2639 HD1 PHE B 22 22.458 29.319 14.965 1.00 0.11 B +ATOM 2640 HD2 PHE B 22 24.958 32.760 14.454 1.00 0.10 B +ATOM 2641 HE1 PHE B 22 20.643 30.419 13.688 1.00 0.09 B +ATOM 2642 HE2 PHE B 22 23.154 33.877 13.189 1.00 0.09 B +ATOM 2643 HZ PHE B 22 20.991 32.729 12.815 1.00 0.08 B +ATOM 2644 N VAL B 23 27.414 30.881 13.868 1.00 0.12 B +ATOM 2645 CA VAL B 23 28.163 31.727 12.878 1.00 0.13 B +ATOM 2646 C VAL B 23 28.871 30.846 11.846 1.00 0.14 B +ATOM 2647 O VAL B 23 28.889 31.155 10.671 1.00 0.14 B +ATOM 2648 CB VAL B 23 29.165 32.675 13.609 1.00 0.13 B +ATOM 2649 CG1 VAL B 23 30.066 33.360 12.581 1.00 0.14 B +ATOM 2650 CG2 VAL B 23 28.383 33.737 14.387 1.00 0.12 B +ATOM 2651 H VAL B 23 27.689 30.889 14.801 1.00 0.12 B +ATOM 2652 HA VAL B 23 27.460 32.317 12.333 1.00 0.12 B +ATOM 2653 HB VAL B 23 29.773 32.098 14.292 1.00 0.14 B +ATOM 2654 1HG1 VAL B 23 30.793 32.651 12.212 1.00 1.01 B +ATOM 2655 2HG1 VAL B 23 30.578 34.190 13.046 1.00 1.05 B +ATOM 2656 3HG1 VAL B 23 29.466 33.721 11.759 1.00 1.01 B +ATOM 2657 1HG2 VAL B 23 29.064 34.307 15.001 1.00 1.03 B +ATOM 2658 2HG2 VAL B 23 27.649 33.255 15.015 1.00 1.03 B +ATOM 2659 3HG2 VAL B 23 27.885 34.397 13.693 1.00 1.01 B +ATOM 2660 N LYS B 24 29.442 29.760 12.254 1.00 0.14 B +ATOM 2661 CA LYS B 24 30.128 28.876 11.284 1.00 0.16 B +ATOM 2662 C LYS B 24 29.110 28.303 10.301 1.00 0.16 B +ATOM 2663 O LYS B 24 29.356 28.205 9.115 1.00 0.16 B +ATOM 2664 CB LYS B 24 30.816 27.705 12.019 1.00 0.17 B +ATOM 2665 CG LYS B 24 31.759 26.971 11.064 1.00 0.22 B +ATOM 2666 CD LYS B 24 32.338 25.741 11.767 1.00 1.00 B +ATOM 2667 CE LYS B 24 33.397 25.092 10.873 1.00 1.18 B +ATOM 2668 NZ LYS B 24 34.165 24.088 11.662 1.00 1.22 B +ATOM 2669 H LYS B 24 29.421 29.524 13.199 1.00 0.14 B +ATOM 2670 HA LYS B 24 30.860 29.453 10.749 1.00 0.16 B +ATOM 2671 1HB LYS B 24 31.381 28.090 12.856 1.00 0.17 B +ATOM 2672 2HB LYS B 24 30.065 27.017 12.379 1.00 0.20 B +ATOM 2673 1HG LYS B 24 31.215 26.663 10.184 1.00 0.78 B +ATOM 2674 2HG LYS B 24 32.566 27.630 10.780 1.00 0.75 B +ATOM 2675 1HD LYS B 24 32.789 26.040 12.702 1.00 1.57 B +ATOM 2676 2HD LYS B 24 31.548 25.030 11.959 1.00 1.59 B +ATOM 2677 1HE LYS B 24 32.914 24.602 10.040 1.00 1.54 B +ATOM 2678 2HE LYS B 24 34.070 25.851 10.503 1.00 1.52 B +ATOM 2679 1HZ LYS B 24 34.907 23.672 11.065 1.00 1.64 B +ATOM 2680 2HZ LYS B 24 33.521 23.339 11.990 1.00 1.60 B +ATOM 2681 3HZ LYS B 24 34.603 24.553 12.482 1.00 1.57 B +ATOM 2682 N GLU B 25 27.967 27.925 10.793 1.00 0.15 B +ATOM 2683 CA GLU B 25 26.935 27.366 9.923 1.00 0.15 B +ATOM 2684 C GLU B 25 26.401 28.483 8.984 1.00 0.14 B +ATOM 2685 O GLU B 25 26.151 28.248 7.814 1.00 0.15 B +ATOM 2686 CB GLU B 25 25.784 26.772 10.757 1.00 0.15 B +ATOM 2687 CG GLU B 25 24.806 26.202 9.673 1.00 0.15 B +ATOM 2688 CD GLU B 25 23.664 25.269 10.101 1.00 0.15 B +ATOM 2689 OE1 GLU B 25 23.922 24.167 10.558 1.00 0.17 B +ATOM 2690 OE2 GLU B 25 22.530 25.643 9.835 1.00 0.15 B +ATOM 2691 H GLU B 25 27.793 28.028 11.745 1.00 0.14 B +ATOM 2692 HA GLU B 25 27.374 26.572 9.324 1.00 0.16 B +ATOM 2693 1HB GLU B 25 26.159 25.993 11.412 1.00 0.15 B +ATOM 2694 2HB GLU B 25 25.300 27.549 11.330 1.00 0.14 B +ATOM 2695 1HG GLU B 25 24.339 27.038 9.223 1.00 0.14 B +ATOM 2696 2HG GLU B 25 25.385 25.685 8.923 1.00 0.16 B +ATOM 2697 N ALA B 26 26.220 29.697 9.489 1.00 0.13 B +ATOM 2698 CA ALA B 26 25.732 30.817 8.634 1.00 0.13 B +ATOM 2699 C ALA B 26 26.725 31.042 7.472 1.00 0.14 B +ATOM 2700 O ALA B 26 26.325 31.226 6.336 1.00 0.14 B +ATOM 2701 CB ALA B 26 25.578 32.038 9.553 1.00 0.12 B +ATOM 2702 H ALA B 26 26.406 29.865 10.438 1.00 0.13 B +ATOM 2703 HA ALA B 26 24.783 30.566 8.196 1.00 0.12 B +ATOM 2704 1HB ALA B 26 25.139 32.856 9.003 1.00 0.12 B +ATOM 2705 2HB ALA B 26 26.546 32.332 9.931 1.00 0.12 B +ATOM 2706 3HB ALA B 26 24.935 31.777 10.384 1.00 0.11 B +ATOM 2707 N LYS B 27 28.003 31.002 7.740 1.00 0.15 B +ATOM 2708 CA LYS B 27 29.025 31.172 6.664 1.00 0.16 B +ATOM 2709 C LYS B 27 28.964 30.053 5.591 1.00 0.17 B +ATOM 2710 O LYS B 27 29.543 30.193 4.532 1.00 0.18 B +ATOM 2711 CB LYS B 27 30.439 31.179 7.273 1.00 0.17 B +ATOM 2712 CG LYS B 27 30.661 32.476 8.045 1.00 0.17 B +ATOM 2713 CD LYS B 27 32.090 32.508 8.592 1.00 0.29 B +ATOM 2714 CE LYS B 27 32.294 33.780 9.416 1.00 1.15 B +ATOM 2715 NZ LYS B 27 33.748 33.972 9.681 1.00 1.43 B +ATOM 2716 H LYS B 27 28.297 30.859 8.659 1.00 0.14 B +ATOM 2717 HA LYS B 27 28.850 32.108 6.172 1.00 0.16 B +ATOM 2718 1HB LYS B 27 30.545 30.339 7.944 1.00 0.17 B +ATOM 2719 2HB LYS B 27 31.172 31.103 6.484 1.00 0.18 B +ATOM 2720 1HG LYS B 27 30.514 33.312 7.380 1.00 0.20 B +ATOM 2721 2HG LYS B 27 29.961 32.536 8.864 1.00 0.19 B +ATOM 2722 1HD LYS B 27 32.255 31.642 9.218 1.00 1.05 B +ATOM 2723 2HD LYS B 27 32.790 32.497 7.771 1.00 1.10 B +ATOM 2724 1HE LYS B 27 31.914 34.629 8.867 1.00 1.87 B +ATOM 2725 2HE LYS B 27 31.766 33.692 10.353 1.00 1.89 B +ATOM 2726 1HZ LYS B 27 34.216 34.313 8.817 1.00 1.77 B +ATOM 2727 2HZ LYS B 27 34.170 33.066 9.970 1.00 1.93 B +ATOM 2728 3HZ LYS B 27 33.874 34.672 10.439 1.00 1.86 B +ATOM 2729 N GLY B 28 28.298 28.954 5.833 1.00 0.17 B +ATOM 2730 CA GLY B 28 28.247 27.878 4.820 1.00 0.18 B +ATOM 2731 C GLY B 28 27.236 28.260 3.747 1.00 0.18 B +ATOM 2732 O GLY B 28 27.195 27.620 2.705 1.00 0.19 B +ATOM 2733 H GLY B 28 27.828 28.837 6.676 1.00 0.16 B +ATOM 2734 1HA GLY B 28 29.227 27.753 4.373 1.00 0.19 B +ATOM 2735 2HA GLY B 28 27.950 26.952 5.291 1.00 0.18 B +ATOM 2736 N PHE B 29 26.417 29.311 3.971 1.00 0.17 B +ATOM 2737 CA PHE B 29 25.427 29.698 2.904 1.00 0.17 B +ATOM 2738 C PHE B 29 25.909 30.940 2.170 1.00 0.18 B +ATOM 2739 O PHE B 29 26.508 31.824 2.751 1.00 0.17 B +ATOM 2740 CB PHE B 29 24.040 30.004 3.472 1.00 0.16 B +ATOM 2741 CG PHE B 29 23.528 28.823 4.245 1.00 0.16 B +ATOM 2742 CD1 PHE B 29 22.870 27.795 3.579 1.00 0.17 B +ATOM 2743 CD2 PHE B 29 23.700 28.763 5.631 1.00 0.15 B +ATOM 2744 CE1 PHE B 29 22.380 26.711 4.299 1.00 0.17 B +ATOM 2745 CE2 PHE B 29 23.202 27.670 6.344 1.00 0.15 B +ATOM 2746 CZ PHE B 29 22.540 26.648 5.673 1.00 0.16 B +ATOM 2747 H PHE B 29 26.473 29.821 4.816 1.00 0.16 B +ATOM 2748 HA PHE B 29 25.346 28.888 2.198 1.00 0.18 B +ATOM 2749 1HB PHE B 29 24.098 30.857 4.118 1.00 0.15 B +ATOM 2750 2HB PHE B 29 23.361 30.216 2.657 1.00 0.16 B +ATOM 2751 HD1 PHE B 29 22.735 27.841 2.509 1.00 0.17 B +ATOM 2752 HD2 PHE B 29 24.223 29.555 6.148 1.00 0.14 B +ATOM 2753 HE1 PHE B 29 21.885 25.926 3.801 1.00 0.18 B +ATOM 2754 HE2 PHE B 29 23.315 27.623 7.406 1.00 0.14 B +ATOM 2755 HZ PHE B 29 22.152 25.803 6.218 1.00 0.16 B +ATOM 2756 N THR B 30 25.639 31.014 0.891 1.00 0.19 B +ATOM 2757 CA THR B 30 26.088 32.208 0.095 1.00 0.20 B +ATOM 2758 C THR B 30 25.208 33.435 0.335 1.00 0.19 B +ATOM 2759 O THR B 30 25.709 34.541 0.234 1.00 0.20 B +ATOM 2760 CB THR B 30 26.214 31.842 -1.408 1.00 0.21 B +ATOM 2761 OG1 THR B 30 24.948 31.381 -1.876 1.00 0.21 B +ATOM 2762 CG2 THR B 30 27.288 30.751 -1.524 1.00 0.22 B +ATOM 2763 H THR B 30 25.139 30.290 0.453 1.00 0.19 B +ATOM 2764 HA THR B 30 27.054 32.506 0.454 1.00 0.20 B +ATOM 2765 HB THR B 30 26.523 32.709 -1.974 1.00 0.22 B +ATOM 2766 HG1 THR B 30 25.081 30.896 -2.691 1.00 0.22 B +ATOM 2767 1HG2 THR B 30 27.449 30.497 -2.559 1.00 0.23 B +ATOM 2768 2HG2 THR B 30 26.970 29.874 -0.979 1.00 0.21 B +ATOM 2769 3HG2 THR B 30 28.213 31.118 -1.095 1.00 0.22 B +ATOM 2770 N SER B 31 23.938 33.295 0.663 1.00 0.18 B +ATOM 2771 CA SER B 31 23.129 34.514 0.905 1.00 0.18 B +ATOM 2772 C SER B 31 23.653 35.426 2.024 1.00 0.17 B +ATOM 2773 O SER B 31 24.285 35.015 2.986 1.00 0.16 B +ATOM 2774 CB SER B 31 21.708 34.178 1.365 1.00 0.17 B +ATOM 2775 OG SER B 31 21.088 33.306 0.448 1.00 0.18 B +ATOM 2776 H SER B 31 23.526 32.406 0.737 1.00 0.18 B +ATOM 2777 HA SER B 31 23.077 35.069 -0.001 1.00 0.19 B +ATOM 2778 1HB SER B 31 21.743 33.708 2.335 1.00 0.16 B +ATOM 2779 2HB SER B 31 21.140 35.099 1.441 1.00 0.17 B +ATOM 2780 HG SER B 31 21.474 32.440 0.566 1.00 0.18 B +ATOM 2781 N GLU B 32 23.243 36.670 1.927 1.00 0.18 B +ATOM 2782 CA GLU B 32 23.502 37.653 2.993 1.00 0.17 B +ATOM 2783 C GLU B 32 22.415 37.310 4.024 1.00 0.16 B +ATOM 2784 O GLU B 32 21.256 37.149 3.681 1.00 0.16 B +ATOM 2785 CB GLU B 32 23.539 39.120 2.481 1.00 0.19 B +ATOM 2786 CG GLU B 32 22.431 40.155 2.865 1.00 0.19 B +ATOM 2787 CD GLU B 32 21.765 40.086 4.244 1.00 0.17 B +ATOM 2788 OE1 GLU B 32 22.335 40.606 5.194 1.00 0.17 B +ATOM 2789 OE2 GLU B 32 20.628 39.640 4.295 1.00 0.17 B +ATOM 2790 H GLU B 32 22.693 36.915 1.169 1.00 0.18 B +ATOM 2791 HA GLU B 32 24.468 37.421 3.403 1.00 0.17 B +ATOM 2792 1HB GLU B 32 24.481 39.543 2.791 1.00 0.19 B +ATOM 2793 2HB GLU B 32 23.558 39.063 1.400 1.00 0.20 B +ATOM 2794 1HG GLU B 32 22.895 41.126 2.809 1.00 0.20 B +ATOM 2795 2HG GLU B 32 21.665 40.108 2.116 1.00 0.19 B +ATOM 2796 N ILE B 33 22.793 37.117 5.264 1.00 0.15 B +ATOM 2797 CA ILE B 33 21.850 36.689 6.323 1.00 0.13 B +ATOM 2798 C ILE B 33 21.944 37.682 7.472 1.00 0.13 B +ATOM 2799 O ILE B 33 23.028 38.053 7.895 1.00 0.13 B +ATOM 2800 CB ILE B 33 22.268 35.280 6.837 1.00 0.12 B +ATOM 2801 CG1 ILE B 33 22.324 34.284 5.646 1.00 0.13 B +ATOM 2802 CG2 ILE B 33 21.304 34.821 7.949 1.00 0.11 B +ATOM 2803 CD1 ILE B 33 23.170 33.032 5.968 1.00 0.13 B +ATOM 2804 H ILE B 33 23.725 37.244 5.501 1.00 0.15 B +ATOM 2805 HA ILE B 33 20.845 36.660 5.933 1.00 0.13 B +ATOM 2806 HB ILE B 33 23.251 35.363 7.276 1.00 0.12 B +ATOM 2807 1HG1 ILE B 33 21.328 33.974 5.386 1.00 0.13 B +ATOM 2808 2HG1 ILE B 33 22.769 34.783 4.796 1.00 0.14 B +ATOM 2809 1HG2 ILE B 33 21.433 35.464 8.813 1.00 0.11 B +ATOM 2810 2HG2 ILE B 33 21.527 33.803 8.232 1.00 0.11 B +ATOM 2811 3HG2 ILE B 33 20.283 34.888 7.608 1.00 0.11 B +ATOM 2812 1HD1 ILE B 33 22.519 32.187 6.126 1.00 0.13 B +ATOM 2813 2HD1 ILE B 33 23.771 33.190 6.848 1.00 0.12 B +ATOM 2814 3HD1 ILE B 33 23.819 32.827 5.130 1.00 0.14 B +ATOM 2815 N THR B 34 20.811 38.104 7.967 1.00 0.13 B +ATOM 2816 CA THR B 34 20.755 39.073 9.082 1.00 0.13 B +ATOM 2817 C THR B 34 19.921 38.481 10.224 1.00 0.12 B +ATOM 2818 O THR B 34 18.876 37.883 10.024 1.00 0.11 B +ATOM 2819 CB THR B 34 20.068 40.412 8.589 1.00 0.14 B +ATOM 2820 OG1 THR B 34 20.865 40.935 7.536 1.00 0.16 B +ATOM 2821 CG2 THR B 34 19.893 41.530 9.645 1.00 0.15 B +ATOM 2822 H THR B 34 19.983 37.773 7.581 1.00 0.13 B +ATOM 2823 HA THR B 34 21.762 39.282 9.416 1.00 0.13 B +ATOM 2824 HB THR B 34 19.089 40.173 8.193 1.00 0.14 B +ATOM 2825 HG1 THR B 34 20.808 40.331 6.793 1.00 0.16 B +ATOM 2826 1HG2 THR B 34 19.867 42.488 9.130 1.00 0.16 B +ATOM 2827 2HG2 THR B 34 20.708 41.525 10.344 1.00 0.15 B +ATOM 2828 3HG2 THR B 34 18.956 41.396 10.170 1.00 0.15 B +ATOM 2829 N VAL B 35 20.395 38.735 11.402 1.00 0.11 B +ATOM 2830 CA VAL B 35 19.728 38.389 12.685 1.00 0.11 B +ATOM 2831 C VAL B 35 19.219 39.739 13.261 1.00 0.12 B +ATOM 2832 O VAL B 35 19.969 40.691 13.375 1.00 0.13 B +ATOM 2833 CB VAL B 35 20.701 37.672 13.672 1.00 0.10 B +ATOM 2834 CG1 VAL B 35 19.961 37.454 15.002 1.00 0.10 B +ATOM 2835 CG2 VAL B 35 21.183 36.334 13.078 1.00 0.09 B +ATOM 2836 H VAL B 35 21.222 39.228 11.443 1.00 0.12 B +ATOM 2837 HA VAL B 35 18.876 37.772 12.502 1.00 0.10 B +ATOM 2838 HB VAL B 35 21.559 38.308 13.853 1.00 0.10 B +ATOM 2839 1HG1 VAL B 35 19.792 38.414 15.472 1.00 0.10 B +ATOM 2840 2HG1 VAL B 35 20.554 36.835 15.657 1.00 0.09 B +ATOM 2841 3HG1 VAL B 35 19.010 36.978 14.814 1.00 0.09 B +ATOM 2842 1HG2 VAL B 35 20.535 36.032 12.266 1.00 0.09 B +ATOM 2843 2HG2 VAL B 35 21.188 35.567 13.838 1.00 0.09 B +ATOM 2844 3HG2 VAL B 35 22.185 36.463 12.706 1.00 0.09 B +ATOM 2845 N THR B 36 17.938 39.821 13.605 1.00 0.12 B +ATOM 2846 CA THR B 36 17.328 41.063 14.162 1.00 0.13 B +ATOM 2847 C THR B 36 16.678 40.781 15.468 1.00 0.13 B +ATOM 2848 O THR B 36 15.761 39.976 15.574 1.00 0.13 B +ATOM 2849 CB THR B 36 16.271 41.716 13.209 1.00 0.14 B +ATOM 2850 OG1 THR B 36 16.912 42.027 11.980 1.00 0.15 B +ATOM 2851 CG2 THR B 36 15.664 42.990 13.824 1.00 0.16 B +ATOM 2852 H THR B 36 17.380 39.038 13.502 1.00 0.11 B +ATOM 2853 HA THR B 36 18.098 41.763 14.354 1.00 0.14 B +ATOM 2854 HB THR B 36 15.477 41.022 13.027 1.00 0.14 B +ATOM 2855 HG1 THR B 36 17.525 42.752 12.134 1.00 0.16 B +ATOM 2856 1HG2 THR B 36 15.172 43.562 13.049 1.00 0.17 B +ATOM 2857 2HG2 THR B 36 16.438 43.586 14.276 1.00 0.16 B +ATOM 2858 3HG2 THR B 36 14.935 42.713 14.576 1.00 0.16 B +ATOM 2859 N SER B 37 17.143 41.478 16.474 1.00 0.14 B +ATOM 2860 CA SER B 37 16.506 41.302 17.816 1.00 0.14 B +ATOM 2861 C SER B 37 16.071 42.696 18.330 1.00 0.16 B +ATOM 2862 O SER B 37 16.863 43.621 18.399 1.00 0.17 B +ATOM 2863 CB SER B 37 17.476 40.582 18.756 1.00 0.14 B +ATOM 2864 OG SER B 37 16.887 40.527 20.048 1.00 0.14 B +ATOM 2865 H SER B 37 17.891 42.119 16.330 1.00 0.15 B +ATOM 2866 HA SER B 37 15.609 40.705 17.716 1.00 0.14 B +ATOM 2867 1HB SER B 37 17.653 39.581 18.400 1.00 0.13 B +ATOM 2868 2HB SER B 37 18.407 41.115 18.798 1.00 0.14 B +ATOM 2869 HG SER B 37 17.484 40.055 20.628 1.00 0.14 B +ATOM 2870 N ASN B 38 14.785 42.848 18.651 1.00 0.17 B +ATOM 2871 CA ASN B 38 14.236 44.174 19.133 1.00 0.18 B +ATOM 2872 C ASN B 38 14.630 45.353 18.221 1.00 0.19 B +ATOM 2873 O ASN B 38 14.888 46.437 18.699 1.00 0.21 B +ATOM 2874 CB ASN B 38 14.700 44.416 20.584 1.00 0.19 B +ATOM 2875 CG ASN B 38 13.935 45.567 21.247 1.00 0.21 B +ATOM 2876 OD1 ASN B 38 14.452 46.220 22.147 1.00 0.22 B +ATOM 2877 ND2 ASN B 38 12.781 45.925 20.769 1.00 0.22 B +ATOM 2878 H ASN B 38 14.172 42.083 18.565 1.00 0.16 B +ATOM 2879 HA ASN B 38 13.156 44.134 19.111 1.00 0.19 B +ATOM 2880 1HB ASN B 38 14.505 43.520 21.157 1.00 0.19 B +ATOM 2881 2HB ASN B 38 15.757 44.621 20.597 1.00 0.19 B +ATOM 2882 1HD2 ASN B 38 12.459 45.540 19.937 1.00 0.21 B +ATOM 2883 2HD2 ASN B 38 12.166 46.425 21.330 1.00 0.23 B +ATOM 2884 N GLY B 39 14.623 45.184 16.913 1.00 0.19 B +ATOM 2885 CA GLY B 39 14.924 46.333 16.021 1.00 0.20 B +ATOM 2886 C GLY B 39 16.408 46.601 15.868 1.00 0.20 B +ATOM 2887 O GLY B 39 16.787 47.632 15.336 1.00 0.21 B +ATOM 2888 H GLY B 39 14.389 44.318 16.519 1.00 0.18 B +ATOM 2889 1HA GLY B 39 14.516 46.123 15.046 1.00 0.20 B +ATOM 2890 2HA GLY B 39 14.453 47.214 16.424 1.00 0.21 B +ATOM 2891 N LYS B 40 17.252 45.704 16.297 1.00 0.19 B +ATOM 2892 CA LYS B 40 18.711 45.913 16.128 1.00 0.19 B +ATOM 2893 C LYS B 40 19.157 44.692 15.314 1.00 0.17 B +ATOM 2894 O LYS B 40 18.690 43.596 15.520 1.00 0.16 B +ATOM 2895 CB LYS B 40 19.369 46.018 17.497 1.00 0.19 B +ATOM 2896 CG LYS B 40 18.838 47.256 18.222 1.00 0.94 B +ATOM 2897 CD LYS B 40 19.588 47.436 19.543 1.00 1.31 B +ATOM 2898 CE LYS B 40 18.981 48.606 20.318 1.00 1.93 B +ATOM 2899 NZ LYS B 40 19.592 48.672 21.675 1.00 2.59 B +ATOM 2900 H LYS B 40 16.929 44.875 16.716 1.00 0.18 B +ATOM 2901 HA LYS B 40 18.901 46.823 15.560 1.00 0.20 B +ATOM 2902 1HB LYS B 40 19.141 45.134 18.076 1.00 0.67 B +ATOM 2903 2HB LYS B 40 20.438 46.104 17.378 1.00 0.69 B +ATOM 2904 1HG LYS B 40 18.987 48.128 17.601 1.00 1.52 B +ATOM 2905 2HG LYS B 40 17.785 47.133 18.422 1.00 1.58 B +ATOM 2906 1HD LYS B 40 19.504 46.532 20.129 1.00 1.83 B +ATOM 2907 2HD LYS B 40 20.629 47.641 19.341 1.00 1.84 B +ATOM 2908 1HE LYS B 40 19.176 49.527 19.790 1.00 2.41 B +ATOM 2909 2HE LYS B 40 17.915 48.463 20.410 1.00 2.37 B +ATOM 2910 1HZ LYS B 40 18.987 48.168 22.354 1.00 2.97 B +ATOM 2911 2HZ LYS B 40 19.686 49.668 21.965 1.00 3.02 B +ATOM 2912 3HZ LYS B 40 20.531 48.226 21.655 1.00 2.98 B +ATOM 2913 N SER B 41 19.978 44.913 14.348 1.00 0.18 B +ATOM 2914 CA SER B 41 20.427 43.884 13.407 1.00 0.17 B +ATOM 2915 C SER B 41 21.921 43.667 13.362 1.00 0.17 B +ATOM 2916 O SER B 41 22.751 44.519 13.647 1.00 0.18 B +ATOM 2917 CB SER B 41 20.094 44.362 11.988 1.00 0.17 B +ATOM 2918 OG SER B 41 18.688 44.467 11.857 1.00 0.18 B +ATOM 2919 H SER B 41 20.284 45.810 14.217 1.00 0.19 B +ATOM 2920 HA SER B 41 19.916 42.958 13.597 1.00 0.15 B +ATOM 2921 1HB SER B 41 20.540 45.330 11.819 1.00 0.19 B +ATOM 2922 2HB SER B 41 20.484 43.660 11.259 1.00 0.17 B +ATOM 2923 HG SER B 41 18.502 44.964 11.060 1.00 0.18 B +ATOM 2924 N ALA B 42 22.222 42.489 12.936 1.00 0.15 B +ATOM 2925 CA ALA B 42 23.597 42.052 12.740 1.00 0.15 B +ATOM 2926 C ALA B 42 23.679 40.991 11.637 1.00 0.14 B +ATOM 2927 O ALA B 42 22.814 40.139 11.500 1.00 0.13 B +ATOM 2928 CB ALA B 42 24.053 41.339 14.020 1.00 0.14 B +ATOM 2929 H ALA B 42 21.498 41.864 12.755 1.00 0.14 B +ATOM 2930 HA ALA B 42 24.238 42.899 12.529 1.00 0.16 B +ATOM 2931 1HB ALA B 42 24.141 42.052 14.823 1.00 0.15 B +ATOM 2932 2HB ALA B 42 25.008 40.861 13.852 1.00 0.14 B +ATOM 2933 3HB ALA B 42 23.321 40.588 14.282 1.00 0.13 B +ATOM 2934 N SER B 43 24.771 40.991 10.939 1.00 0.15 B +ATOM 2935 CA SER B 43 25.050 39.940 9.955 1.00 0.14 B +ATOM 2936 C SER B 43 25.211 38.629 10.753 1.00 0.13 B +ATOM 2937 O SER B 43 25.920 38.593 11.751 1.00 0.13 B +ATOM 2938 CB SER B 43 26.403 40.224 9.315 1.00 0.16 B +ATOM 2939 OG SER B 43 26.877 39.045 8.672 1.00 0.15 B +ATOM 2940 H SER B 43 25.449 41.666 11.115 1.00 0.16 B +ATOM 2941 HA SER B 43 24.277 39.898 9.202 1.00 0.14 B +ATOM 2942 1HB SER B 43 26.304 41.013 8.589 1.00 0.17 B +ATOM 2943 2HB SER B 43 27.100 40.531 10.084 1.00 0.16 B +ATOM 2944 HG SER B 43 26.391 38.935 7.853 1.00 0.15 B +ATOM 2945 N ALA B 44 24.595 37.562 10.350 1.00 0.12 B +ATOM 2946 CA ALA B 44 24.773 36.299 11.103 1.00 0.11 B +ATOM 2947 C ALA B 44 26.170 35.700 10.847 1.00 0.12 B +ATOM 2948 O ALA B 44 26.537 34.703 11.448 1.00 0.11 B +ATOM 2949 CB ALA B 44 23.723 35.328 10.588 1.00 0.10 B +ATOM 2950 H ALA B 44 24.020 37.586 9.554 1.00 0.12 B +ATOM 2951 HA ALA B 44 24.637 36.471 12.162 1.00 0.11 B +ATOM 2952 1HB ALA B 44 22.740 35.731 10.749 1.00 0.10 B +ATOM 2953 2HB ALA B 44 23.821 34.386 11.095 1.00 0.10 B +ATOM 2954 3HB ALA B 44 23.872 35.179 9.530 1.00 0.11 B +ATOM 2955 N LYS B 45 26.947 36.276 9.944 1.00 0.13 B +ATOM 2956 CA LYS B 45 28.289 35.699 9.638 1.00 0.14 B +ATOM 2957 C LYS B 45 29.348 36.460 10.412 1.00 0.15 B +ATOM 2958 O LYS B 45 30.533 36.318 10.149 1.00 0.16 B +ATOM 2959 CB LYS B 45 28.626 35.752 8.123 1.00 0.15 B +ATOM 2960 CG LYS B 45 27.594 34.951 7.278 1.00 0.15 B +ATOM 2961 CD LYS B 45 27.916 35.034 5.764 1.00 0.16 B +ATOM 2962 CE LYS B 45 26.702 34.545 4.945 1.00 0.16 B +ATOM 2963 NZ LYS B 45 27.107 34.401 3.509 1.00 0.17 B +ATOM 2964 H LYS B 45 26.638 37.073 9.475 1.00 0.13 B +ATOM 2965 HA LYS B 45 28.308 34.677 9.959 1.00 0.13 B +ATOM 2966 1HB LYS B 45 28.632 36.781 7.797 1.00 0.16 B +ATOM 2967 2HB LYS B 45 29.607 35.332 7.975 1.00 0.16 B +ATOM 2968 1HG LYS B 45 27.618 33.914 7.579 1.00 0.14 B +ATOM 2969 2HG LYS B 45 26.607 35.349 7.448 1.00 0.14 B +ATOM 2970 1HD LYS B 45 28.142 36.056 5.494 1.00 0.17 B +ATOM 2971 2HD LYS B 45 28.768 34.408 5.537 1.00 0.16 B +ATOM 2972 1HE LYS B 45 26.365 33.589 5.325 1.00 0.15 B +ATOM 2973 2HE LYS B 45 25.896 35.263 5.023 1.00 0.15 B +ATOM 2974 1HZ LYS B 45 26.442 34.923 2.901 1.00 0.17 B +ATOM 2975 2HZ LYS B 45 27.102 33.395 3.243 1.00 0.17 B +ATOM 2976 3HZ LYS B 45 28.063 34.787 3.381 1.00 0.18 B +ATOM 2977 N SER B 46 28.943 37.269 11.371 1.00 0.14 B +ATOM 2978 CA SER B 46 29.939 38.041 12.147 1.00 0.15 B +ATOM 2979 C SER B 46 29.634 37.961 13.638 1.00 0.15 B +ATOM 2980 O SER B 46 28.722 38.575 14.166 1.00 0.14 B +ATOM 2981 CB SER B 46 29.932 39.490 11.614 1.00 0.16 B +ATOM 2982 OG SER B 46 30.070 40.404 12.694 1.00 0.17 B +ATOM 2983 H SER B 46 27.986 37.362 11.573 1.00 0.14 B +ATOM 2984 HA SER B 46 30.920 37.609 12.011 1.00 0.16 B +ATOM 2985 1HB SER B 46 30.751 39.630 10.925 1.00 0.17 B +ATOM 2986 2HB SER B 46 29.001 39.672 11.095 1.00 0.16 B +ATOM 2987 HG SER B 46 30.862 40.174 13.180 1.00 0.17 B +ATOM 2988 N LEU B 47 30.443 37.183 14.303 1.00 0.15 B +ATOM 2989 CA LEU B 47 30.320 36.994 15.776 1.00 0.15 B +ATOM 2990 C LEU B 47 30.421 38.366 16.477 1.00 0.16 B +ATOM 2991 O LEU B 47 29.739 38.611 17.446 1.00 0.15 B +ATOM 2992 CB LEU B 47 31.462 36.039 16.219 1.00 0.15 B +ATOM 2993 CG LEU B 47 31.346 35.730 17.720 1.00 0.16 B +ATOM 2994 CD1 LEU B 47 30.166 34.780 17.986 1.00 0.19 B +ATOM 2995 CD2 LEU B 47 32.647 35.074 18.193 1.00 0.19 B +ATOM 2996 H LEU B 47 31.159 36.716 13.817 1.00 0.15 B +ATOM 2997 HA LEU B 47 29.361 36.555 16.019 1.00 0.14 B +ATOM 2998 1HB LEU B 47 31.402 35.122 15.653 1.00 0.15 B +ATOM 2999 2HB LEU B 47 32.414 36.512 16.027 1.00 0.17 B +ATOM 3000 HG LEU B 47 31.192 36.649 18.265 1.00 0.19 B +ATOM 3001 1HD1 LEU B 47 30.129 34.019 17.221 1.00 1.01 B +ATOM 3002 2HD1 LEU B 47 29.244 35.339 17.981 1.00 1.06 B +ATOM 3003 3HD1 LEU B 47 30.290 34.310 18.951 1.00 1.00 B +ATOM 3004 1HD2 LEU B 47 32.559 34.809 19.236 1.00 1.00 B +ATOM 3005 2HD2 LEU B 47 33.466 35.766 18.065 1.00 1.08 B +ATOM 3006 3HD2 LEU B 47 32.833 34.185 17.609 1.00 1.02 B +ATOM 3007 N PHE B 48 31.258 39.264 16.009 1.00 0.17 B +ATOM 3008 CA PHE B 48 31.365 40.600 16.695 1.00 0.18 B +ATOM 3009 C PHE B 48 30.035 41.391 16.690 1.00 0.17 B +ATOM 3010 O PHE B 48 29.617 41.868 17.727 1.00 0.18 B +ATOM 3011 CB PHE B 48 32.477 41.474 16.091 1.00 0.19 B +ATOM 3012 CG PHE B 48 32.601 42.748 16.892 1.00 0.22 B +ATOM 3013 CD1 PHE B 48 31.889 43.896 16.499 1.00 0.28 B +ATOM 3014 CD2 PHE B 48 33.424 42.786 18.034 1.00 0.28 B +ATOM 3015 CE1 PHE B 48 31.999 45.084 17.247 1.00 0.33 B +ATOM 3016 CE2 PHE B 48 33.536 43.975 18.781 1.00 0.34 B +ATOM 3017 CZ PHE B 48 32.823 45.123 18.388 1.00 0.34 B +ATOM 3018 H PHE B 48 31.816 39.061 15.232 1.00 0.17 B +ATOM 3019 HA PHE B 48 31.605 40.418 17.724 1.00 0.18 B +ATOM 3020 1HB PHE B 48 33.412 40.935 16.122 1.00 0.21 B +ATOM 3021 2HB PHE B 48 32.232 41.714 15.067 1.00 0.20 B +ATOM 3022 HD1 PHE B 48 31.260 43.865 15.624 1.00 0.34 B +ATOM 3023 HD2 PHE B 48 33.971 41.905 18.335 1.00 0.33 B +ATOM 3024 HE1 PHE B 48 31.453 45.965 16.945 1.00 0.41 B +ATOM 3025 HE2 PHE B 48 34.170 44.006 19.655 1.00 0.43 B +ATOM 3026 HZ PHE B 48 32.906 46.033 18.963 1.00 0.40 B +ATOM 3027 N LYS B 49 29.362 41.569 15.577 1.00 0.17 B +ATOM 3028 CA LYS B 49 28.107 42.347 15.610 1.00 0.17 B +ATOM 3029 C LYS B 49 27.033 41.586 16.342 1.00 0.16 B +ATOM 3030 O LYS B 49 26.141 42.152 16.942 1.00 0.16 B +ATOM 3031 CB LYS B 49 27.634 42.521 14.170 1.00 0.17 B +ATOM 3032 CG LYS B 49 28.723 43.192 13.319 1.00 0.19 B +ATOM 3033 CD LYS B 49 28.863 44.672 13.696 1.00 0.24 B +ATOM 3034 CE LYS B 49 29.721 45.383 12.648 1.00 0.36 B +ATOM 3035 NZ LYS B 49 30.166 46.702 13.181 1.00 1.13 B +ATOM 3036 H LYS B 49 29.673 41.203 14.721 1.00 0.17 B +ATOM 3037 HA LYS B 49 28.273 43.310 16.073 1.00 0.18 B +ATOM 3038 1HB LYS B 49 27.403 41.552 13.753 1.00 0.17 B +ATOM 3039 2HB LYS B 49 26.745 43.134 14.159 1.00 0.18 B +ATOM 3040 1HG LYS B 49 29.665 42.691 13.481 1.00 0.23 B +ATOM 3041 2HG LYS B 49 28.455 43.116 12.275 1.00 0.20 B +ATOM 3042 1HD LYS B 49 27.886 45.130 13.733 1.00 0.34 B +ATOM 3043 2HD LYS B 49 29.338 44.760 14.659 1.00 0.43 B +ATOM 3044 1HE LYS B 49 30.586 44.779 12.418 1.00 1.02 B +ATOM 3045 2HE LYS B 49 29.140 45.535 11.750 1.00 1.11 B +ATOM 3046 1HZ LYS B 49 30.080 47.424 12.438 1.00 1.71 B +ATOM 3047 2HZ LYS B 49 31.158 46.635 13.487 1.00 1.68 B +ATOM 3048 3HZ LYS B 49 29.570 46.968 13.990 1.00 1.70 B +ATOM 3049 N LEU B 50 27.084 40.306 16.251 1.00 0.15 B +ATOM 3050 CA LEU B 50 26.017 39.486 16.901 1.00 0.13 B +ATOM 3051 C LEU B 50 26.100 39.663 18.424 1.00 0.14 B +ATOM 3052 O LEU B 50 25.097 39.606 19.120 1.00 0.14 B +ATOM 3053 CB LEU B 50 26.315 38.035 16.494 1.00 0.12 B +ATOM 3054 CG LEU B 50 25.427 37.293 15.487 1.00 0.11 B +ATOM 3055 CD1 LEU B 50 25.854 35.800 15.606 1.00 0.11 B +ATOM 3056 CD2 LEU B 50 23.942 37.427 15.814 1.00 0.11 B +ATOM 3057 H LEU B 50 27.812 39.871 15.732 1.00 0.15 B +ATOM 3058 HA LEU B 50 25.044 39.802 16.590 1.00 0.13 B +ATOM 3059 1HB LEU B 50 27.300 38.028 16.064 1.00 0.13 B +ATOM 3060 2HB LEU B 50 26.352 37.446 17.399 1.00 0.12 B +ATOM 3061 HG LEU B 50 25.626 37.641 14.482 1.00 0.12 B +ATOM 3062 1HD1 LEU B 50 25.430 35.377 16.510 1.00 0.11 B +ATOM 3063 2HD1 LEU B 50 26.938 35.735 15.669 1.00 0.12 B +ATOM 3064 3HD1 LEU B 50 25.517 35.241 14.753 1.00 0.10 B +ATOM 3065 1HD2 LEU B 50 23.599 38.414 15.553 1.00 0.11 B +ATOM 3066 2HD2 LEU B 50 23.795 37.256 16.859 1.00 0.11 B +ATOM 3067 3HD2 LEU B 50 23.382 36.695 15.250 1.00 0.10 B +ATOM 3068 N GLN B 51 27.283 39.866 18.934 1.00 0.15 B +ATOM 3069 CA GLN B 51 27.460 40.018 20.397 1.00 0.16 B +ATOM 3070 C GLN B 51 26.825 41.312 20.859 1.00 0.17 B +ATOM 3071 O GLN B 51 26.716 41.550 22.039 1.00 0.17 B +ATOM 3072 CB GLN B 51 28.951 40.092 20.735 1.00 0.17 B +ATOM 3073 CG GLN B 51 29.567 38.696 20.612 1.00 0.17 B +ATOM 3074 CD GLN B 51 31.091 38.798 20.693 1.00 0.42 B +ATOM 3075 OE1 GLN B 51 31.656 39.841 20.431 1.00 0.78 B +ATOM 3076 NE2 GLN B 51 31.786 37.752 21.047 1.00 0.37 B +ATOM 3077 H GLN B 51 28.063 39.914 18.345 1.00 0.15 B +ATOM 3078 HA GLN B 51 27.022 39.168 20.908 1.00 0.15 B +ATOM 3079 1HB GLN B 51 29.444 40.767 20.052 1.00 0.18 B +ATOM 3080 2HB GLN B 51 29.079 40.444 21.745 1.00 0.18 B +ATOM 3081 1HG GLN B 51 29.207 38.076 21.421 1.00 0.30 B +ATOM 3082 2HG GLN B 51 29.284 38.256 19.673 1.00 0.32 B +ATOM 3083 1HE2 GLN B 51 31.330 36.910 21.259 1.00 0.27 B +ATOM 3084 2HE2 GLN B 51 32.762 37.807 21.102 1.00 0.59 B +ATOM 3085 N THR B 52 26.431 42.181 19.956 1.00 0.17 B +ATOM 3086 CA THR B 52 25.851 43.475 20.422 1.00 0.18 B +ATOM 3087 C THR B 52 24.324 43.373 20.553 1.00 0.18 B +ATOM 3088 O THR B 52 23.665 44.294 20.994 1.00 0.19 B +ATOM 3089 CB THR B 52 26.277 44.658 19.505 1.00 0.19 B +ATOM 3090 OG1 THR B 52 26.271 44.234 18.149 1.00 0.21 B +ATOM 3091 CG2 THR B 52 27.681 45.137 19.901 1.00 0.22 B +ATOM 3092 H THR B 52 26.528 41.983 18.999 1.00 0.16 B +ATOM 3093 HA THR B 52 26.222 43.664 21.414 1.00 0.19 B +ATOM 3094 HB THR B 52 25.578 45.472 19.626 1.00 0.21 B +ATOM 3095 HG1 THR B 52 25.467 43.731 18.000 1.00 0.95 B +ATOM 3096 1HG2 THR B 52 27.957 45.986 19.294 1.00 0.98 B +ATOM 3097 2HG2 THR B 52 28.390 44.338 19.749 1.00 1.00 B +ATOM 3098 3HG2 THR B 52 27.683 45.426 20.948 1.00 0.99 B +ATOM 3099 N LEU B 53 23.763 42.258 20.181 1.00 0.16 B +ATOM 3100 CA LEU B 53 22.307 42.054 20.274 1.00 0.16 B +ATOM 3101 C LEU B 53 21.956 41.348 21.593 1.00 0.16 B +ATOM 3102 O LEU B 53 22.761 40.643 22.169 1.00 0.16 B +ATOM 3103 CB LEU B 53 21.904 41.110 19.103 1.00 0.14 B +ATOM 3104 CG LEU B 53 21.829 41.905 17.787 1.00 0.14 B +ATOM 3105 CD1 LEU B 53 21.892 40.932 16.605 1.00 0.16 B +ATOM 3106 CD2 LEU B 53 20.506 42.709 17.705 1.00 0.13 B +ATOM 3107 H LEU B 53 24.311 41.542 19.811 1.00 0.15 B +ATOM 3108 HA LEU B 53 21.792 42.986 20.232 1.00 0.17 B +ATOM 3109 1HB LEU B 53 22.641 40.325 19.010 1.00 0.14 B +ATOM 3110 2HB LEU B 53 20.938 40.671 19.309 1.00 0.14 B +ATOM 3111 HG LEU B 53 22.670 42.583 17.734 1.00 0.14 B +ATOM 3112 1HD1 LEU B 53 21.699 41.469 15.689 1.00 0.16 B +ATOM 3113 2HD1 LEU B 53 21.146 40.162 16.734 1.00 0.16 B +ATOM 3114 3HD1 LEU B 53 22.866 40.482 16.563 1.00 0.17 B +ATOM 3115 1HD2 LEU B 53 20.148 42.944 18.695 1.00 0.13 B +ATOM 3116 2HD2 LEU B 53 19.752 42.132 17.189 1.00 0.12 B +ATOM 3117 3HD2 LEU B 53 20.680 43.628 17.163 1.00 0.13 B +ATOM 3118 N GLY B 54 20.735 41.502 22.042 1.00 0.16 B +ATOM 3119 CA GLY B 54 20.301 40.802 23.293 1.00 0.16 B +ATOM 3120 C GLY B 54 19.838 39.433 22.830 1.00 0.15 B +ATOM 3121 O GLY B 54 18.810 39.324 22.193 1.00 0.15 B +ATOM 3122 H GLY B 54 20.098 42.049 21.529 1.00 0.16 B +ATOM 3123 1HA GLY B 54 21.129 40.711 23.986 1.00 0.17 B +ATOM 3124 2HA GLY B 54 19.483 41.330 23.766 1.00 0.17 B +ATOM 3125 N LEU B 55 20.599 38.388 23.081 1.00 0.15 B +ATOM 3126 CA LEU B 55 20.181 37.064 22.604 1.00 0.14 B +ATOM 3127 C LEU B 55 20.097 36.177 23.838 1.00 0.14 B +ATOM 3128 O LEU B 55 20.627 35.078 23.864 1.00 0.14 B +ATOM 3129 CB LEU B 55 21.193 36.547 21.573 1.00 0.13 B +ATOM 3130 CG LEU B 55 21.364 37.399 20.300 1.00 0.12 B +ATOM 3131 CD1 LEU B 55 22.437 36.731 19.407 1.00 0.11 B +ATOM 3132 CD2 LEU B 55 20.054 37.481 19.508 1.00 0.11 B +ATOM 3133 H LEU B 55 21.451 38.491 23.562 1.00 0.15 B +ATOM 3134 HA LEU B 55 19.198 37.103 22.168 1.00 0.13 B +ATOM 3135 1HB LEU B 55 22.149 36.490 22.056 1.00 0.13 B +ATOM 3136 2HB LEU B 55 20.893 35.554 21.280 1.00 0.12 B +ATOM 3137 HG LEU B 55 21.695 38.391 20.563 1.00 0.13 B +ATOM 3138 1HD1 LEU B 55 21.975 36.019 18.732 1.00 0.10 B +ATOM 3139 2HD1 LEU B 55 23.166 36.212 20.018 1.00 0.12 B +ATOM 3140 3HD1 LEU B 55 22.936 37.490 18.839 1.00 0.11 B +ATOM 3141 1HD2 LEU B 55 19.342 38.082 20.048 1.00 0.12 B +ATOM 3142 2HD2 LEU B 55 19.658 36.487 19.363 1.00 0.11 B +ATOM 3143 3HD2 LEU B 55 20.249 37.932 18.542 1.00 0.11 B +ATOM 3144 N THR B 56 19.430 36.677 24.879 1.00 0.16 B +ATOM 3145 CA THR B 56 19.284 35.890 26.115 1.00 0.17 B +ATOM 3146 C THR B 56 18.105 34.917 25.963 1.00 0.17 B +ATOM 3147 O THR B 56 17.350 34.989 25.014 1.00 0.16 B +ATOM 3148 CB THR B 56 19.016 36.835 27.301 1.00 0.18 B +ATOM 3149 OG1 THR B 56 17.682 37.317 27.226 1.00 0.20 B +ATOM 3150 CG2 THR B 56 19.988 38.014 27.252 1.00 0.21 B +ATOM 3151 H THR B 56 19.038 37.580 24.832 1.00 0.16 B +ATOM 3152 HA THR B 56 20.189 35.340 26.286 1.00 0.17 B +ATOM 3153 HB THR B 56 19.154 36.299 28.227 1.00 0.22 B +ATOM 3154 HG1 THR B 56 17.179 36.910 27.935 1.00 0.96 B +ATOM 3155 1HG2 THR B 56 19.864 38.547 26.321 1.00 0.99 B +ATOM 3156 2HG2 THR B 56 21.002 37.650 27.326 1.00 1.04 B +ATOM 3157 3HG2 THR B 56 19.783 38.680 28.076 1.00 1.05 B +ATOM 3158 N GLN B 57 17.939 34.013 26.893 1.00 0.18 B +ATOM 3159 CA GLN B 57 16.813 33.048 26.806 1.00 0.18 B +ATOM 3160 C GLN B 57 15.484 33.780 26.738 1.00 0.18 B +ATOM 3161 O GLN B 57 15.256 34.733 27.464 1.00 0.19 B +ATOM 3162 CB GLN B 57 16.823 32.168 28.075 1.00 0.20 B +ATOM 3163 CG GLN B 57 15.698 31.138 27.979 1.00 0.20 B +ATOM 3164 CD GLN B 57 15.840 30.191 29.157 1.00 0.22 B +ATOM 3165 OE1 GLN B 57 15.520 29.016 29.068 1.00 0.22 B +ATOM 3166 NE2 GLN B 57 16.331 30.681 30.266 1.00 0.23 B +ATOM 3167 H GLN B 57 18.557 33.977 27.654 1.00 0.18 B +ATOM 3168 HA GLN B 57 16.921 32.434 25.931 1.00 0.17 B +ATOM 3169 1HB GLN B 57 17.772 31.665 28.165 1.00 0.20 B +ATOM 3170 2HB GLN B 57 16.667 32.788 28.947 1.00 0.20 B +ATOM 3171 1HG GLN B 57 14.739 31.641 28.028 1.00 0.20 B +ATOM 3172 2HG GLN B 57 15.774 30.589 27.052 1.00 0.19 B +ATOM 3173 1HE2 GLN B 57 16.586 31.629 30.302 1.00 0.22 B +ATOM 3174 2HE2 GLN B 57 16.448 30.114 31.054 1.00 0.24 B +ATOM 3175 N GLY B 58 14.574 33.321 25.895 1.00 0.18 B +ATOM 3176 CA GLY B 58 13.252 33.967 25.835 1.00 0.18 B +ATOM 3177 C GLY B 58 13.184 35.068 24.781 1.00 0.17 B +ATOM 3178 O GLY B 58 12.147 35.684 24.565 1.00 0.18 B +ATOM 3179 H GLY B 58 14.761 32.536 25.333 1.00 0.17 B +ATOM 3180 1HA GLY B 58 12.520 33.215 25.604 1.00 0.19 B +ATOM 3181 2HA GLY B 58 13.043 34.393 26.800 1.00 0.19 B +ATOM 3182 N THR B 59 14.272 35.333 24.139 1.00 0.16 B +ATOM 3183 CA THR B 59 14.298 36.393 23.106 1.00 0.15 B +ATOM 3184 C THR B 59 13.828 35.854 21.745 1.00 0.14 B +ATOM 3185 O THR B 59 14.310 34.838 21.292 1.00 0.14 B +ATOM 3186 CB THR B 59 15.761 36.889 22.938 1.00 0.15 B +ATOM 3187 OG1 THR B 59 16.191 37.523 24.139 1.00 0.16 B +ATOM 3188 CG2 THR B 59 15.819 37.896 21.778 1.00 0.14 B +ATOM 3189 H THR B 59 15.088 34.836 24.344 1.00 0.16 B +ATOM 3190 HA THR B 59 13.666 37.214 23.418 1.00 0.16 B +ATOM 3191 HB THR B 59 16.407 36.050 22.723 1.00 0.14 B +ATOM 3192 HG1 THR B 59 15.547 37.332 24.824 1.00 0.17 B +ATOM 3193 1HG2 THR B 59 14.942 38.529 21.805 1.00 0.15 B +ATOM 3194 2HG2 THR B 59 15.848 37.365 20.838 1.00 0.13 B +ATOM 3195 3HG2 THR B 59 16.699 38.505 21.872 1.00 0.14 B +ATOM 3196 N VAL B 60 12.938 36.561 21.059 1.00 0.15 B +ATOM 3197 CA VAL B 60 12.492 36.133 19.716 1.00 0.14 B +ATOM 3198 C VAL B 60 13.360 36.857 18.711 1.00 0.13 B +ATOM 3199 O VAL B 60 13.391 38.083 18.703 1.00 0.13 B +ATOM 3200 CB VAL B 60 11.020 36.566 19.486 1.00 0.15 B +ATOM 3201 CG1 VAL B 60 10.555 36.204 18.066 1.00 0.14 B +ATOM 3202 CG2 VAL B 60 10.107 35.952 20.545 1.00 0.16 B +ATOM 3203 H VAL B 60 12.589 37.396 21.421 1.00 0.15 B +ATOM 3204 HA VAL B 60 12.594 35.079 19.606 1.00 0.13 B +ATOM 3205 HB VAL B 60 10.965 37.640 19.589 1.00 0.15 B +ATOM 3206 1HG1 VAL B 60 9.598 36.669 17.866 1.00 0.15 B +ATOM 3207 2HG1 VAL B 60 10.466 35.134 17.961 1.00 0.14 B +ATOM 3208 3HG1 VAL B 60 11.280 36.572 17.363 1.00 0.14 B +ATOM 3209 1HG2 VAL B 60 9.097 36.309 20.395 1.00 0.17 B +ATOM 3210 2HG2 VAL B 60 10.450 36.260 21.524 1.00 0.16 B +ATOM 3211 3HG2 VAL B 60 10.128 34.879 20.476 1.00 0.16 B +ATOM 3212 N VAL B 61 14.059 36.157 17.835 1.00 0.12 B +ATOM 3213 CA VAL B 61 14.864 36.932 16.833 1.00 0.11 B +ATOM 3214 C VAL B 61 14.293 36.732 15.446 1.00 0.11 B +ATOM 3215 O VAL B 61 13.603 35.745 15.209 1.00 0.11 B +ATOM 3216 CB VAL B 61 16.312 36.441 16.765 1.00 0.10 B +ATOM 3217 CG1 VAL B 61 17.074 36.774 18.062 1.00 0.11 B +ATOM 3218 CG2 VAL B 61 16.281 34.931 16.524 1.00 0.10 B +ATOM 3219 H VAL B 61 14.043 35.166 17.832 1.00 0.11 B +ATOM 3220 HA VAL B 61 14.853 37.977 17.090 1.00 0.12 B +ATOM 3221 HB VAL B 61 16.808 36.920 15.929 1.00 0.10 B +ATOM 3222 1HG1 VAL B 61 16.567 37.565 18.594 1.00 0.12 B +ATOM 3223 2HG1 VAL B 61 18.074 37.101 17.813 1.00 0.10 B +ATOM 3224 3HG1 VAL B 61 17.131 35.900 18.694 1.00 0.11 B +ATOM 3225 1HG2 VAL B 61 15.815 34.724 15.572 1.00 0.09 B +ATOM 3226 2HG2 VAL B 61 15.714 34.457 17.310 1.00 0.10 B +ATOM 3227 3HG2 VAL B 61 17.286 34.549 16.520 1.00 0.09 B +ATOM 3228 N THR B 62 14.625 37.620 14.502 1.00 0.11 B +ATOM 3229 CA THR B 62 14.149 37.382 13.113 1.00 0.11 B +ATOM 3230 C THR B 62 15.386 37.021 12.291 1.00 0.11 B +ATOM 3231 O THR B 62 16.382 37.717 12.330 1.00 0.11 B +ATOM 3232 CB THR B 62 13.423 38.601 12.484 1.00 0.13 B +ATOM 3233 OG1 THR B 62 12.316 38.915 13.324 1.00 0.14 B +ATOM 3234 CG2 THR B 62 12.914 38.197 11.088 1.00 0.13 B +ATOM 3235 H THR B 62 15.210 38.388 14.715 1.00 0.11 B +ATOM 3236 HA THR B 62 13.462 36.550 13.125 1.00 0.11 B +ATOM 3237 HB THR B 62 14.081 39.443 12.409 1.00 0.13 B +ATOM 3238 HG1 THR B 62 11.542 38.456 12.985 1.00 0.14 B +ATOM 3239 1HG2 THR B 62 12.218 38.936 10.722 1.00 0.14 B +ATOM 3240 2HG2 THR B 62 12.415 37.239 11.154 1.00 0.13 B +ATOM 3241 3HG2 THR B 62 13.748 38.116 10.405 1.00 0.13 B +ATOM 3242 N ILE B 63 15.323 35.952 11.540 1.00 0.10 B +ATOM 3243 CA ILE B 63 16.459 35.529 10.672 1.00 0.10 B +ATOM 3244 C ILE B 63 15.924 35.795 9.251 1.00 0.11 B +ATOM 3245 O ILE B 63 14.906 35.258 8.877 1.00 0.11 B +ATOM 3246 CB ILE B 63 16.865 34.022 10.831 1.00 0.09 B +ATOM 3247 CG1 ILE B 63 17.198 33.728 12.319 1.00 0.09 B +ATOM 3248 CG2 ILE B 63 18.059 33.733 9.891 1.00 0.09 B +ATOM 3249 CD1 ILE B 63 17.608 32.259 12.559 1.00 0.09 B +ATOM 3250 H ILE B 63 14.499 35.439 11.517 1.00 0.10 B +ATOM 3251 HA ILE B 63 17.318 36.148 10.885 1.00 0.10 B +ATOM 3252 HB ILE B 63 16.038 33.399 10.520 1.00 0.10 B +ATOM 3253 1HG1 ILE B 63 18.000 34.371 12.640 1.00 0.08 B +ATOM 3254 2HG1 ILE B 63 16.318 33.939 12.910 1.00 0.09 B +ATOM 3255 1HG2 ILE B 63 17.686 33.573 8.887 1.00 0.10 B +ATOM 3256 2HG2 ILE B 63 18.586 32.852 10.216 1.00 0.09 B +ATOM 3257 3HG2 ILE B 63 18.735 34.577 9.882 1.00 0.09 B +ATOM 3258 1HD1 ILE B 63 16.886 31.597 12.116 1.00 0.09 B +ATOM 3259 2HD1 ILE B 63 17.650 32.071 13.626 1.00 0.09 B +ATOM 3260 3HD1 ILE B 63 18.579 32.075 12.129 1.00 0.09 B +ATOM 3261 N SER B 64 16.588 36.634 8.493 1.00 0.12 B +ATOM 3262 CA SER B 64 16.183 36.994 7.099 1.00 0.13 B +ATOM 3263 C SER B 64 17.357 36.727 6.197 1.00 0.13 B +ATOM 3264 O SER B 64 18.506 36.929 6.580 1.00 0.13 B +ATOM 3265 CB SER B 64 15.827 38.499 6.933 1.00 0.14 B +ATOM 3266 OG SER B 64 15.323 39.025 8.147 1.00 0.14 B +ATOM 3267 H SER B 64 17.389 37.034 8.856 1.00 0.11 B +ATOM 3268 HA SER B 64 15.360 36.392 6.798 1.00 0.13 B +ATOM 3269 1HB SER B 64 16.707 39.061 6.657 1.00 0.15 B +ATOM 3270 2HB SER B 64 15.096 38.613 6.147 1.00 0.15 B +ATOM 3271 HG SER B 64 16.074 39.219 8.713 1.00 0.14 B +ATOM 3272 N ALA B 65 17.104 36.323 4.990 1.00 0.14 B +ATOM 3273 CA ALA B 65 18.265 36.095 4.081 1.00 0.15 B +ATOM 3274 C ALA B 65 17.898 36.569 2.710 1.00 0.16 B +ATOM 3275 O ALA B 65 16.735 36.574 2.324 1.00 0.17 B +ATOM 3276 CB ALA B 65 18.665 34.633 3.955 1.00 0.14 B +ATOM 3277 H ALA B 65 16.170 36.199 4.685 1.00 0.14 B +ATOM 3278 HA ALA B 65 19.114 36.647 4.452 1.00 0.15 B +ATOM 3279 1HB ALA B 65 17.798 34.040 3.710 1.00 0.14 B +ATOM 3280 2HB ALA B 65 19.085 34.293 4.888 1.00 0.13 B +ATOM 3281 3HB ALA B 65 19.405 34.530 3.171 1.00 0.15 B +ATOM 3282 N GLU B 66 18.891 36.937 1.961 1.00 0.17 B +ATOM 3283 CA GLU B 66 18.615 37.396 0.571 1.00 0.19 B +ATOM 3284 C GLU B 66 19.730 36.869 -0.297 1.00 0.20 B +ATOM 3285 O GLU B 66 20.875 37.281 -0.180 1.00 0.20 B +ATOM 3286 CB GLU B 66 18.606 38.934 0.607 1.00 0.20 B +ATOM 3287 CG GLU B 66 17.597 39.684 -0.288 1.00 0.21 B +ATOM 3288 CD GLU B 66 17.462 39.109 -1.688 1.00 0.22 B +ATOM 3289 OE1 GLU B 66 18.262 39.442 -2.552 1.00 0.23 B +ATOM 3290 OE2 GLU B 66 16.512 38.377 -1.881 1.00 0.22 B +ATOM 3291 H GLU B 66 19.814 36.899 2.318 1.00 0.17 B +ATOM 3292 HA GLU B 66 17.673 37.002 0.225 1.00 0.19 B +ATOM 3293 1HB GLU B 66 18.396 39.225 1.623 1.00 0.19 B +ATOM 3294 2HB GLU B 66 19.598 39.284 0.364 1.00 0.20 B +ATOM 3295 1HG GLU B 66 16.648 39.662 0.170 1.00 0.21 B +ATOM 3296 2HG GLU B 66 17.915 40.717 -0.360 1.00 0.22 B +ATOM 3297 N GLY B 67 19.425 35.957 -1.164 1.00 0.20 B +ATOM 3298 CA GLY B 67 20.507 35.436 -2.019 1.00 0.21 B +ATOM 3299 C GLY B 67 20.029 34.156 -2.681 1.00 0.21 B +ATOM 3300 O GLY B 67 18.888 33.755 -2.568 1.00 0.21 B +ATOM 3301 H GLY B 67 18.498 35.624 -1.255 1.00 0.20 B +ATOM 3302 1HA GLY B 67 20.773 36.174 -2.768 1.00 0.22 B +ATOM 3303 2HA GLY B 67 21.377 35.218 -1.418 1.00 0.20 B +ATOM 3304 N GLU B 68 20.935 33.536 -3.350 1.00 0.22 B +ATOM 3305 CA GLU B 68 20.711 32.275 -4.068 1.00 0.23 B +ATOM 3306 C GLU B 68 20.142 31.173 -3.184 1.00 0.22 B +ATOM 3307 O GLU B 68 19.299 30.436 -3.659 1.00 0.22 B +ATOM 3308 CB GLU B 68 22.102 31.787 -4.531 1.00 0.23 B +ATOM 3309 CG GLU B 68 22.077 31.007 -5.847 1.00 0.25 B +ATOM 3310 CD GLU B 68 23.504 31.001 -6.399 1.00 0.26 B +ATOM 3311 OE1 GLU B 68 24.399 30.748 -5.606 1.00 0.25 B +ATOM 3312 OE2 GLU B 68 23.678 31.278 -7.577 1.00 0.27 B +ATOM 3313 H GLU B 68 21.825 33.926 -3.388 1.00 0.22 B +ATOM 3314 HA GLU B 68 20.069 32.447 -4.918 1.00 0.23 B +ATOM 3315 1HB GLU B 68 22.740 32.649 -4.650 1.00 0.24 B +ATOM 3316 2HB GLU B 68 22.532 31.152 -3.763 1.00 0.23 B +ATOM 3317 1HG GLU B 68 21.762 29.989 -5.660 1.00 0.25 B +ATOM 3318 2HG GLU B 68 21.414 31.477 -6.551 1.00 0.25 B +ATOM 3319 N ASP B 69 20.601 30.990 -1.932 1.00 0.20 B +ATOM 3320 CA ASP B 69 20.024 29.843 -1.157 1.00 0.20 B +ATOM 3321 C ASP B 69 19.284 30.403 0.025 1.00 0.18 B +ATOM 3322 O ASP B 69 19.334 29.849 1.109 1.00 0.17 B +ATOM 3323 CB ASP B 69 21.163 28.906 -0.694 1.00 0.20 B +ATOM 3324 CG ASP B 69 22.301 29.706 -0.020 1.00 0.19 B +ATOM 3325 OD1 ASP B 69 22.058 30.827 0.412 1.00 0.18 B +ATOM 3326 OD2 ASP B 69 23.403 29.176 0.051 1.00 0.19 B +ATOM 3327 H ASP B 69 21.304 31.578 -1.542 1.00 0.20 B +ATOM 3328 HA ASP B 69 19.337 29.285 -1.783 1.00 0.20 B +ATOM 3329 1HB ASP B 69 20.769 28.189 0.011 1.00 0.19 B +ATOM 3330 2HB ASP B 69 21.560 28.379 -1.551 1.00 0.21 B +ATOM 3331 N GLU B 70 18.630 31.531 -0.149 1.00 0.18 B +ATOM 3332 CA GLU B 70 17.973 32.150 1.040 1.00 0.17 B +ATOM 3333 C GLU B 70 16.915 31.349 1.803 1.00 0.17 B +ATOM 3334 O GLU B 70 16.749 31.565 2.995 1.00 0.15 B +ATOM 3335 CB GLU B 70 17.418 33.500 0.593 1.00 0.18 B +ATOM 3336 CG GLU B 70 16.199 33.364 -0.350 1.00 0.19 B +ATOM 3337 CD GLU B 70 15.802 34.749 -0.903 1.00 0.20 B +ATOM 3338 OE1 GLU B 70 16.693 35.470 -1.324 1.00 0.20 B +ATOM 3339 OE2 GLU B 70 14.618 35.063 -0.902 1.00 0.20 B +ATOM 3340 H GLU B 70 18.612 31.995 -1.035 1.00 0.19 B +ATOM 3341 HA GLU B 70 18.728 32.315 1.784 1.00 0.16 B +ATOM 3342 1HB GLU B 70 17.121 34.057 1.467 1.00 0.17 B +ATOM 3343 2HB GLU B 70 18.198 34.041 0.079 1.00 0.18 B +ATOM 3344 1HG GLU B 70 16.451 32.717 -1.176 1.00 0.19 B +ATOM 3345 2HG GLU B 70 15.366 32.950 0.192 1.00 0.18 B +ATOM 3346 N GLN B 71 16.179 30.492 1.206 1.00 0.17 B +ATOM 3347 CA GLN B 71 15.119 29.765 2.004 1.00 0.17 B +ATOM 3348 C GLN B 71 15.771 28.642 2.834 1.00 0.17 B +ATOM 3349 O GLN B 71 15.469 28.439 3.995 1.00 0.16 B +ATOM 3350 CB GLN B 71 13.944 29.180 1.160 1.00 0.18 B +ATOM 3351 CG GLN B 71 13.728 29.752 -0.280 1.00 0.20 B +ATOM 3352 CD GLN B 71 12.376 30.498 -0.366 1.00 0.20 B +ATOM 3353 OE1 GLN B 71 12.265 31.586 0.163 1.00 0.19 B +ATOM 3354 NE2 GLN B 71 11.427 30.084 -1.185 1.00 0.21 B +ATOM 3355 H GLN B 71 16.276 30.343 0.256 1.00 0.18 B +ATOM 3356 HA GLN B 71 14.712 30.443 2.707 1.00 0.16 B +ATOM 3357 1HB GLN B 71 14.106 28.117 1.063 1.00 0.19 B +ATOM 3358 2HB GLN B 71 13.034 29.320 1.732 1.00 0.18 B +ATOM 3359 1HG GLN B 71 14.530 30.398 -0.551 1.00 0.19 B +ATOM 3360 2HG GLN B 71 13.681 28.915 -0.964 1.00 0.20 B +ATOM 3361 1HE2 GLN B 71 11.609 29.410 -1.852 1.00 0.22 B +ATOM 3362 2HE2 GLN B 71 10.505 30.258 -0.960 1.00 0.21 B +ATOM 3363 N LYS B 72 16.656 27.934 2.225 1.00 0.17 B +ATOM 3364 CA LYS B 72 17.375 26.846 2.870 1.00 0.17 B +ATOM 3365 C LYS B 72 18.199 27.462 3.991 1.00 0.16 B +ATOM 3366 O LYS B 72 18.319 26.898 5.057 1.00 0.16 B +ATOM 3367 CB LYS B 72 18.355 26.160 1.898 1.00 0.19 B +ATOM 3368 CG LYS B 72 18.606 24.736 2.440 1.00 0.19 B +ATOM 3369 CD LYS B 72 19.641 23.986 1.580 1.00 0.21 B +ATOM 3370 CE LYS B 72 21.014 24.023 2.246 1.00 0.20 B +ATOM 3371 NZ LYS B 72 21.027 23.108 3.427 1.00 0.20 B +ATOM 3372 H LYS B 72 16.858 28.143 1.311 1.00 0.18 B +ATOM 3373 HA LYS B 72 16.661 26.114 3.230 1.00 0.18 B +ATOM 3374 1HB LYS B 72 17.919 26.109 0.909 1.00 0.19 B +ATOM 3375 2HB LYS B 72 19.292 26.701 1.854 1.00 0.18 B +ATOM 3376 1HG LYS B 72 18.951 24.805 3.465 1.00 0.18 B +ATOM 3377 2HG LYS B 72 17.671 24.191 2.427 1.00 0.20 B +ATOM 3378 1HD LYS B 72 19.335 22.958 1.465 1.00 0.22 B +ATOM 3379 2HD LYS B 72 19.708 24.449 0.608 1.00 0.21 B +ATOM 3380 1HE LYS B 72 21.772 23.716 1.543 1.00 0.21 B +ATOM 3381 2HE LYS B 72 21.208 25.016 2.554 1.00 0.19 B +ATOM 3382 1HZ LYS B 72 20.652 23.605 4.262 1.00 0.19 B +ATOM 3383 2HZ LYS B 72 22.003 22.798 3.618 1.00 0.21 B +ATOM 3384 3HZ LYS B 72 20.433 22.279 3.226 1.00 0.21 B +ATOM 3385 N ALA B 73 18.810 28.627 3.743 1.00 0.15 B +ATOM 3386 CA ALA B 73 19.652 29.223 4.810 1.00 0.14 B +ATOM 3387 C ALA B 73 18.807 29.550 6.049 1.00 0.13 B +ATOM 3388 O ALA B 73 19.191 29.239 7.159 1.00 0.13 B +ATOM 3389 CB ALA B 73 20.334 30.492 4.259 1.00 0.14 B +ATOM 3390 H ALA B 73 18.728 29.082 2.867 1.00 0.16 B +ATOM 3391 HA ALA B 73 20.407 28.510 5.103 1.00 0.14 B +ATOM 3392 1HB ALA B 73 19.603 31.281 4.157 1.00 0.14 B +ATOM 3393 2HB ALA B 73 20.769 30.278 3.294 1.00 0.15 B +ATOM 3394 3HB ALA B 73 21.108 30.805 4.939 1.00 0.14 B +ATOM 3395 N VAL B 74 17.676 30.170 5.873 1.00 0.13 B +ATOM 3396 CA VAL B 74 16.807 30.541 7.045 1.00 0.12 B +ATOM 3397 C VAL B 74 16.243 29.267 7.650 1.00 0.13 B +ATOM 3398 O VAL B 74 16.155 29.130 8.866 1.00 0.12 B +ATOM 3399 CB VAL B 74 15.705 31.532 6.593 1.00 0.12 B +ATOM 3400 CG1 VAL B 74 14.668 31.781 7.705 1.00 0.12 B +ATOM 3401 CG2 VAL B 74 16.361 32.865 6.167 1.00 0.12 B +ATOM 3402 H VAL B 74 17.393 30.403 4.970 1.00 0.14 B +ATOM 3403 HA VAL B 74 17.409 31.014 7.794 1.00 0.11 B +ATOM 3404 HB VAL B 74 15.203 31.105 5.751 1.00 0.13 B +ATOM 3405 1HG1 VAL B 74 13.953 32.520 7.367 1.00 0.12 B +ATOM 3406 2HG1 VAL B 74 15.162 32.142 8.594 1.00 0.11 B +ATOM 3407 3HG1 VAL B 74 14.150 30.859 7.928 1.00 0.12 B +ATOM 3408 1HG2 VAL B 74 15.810 33.291 5.341 1.00 0.13 B +ATOM 3409 2HG2 VAL B 74 17.383 32.689 5.858 1.00 0.12 B +ATOM 3410 3HG2 VAL B 74 16.356 33.560 6.993 1.00 0.12 B +ATOM 3411 N GLU B 75 15.871 28.332 6.806 1.00 0.14 B +ATOM 3412 CA GLU B 75 15.294 27.046 7.326 1.00 0.15 B +ATOM 3413 C GLU B 75 16.283 26.387 8.243 1.00 0.15 B +ATOM 3414 O GLU B 75 15.953 25.933 9.326 1.00 0.15 B +ATOM 3415 CB GLU B 75 14.881 26.071 6.189 1.00 0.16 B +ATOM 3416 CG GLU B 75 13.539 26.619 5.658 1.00 0.17 B +ATOM 3417 CD GLU B 75 13.027 25.980 4.367 1.00 0.18 B +ATOM 3418 OE1 GLU B 75 13.613 25.028 3.877 1.00 0.19 B +ATOM 3419 OE2 GLU B 75 12.027 26.495 3.882 1.00 0.18 B +ATOM 3420 H GLU B 75 15.953 28.493 5.842 1.00 0.14 B +ATOM 3421 HA GLU B 75 14.416 27.289 7.895 1.00 0.15 B +ATOM 3422 1HB GLU B 75 15.622 26.067 5.405 1.00 0.17 B +ATOM 3423 2HB GLU B 75 14.744 25.074 6.587 1.00 0.17 B +ATOM 3424 1HG GLU B 75 12.794 26.470 6.418 1.00 0.17 B +ATOM 3425 2HG GLU B 75 13.650 27.681 5.490 1.00 0.16 B +ATOM 3426 N HIS B 76 17.492 26.324 7.819 1.00 0.15 B +ATOM 3427 CA HIS B 76 18.525 25.686 8.637 1.00 0.15 B +ATOM 3428 C HIS B 76 18.900 26.490 9.861 1.00 0.13 B +ATOM 3429 O HIS B 76 19.221 25.910 10.884 1.00 0.14 B +ATOM 3430 CB HIS B 76 19.771 25.441 7.750 1.00 0.15 B +ATOM 3431 CG HIS B 76 19.368 24.390 6.747 1.00 0.17 B +ATOM 3432 ND1 HIS B 76 20.129 23.266 6.459 1.00 0.18 B +ATOM 3433 CD2 HIS B 76 18.234 24.270 5.991 1.00 0.17 B +ATOM 3434 CE1 HIS B 76 19.435 22.533 5.561 1.00 0.19 B +ATOM 3435 NE2 HIS B 76 18.278 23.105 5.247 1.00 0.19 B +ATOM 3436 H HIS B 76 17.721 26.684 6.936 1.00 0.15 B +ATOM 3437 HA HIS B 76 18.155 24.745 8.992 1.00 0.16 B +ATOM 3438 1HB HIS B 76 20.052 26.356 7.239 1.00 0.15 B +ATOM 3439 2HB HIS B 76 20.596 25.086 8.349 1.00 0.16 B +ATOM 3440 HD2 HIS B 76 17.424 24.966 5.986 1.00 0.17 B +ATOM 3441 HE1 HIS B 76 19.776 21.597 5.145 1.00 0.21 B +ATOM 3442 N LEU B 77 18.922 27.789 9.794 1.00 0.12 B +ATOM 3443 CA LEU B 77 19.387 28.553 10.985 1.00 0.11 B +ATOM 3444 C LEU B 77 18.312 28.674 12.023 1.00 0.11 B +ATOM 3445 O LEU B 77 18.603 28.822 13.199 1.00 0.11 B +ATOM 3446 CB LEU B 77 19.939 29.927 10.535 1.00 0.10 B +ATOM 3447 CG LEU B 77 21.229 29.750 9.700 1.00 0.11 B +ATOM 3448 CD1 LEU B 77 21.642 31.122 9.180 1.00 0.10 B +ATOM 3449 CD2 LEU B 77 22.399 29.243 10.560 1.00 0.11 B +ATOM 3450 H LEU B 77 18.682 28.265 8.967 1.00 0.12 B +ATOM 3451 HA LEU B 77 20.172 28.001 11.462 1.00 0.12 B +ATOM 3452 1HB LEU B 77 19.197 30.433 9.932 1.00 0.10 B +ATOM 3453 2HB LEU B 77 20.162 30.527 11.402 1.00 0.10 B +ATOM 3454 HG LEU B 77 21.046 29.073 8.872 1.00 0.12 B +ATOM 3455 1HD1 LEU B 77 20.829 31.564 8.630 1.00 0.10 B +ATOM 3456 2HD1 LEU B 77 22.506 31.019 8.541 1.00 0.11 B +ATOM 3457 3HD1 LEU B 77 21.893 31.751 10.023 1.00 0.10 B +ATOM 3458 1HD2 LEU B 77 23.329 29.402 10.028 1.00 0.12 B +ATOM 3459 2HD2 LEU B 77 22.291 28.193 10.768 1.00 0.12 B +ATOM 3460 3HD2 LEU B 77 22.424 29.799 11.486 1.00 0.10 B +ATOM 3461 N VAL B 78 17.091 28.596 11.620 1.00 0.11 B +ATOM 3462 CA VAL B 78 16.008 28.692 12.580 1.00 0.12 B +ATOM 3463 C VAL B 78 16.003 27.377 13.351 1.00 0.13 B +ATOM 3464 O VAL B 78 15.791 27.343 14.554 1.00 0.13 B +ATOM 3465 CB VAL B 78 14.735 28.939 11.757 1.00 0.12 B +ATOM 3466 CG1 VAL B 78 13.539 28.310 12.469 1.00 0.13 B +ATOM 3467 CG2 VAL B 78 14.463 30.445 11.623 1.00 0.11 B +ATOM 3468 H VAL B 78 16.889 28.468 10.669 1.00 0.12 B +ATOM 3469 HA VAL B 78 16.182 29.506 13.268 1.00 0.11 B +ATOM 3470 HB VAL B 78 14.849 28.499 10.774 1.00 0.12 B +ATOM 3471 1HG1 VAL B 78 12.624 28.657 12.012 1.00 0.13 B +ATOM 3472 2HG1 VAL B 78 13.556 28.604 13.509 1.00 0.13 B +ATOM 3473 3HG1 VAL B 78 13.597 27.237 12.395 1.00 0.14 B +ATOM 3474 1HG2 VAL B 78 13.447 30.586 11.307 1.00 0.12 B +ATOM 3475 2HG2 VAL B 78 15.127 30.877 10.895 1.00 0.11 B +ATOM 3476 3HG2 VAL B 78 14.602 30.929 12.580 1.00 0.11 B +ATOM 3477 N LYS B 79 16.249 26.299 12.641 1.00 0.14 B +ATOM 3478 CA LYS B 79 16.268 24.971 13.286 1.00 0.15 B +ATOM 3479 C LYS B 79 17.490 24.920 14.197 1.00 0.15 B +ATOM 3480 O LYS B 79 17.394 24.574 15.362 1.00 0.16 B +ATOM 3481 CB LYS B 79 16.265 23.894 12.222 1.00 0.17 B +ATOM 3482 CG LYS B 79 16.173 22.539 12.911 1.00 0.18 B +ATOM 3483 CD LYS B 79 15.783 21.467 11.871 1.00 0.20 B +ATOM 3484 CE LYS B 79 16.881 20.402 11.748 1.00 0.21 B +ATOM 3485 NZ LYS B 79 17.160 20.233 10.304 1.00 0.21 B +ATOM 3486 H LYS B 79 16.416 26.388 11.677 1.00 0.14 B +ATOM 3487 HA LYS B 79 15.386 24.860 13.897 1.00 0.16 B +ATOM 3488 1HB LYS B 79 15.406 24.040 11.578 1.00 0.17 B +ATOM 3489 2HB LYS B 79 17.171 23.947 11.636 1.00 0.16 B +ATOM 3490 1HG LYS B 79 17.129 22.317 13.359 1.00 0.18 B +ATOM 3491 2HG LYS B 79 15.427 22.571 13.692 1.00 0.18 B +ATOM 3492 1HD LYS B 79 14.851 21.000 12.163 1.00 0.20 B +ATOM 3493 2HD LYS B 79 15.640 21.927 10.898 1.00 0.19 B +ATOM 3494 1HE LYS B 79 17.787 20.713 12.250 1.00 0.20 B +ATOM 3495 2HE LYS B 79 16.540 19.469 12.169 1.00 0.22 B +ATOM 3496 1HZ LYS B 79 16.263 20.263 9.778 1.00 0.21 B +ATOM 3497 2HZ LYS B 79 17.632 19.326 10.143 1.00 0.22 B +ATOM 3498 3HZ LYS B 79 17.771 21.012 9.980 1.00 0.20 B +ATOM 3499 N LEU B 80 18.638 25.300 13.704 1.00 0.15 B +ATOM 3500 CA LEU B 80 19.809 25.322 14.581 1.00 0.15 B +ATOM 3501 C LEU B 80 19.541 26.193 15.829 1.00 0.14 B +ATOM 3502 O LEU B 80 19.814 25.796 16.949 1.00 0.15 B +ATOM 3503 CB LEU B 80 20.977 25.916 13.778 1.00 0.14 B +ATOM 3504 CG LEU B 80 22.248 25.864 14.593 1.00 0.14 B +ATOM 3505 CD1 LEU B 80 22.514 24.445 15.113 1.00 0.16 B +ATOM 3506 CD2 LEU B 80 23.416 26.304 13.731 1.00 0.14 B +ATOM 3507 H LEU B 80 18.721 25.579 12.765 1.00 0.14 B +ATOM 3508 HA LEU B 80 20.038 24.325 14.889 1.00 0.16 B +ATOM 3509 1HB LEU B 80 21.117 25.351 12.870 1.00 0.14 B +ATOM 3510 2HB LEU B 80 20.756 26.945 13.529 1.00 0.13 B +ATOM 3511 HG LEU B 80 22.133 26.530 15.379 1.00 0.14 B +ATOM 3512 1HD1 LEU B 80 21.872 24.240 15.947 1.00 0.16 B +ATOM 3513 2HD1 LEU B 80 23.543 24.353 15.418 1.00 0.16 B +ATOM 3514 3HD1 LEU B 80 22.312 23.736 14.331 1.00 0.17 B +ATOM 3515 1HD2 LEU B 80 23.257 27.319 13.404 1.00 0.13 B +ATOM 3516 2HD2 LEU B 80 23.485 25.652 12.877 1.00 0.15 B +ATOM 3517 3HD2 LEU B 80 24.331 26.246 14.305 1.00 0.14 B +ATOM 3518 N MET B 81 19.009 27.376 15.650 1.00 0.13 B +ATOM 3519 CA MET B 81 18.772 28.275 16.803 1.00 0.12 B +ATOM 3520 C MET B 81 17.807 27.701 17.833 1.00 0.13 B +ATOM 3521 O MET B 81 17.933 27.941 19.021 1.00 0.14 B +ATOM 3522 CB MET B 81 18.237 29.656 16.365 1.00 0.11 B +ATOM 3523 CG MET B 81 18.560 30.632 17.519 1.00 0.11 B +ATOM 3524 SD MET B 81 18.693 32.312 16.876 1.00 0.09 B +ATOM 3525 CE MET B 81 20.484 32.566 17.066 1.00 0.09 B +ATOM 3526 H MET B 81 18.775 27.669 14.752 1.00 0.12 B +ATOM 3527 HA MET B 81 19.714 28.415 17.296 1.00 0.12 B +ATOM 3528 1HB MET B 81 18.726 29.978 15.453 1.00 0.10 B +ATOM 3529 2HB MET B 81 17.167 29.616 16.212 1.00 0.11 B +ATOM 3530 1HG MET B 81 17.774 30.582 18.257 1.00 0.11 B +ATOM 3531 2HG MET B 81 19.498 30.360 17.992 1.00 0.11 B +ATOM 3532 1HE MET B 81 20.730 33.570 16.748 1.00 0.09 B +ATOM 3533 2HE MET B 81 21.026 31.859 16.457 1.00 0.09 B +ATOM 3534 3HE MET B 81 20.764 32.435 18.102 1.00 0.10 B +ATOM 3535 N ALA B 82 16.837 26.983 17.400 1.00 0.14 B +ATOM 3536 CA ALA B 82 15.837 26.413 18.361 1.00 0.15 B +ATOM 3537 C ALA B 82 16.461 25.188 19.064 1.00 0.17 B +ATOM 3538 O ALA B 82 16.140 24.892 20.199 1.00 0.18 B +ATOM 3539 CB ALA B 82 14.538 26.054 17.626 1.00 0.16 B +ATOM 3540 H ALA B 82 16.751 26.816 16.441 1.00 0.14 B +ATOM 3541 HA ALA B 82 15.612 27.152 19.117 1.00 0.15 B +ATOM 3542 1HB ALA B 82 14.159 26.931 17.119 1.00 0.15 B +ATOM 3543 2HB ALA B 82 13.804 25.712 18.341 1.00 0.17 B +ATOM 3544 3HB ALA B 82 14.731 25.276 16.906 1.00 0.16 B +ATOM 3545 N GLU B 83 17.366 24.497 18.390 1.00 0.17 B +ATOM 3546 CA GLU B 83 18.059 23.308 18.950 1.00 0.19 B +ATOM 3547 C GLU B 83 19.156 23.708 19.954 1.00 0.19 B +ATOM 3548 O GLU B 83 19.446 23.005 20.896 1.00 0.20 B +ATOM 3549 CB GLU B 83 18.873 22.627 17.841 1.00 0.19 B +ATOM 3550 CG GLU B 83 18.067 21.572 17.098 1.00 0.20 B +ATOM 3551 CD GLU B 83 18.747 21.236 15.761 1.00 0.20 B +ATOM 3552 OE1 GLU B 83 19.692 21.925 15.393 1.00 0.19 B +ATOM 3553 OE2 GLU B 83 18.303 20.297 15.124 1.00 0.21 B +ATOM 3554 H GLU B 83 17.604 24.775 17.490 1.00 0.16 B +ATOM 3555 HA GLU B 83 17.327 22.619 19.351 1.00 0.20 B +ATOM 3556 1HB GLU B 83 19.198 23.381 17.142 1.00 0.18 B +ATOM 3557 2HB GLU B 83 19.751 22.148 18.267 1.00 0.20 B +ATOM 3558 1HG GLU B 83 18.023 20.678 17.704 1.00 0.21 B +ATOM 3559 2HG GLU B 83 17.074 21.937 16.916 1.00 0.20 B +ATOM 3560 N LEU B 84 19.834 24.791 19.676 1.00 0.17 B +ATOM 3561 CA LEU B 84 20.966 25.223 20.523 1.00 0.17 B +ATOM 3562 C LEU B 84 20.582 25.387 22.015 1.00 0.18 B +ATOM 3563 O LEU B 84 19.632 26.008 22.441 1.00 0.18 B +ATOM 3564 CB LEU B 84 21.588 26.445 19.840 1.00 0.16 B +ATOM 3565 CG LEU B 84 22.725 26.110 18.848 1.00 0.16 B +ATOM 3566 CD1 LEU B 84 22.733 24.651 18.365 1.00 0.17 B +ATOM 3567 CD2 LEU B 84 22.539 27.020 17.654 1.00 0.14 B +ATOM 3568 H LEU B 84 19.614 25.315 18.875 1.00 0.16 B +ATOM 3569 HA LEU B 84 21.688 24.444 20.575 1.00 0.18 B +ATOM 3570 1HB LEU B 84 20.797 26.964 19.316 1.00 0.15 B +ATOM 3571 2HB LEU B 84 21.978 27.104 20.600 1.00 0.15 B +ATOM 3572 HG LEU B 84 23.674 26.324 19.303 1.00 0.16 B +ATOM 3573 1HD1 LEU B 84 21.737 24.355 18.077 1.00 0.17 B +ATOM 3574 2HD1 LEU B 84 23.094 24.003 19.143 1.00 0.18 B +ATOM 3575 3HD1 LEU B 84 23.398 24.570 17.535 1.00 0.17 B +ATOM 3576 1HD2 LEU B 84 21.612 26.771 17.189 1.00 0.14 B +ATOM 3577 2HD2 LEU B 84 23.349 26.884 16.964 1.00 0.14 B +ATOM 3578 3HD2 LEU B 84 22.497 28.045 17.972 1.00 0.13 B +ATOM 3579 N GLU B 85 21.427 24.691 22.731 1.00 0.19 B +ATOM 3580 CA GLU B 85 21.525 24.453 24.184 1.00 0.21 B +ATOM 3581 C GLU B 85 22.437 25.489 24.855 1.00 0.20 B +ATOM 3582 CB GLU B 85 22.141 23.025 24.360 1.00 0.22 B +ATOM 3583 CG GLU B 85 22.868 22.434 23.118 1.00 0.22 B +ATOM 3584 CD GLU B 85 24.090 23.197 22.572 1.00 0.21 B +ATOM 3585 OE1 GLU B 85 24.772 23.914 23.293 1.00 0.21 B +ATOM 3586 OE2 GLU B 85 24.340 22.985 21.394 1.00 0.21 B +ATOM 3587 H GLU B 85 22.091 24.246 22.217 1.00 0.20 B +ATOM 3588 HA GLU B 85 20.562 24.488 24.655 1.00 0.21 B +ATOM 3589 1HB GLU B 85 22.827 23.024 25.187 1.00 0.23 B +ATOM 3590 2HB GLU B 85 21.329 22.348 24.599 1.00 0.23 B +ATOM 3591 1HG GLU B 85 23.217 21.453 23.393 1.00 0.24 B +ATOM 3592 2HG GLU B 85 22.156 22.328 22.322 1.00 0.22 B +TER 3593 GLU B 385 +END diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/README.txt b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/README.txt new file mode 100644 index 000000000..a938b25be --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/README.txt @@ -0,0 +1,6 @@ +################################################################################ +# Information about configuration files present in the same directory # +################################################################################ +"run-prodigy-prot-prot/data/configurations/raw_input.toml": An untouched copy of the raw input file, as provided by the user. +"run-prodigy-prot-prot/data/configurations/cleaned_input.toml": Pre-parsed input file where (eventually) some indexing and modifications were applied to ensure further processing. +"run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.toml": Final input file with detailed default parameters. diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/cleaned_input.toml b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/cleaned_input.toml new file mode 100644 index 000000000..aebd2e0bd --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/cleaned_input.toml @@ -0,0 +1,10 @@ + +run_dir = "run-prodigy-prot-prot" +molecules = [ + "data/prot-prot.pdb", + "data/homotrimer.pdb", + ] +postprocess=false +clean=false +['topoaa.1'] +['prodigy.1'] diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.json b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.json new file mode 100644 index 000000000..a099aa7b1 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.json @@ -0,0 +1,65 @@ +{ + "cns_exec": "", + "ncores": 4, + "max_cpus": true, + "mode": "local", + "batch_type": "slurm", + "queue": "", + "queue_limit": 100, + "concat": 1, + "self_contained": false, + "clean": false, + "offline": false, + "debug": false, + "preprocess": false, + "postprocess": false, + "run_dir": "run-prodigy-prot-prot", + "molecules": [ + "data/prot-prot.pdb", + "data/homotrimer.pdb" + ], + "topoaa.1": { + "molecules": [ + "data/prot-prot.pdb", + "data/homotrimer.pdb" + ], + "mol1": { + "cyclicpept": false, + "nhisd": 0, + "hisd_1": NaN, + "nhise": 0, + "hise_1": NaN + }, + "mol2": { + "cyclicpept": false, + "nhisd": 0, + "hisd_1": NaN, + "nhise": 0, + "hise_1": NaN + }, + "autohis": true, + "delenph": true, + "log_level": "quiet", + "iniseed": 917, + "ligand_param_fname": "", + "ligand_top_fname": "", + "limit": true, + "set_bfactor": true, + "tolerance": 0, + "cyclicpept_dist": 2.0, + "disulphide_dist": 2.2 + }, + "prodigy.1": { + "scoring_mode": "protein", + "chains": [ + "A", + "B" + ], + "ligand_resname": "UNK", + "ligand_chain": "B", + "distance_cutoff": NaN, + "accessibility_cutoff": 0.05, + "temperature": 25.0, + "to_pkd": true + } +} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.toml b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.toml new file mode 100644 index 000000000..ea3a3d197 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.toml @@ -0,0 +1,54 @@ +cns_exec = "" +ncores = 4 +max_cpus = true +mode = "local" +batch_type = "slurm" +queue = "" +queue_limit = 100 +concat = 1 +self_contained = false +clean = false +offline = false +debug = false +preprocess = false +postprocess = false +run_dir = "run-prodigy-prot-prot" +molecules = [ "data/prot-prot.pdb", "data/homotrimer.pdb",] + +["topoaa.1"] +molecules = [ "data/prot-prot.pdb", "data/homotrimer.pdb",] +autohis = true +delenph = true +log_level = "quiet" +iniseed = 917 +ligand_param_fname = "" +ligand_top_fname = "" +limit = true +set_bfactor = true +tolerance = 0 +cyclicpept_dist = 2.0 +disulphide_dist = 2.2 + +["prodigy.1"] +scoring_mode = "protein" +chains = [ "A", "B",] +ligand_resname = "UNK" +ligand_chain = "B" +distance_cutoff = nan +accessibility_cutoff = 0.05 +temperature = 25.0 +to_pkd = true + +["topoaa.1".mol1] +cyclicpept = false +nhisd = 0 +hisd_1 = nan +nhise = 0 +hise_1 = nan + +["topoaa.1".mol2] +cyclicpept = false +nhisd = 0 +hisd_1 = nan +nhise = 0 +hise_1 = nan diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/raw_input.toml b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/raw_input.toml new file mode 100644 index 000000000..be7221384 --- /dev/null +++ b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/raw_input.toml @@ -0,0 +1,10 @@ + +run_dir = "run-prodigy-prot-prot" +molecules = [ + "data/prot-prot.pdb", + "data/homotrimer.pdb", + ] +postprocess=false +clean=false +[topoaa] +[prodigy] diff --git a/pyproject.toml b/pyproject.toml index b8072d25a..637710f97 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -37,7 +37,9 @@ dependencies = [ 'pandas==2.*', 'plotly==5.11.0', 'kaleido==0.2.1', - 'freesasa>=2.2.1' + 'freesasa>=2.2.1', + 'prodigy-prot==2.2.3', + 'prodigy-lig==1.1.2' ] [project.optional-dependencies] From 5779c30672d6a424bc05fa65494d3f84caea3450 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Thu, 3 Oct 2024 16:18:59 +0200 Subject: [PATCH 08/16] removed runs --- .../run-prodigy-prot-lig/0_topoaa/io.json | 85 - .../run-prodigy-prot-lig/0_topoaa/params.cfg | 19 - .../0_topoaa/prot-lig_haddock.pdb.gz | Bin 97630 -> 0 bytes .../0_topoaa/prot-lig_haddock.psf.gz | Bin 129720 -> 0 bytes .../run-prodigy-prot-lig/1_prodigy/io.json | 89 - .../run-prodigy-prot-lig/1_prodigy/params.cfg | 16 - .../1_prodigy/prodigy.tsv | 2 - .../data/0_topoaa/ligand-prodrg.param | 137 - .../data/0_topoaa/ligand-prodrg.top | 161 - .../data/0_topoaa/prot-lig.pdb | 2984 -- .../data/configurations/README.txt | 6 - .../data/configurations/cleaned_input.toml | 12 - .../enhanced_haddock_params.json | 56 - .../enhanced_haddock_params.toml | 47 - .../data/configurations/raw_input.toml | 12 - .../0_topoaa/homotrimer_haddock.pdb | 3487 -- .../0_topoaa/homotrimer_haddock.psf | 26846 ---------------- .../run-prodigy-prot-prot/0_topoaa/io.json | 147 - .../run-prodigy-prot-prot/0_topoaa/params.cfg | 34 - .../0_topoaa/prot-prot_haddock.pdb | 2154 -- .../0_topoaa/prot-prot_haddock.psf | 16430 ---------- .../run-prodigy-prot-prot/1_prodigy/io.json | 193 - .../1_prodigy/params.cfg | 20 - .../1_prodigy/prodigy.tsv | 3 - .../data/0_topoaa/homotrimer.pdb | 2842 -- .../data/0_topoaa/prot-prot.pdb | 3620 --- .../data/configurations/README.txt | 6 - .../data/configurations/cleaned_input.toml | 10 - .../enhanced_haddock_params.json | 65 - .../enhanced_haddock_params.toml | 54 - .../data/configurations/raw_input.toml | 10 - 31 files changed, 59547 deletions(-) delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/io.json delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/params.cfg delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/prot-lig_haddock.pdb.gz delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/prot-lig_haddock.psf.gz delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/io.json delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/params.cfg delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/prodigy.tsv delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.param delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.top delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/prot-lig.pdb delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/README.txt delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/cleaned_input.toml delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.json delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.toml delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/raw_input.toml delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.pdb delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.psf delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/io.json delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/params.cfg delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.pdb delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.psf delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/io.json delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/params.cfg delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/prodigy.tsv delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/homotrimer.pdb delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/prot-prot.pdb delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/README.txt delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/cleaned_input.toml delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.json delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.toml delete mode 100644 examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/raw_input.toml diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/io.json b/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/io.json deleted file mode 100644 index cef245fbf..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/io.json +++ /dev/null @@ -1,85 +0,0 @@ -{ - "input": [], - "output": [ - { - "0": { - "clt_id": null, - "clt_model_rank": null, - "clt_rank": null, - "created": "2024-10-02 10:05:57", - "file_name": "prot-lig_haddock.pdb", - "file_type": { - "py/reduce": [ - { - "py/type": "haddock.libs.libontology.Format" - }, - { - "py/tuple": [ - "pdb" - ] - } - ] - }, - "full_name": "prot-lig_haddock.pdb", - "len": NaN, - "md5": null, - "ori_name": "prot-lig", - "path": "/Users/vreys/Desktop/HADDOCK3/haddock3-dev/examples/thirdparty/prodigy/run-prodigy-prot-lig/0_topoaa", - "py/object": "haddock.libs.libontology.PDBFile", - "rel_path": { - "py/reduce": [ - { - "py/type": "pathlib.PosixPath" - }, - { - "py/tuple": [ - "..", - "0_topoaa", - "prot-lig_haddock.pdb" - ] - } - ] - }, - "restr_fname": null, - "score": NaN, - "seed": null, - "topology": { - "created": "2024-10-02 10:05:57", - "file_name": "prot-lig_haddock.psf", - "file_type": { - "py/reduce": [ - { - "py/type": "haddock.libs.libontology.Format" - }, - { - "py/tuple": [ - "psf" - ] - } - ] - }, - "full_name": "prot-lig_haddock.psf", - "md5": null, - "path": "/Users/vreys/Desktop/HADDOCK3/haddock3-dev/examples/thirdparty/prodigy/run-prodigy-prot-lig/0_topoaa", - "py/object": "haddock.libs.libontology.TopologyFile", - "rel_path": { - "py/reduce": [ - { - "py/type": "pathlib.PosixPath" - }, - { - "py/tuple": [ - "..", - "0_topoaa", - "prot-lig_haddock.psf" - ] - } - ] - }, - "restr_fname": null - }, - "unw_energies": null - } - } - ] -} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/params.cfg b/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/params.cfg deleted file mode 100644 index 9d92624da..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/params.cfg +++ /dev/null @@ -1,19 +0,0 @@ -[topoaa] -autohis = true -delenph = false -log_level = "quiet" -iniseed = 917 -ligand_param_fname = "data/0_topoaa/ligand-prodrg.param" -ligand_top_fname = "data/0_topoaa/ligand-prodrg.top" -limit = true -set_bfactor = true -tolerance = 0 -cyclicpept_dist = 2.0 -disulphide_dist = 2.2 - -[topoaa.mol1] -cyclicpept = false -nhisd = 0 -hisd_1 = nan -nhise = 0 -hise_1 = nan diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/prot-lig_haddock.pdb.gz b/examples/scoring/prodigy/run-prodigy-prot-lig/0_topoaa/prot-lig_haddock.pdb.gz deleted file mode 100644 index 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"created": "2024-10-02 10:05:57", - "file_name": "prot-lig_haddock.pdb", - "file_type": { - "py/reduce": [ - { - "py/type": "haddock.libs.libontology.Format" - }, - { - "py/tuple": [ - "pdb" - ] - } - ] - }, - "full_name": "prot-lig_haddock.pdb", - "len": NaN, - "md5": null, - "ori_name": "prot-lig", - "path": "/Users/vreys/Desktop/HADDOCK3/haddock3-dev/examples/thirdparty/prodigy/run-prodigy-prot-lig/0_topoaa", - "py/object": "haddock.libs.libontology.PDBFile", - "rel_path": { - "py/reduce": [ - { - "py/type": "pathlib.PosixPath" - }, - { - "py/tuple": [ - "..", - "0_topoaa", - "prot-lig_haddock.pdb" - ] - } - ] - }, - "restr_fname": null, - "score": null, - "seed": null, - "topology": { - "created": "2024-10-02 10:05:57", - "file_name": "prot-lig_haddock.psf", - "file_type": { - "py/reduce": [ - { - "py/type": "haddock.libs.libontology.Format" - }, - { - "py/tuple": [ - "psf" - ] - } - ] - }, - "full_name": "prot-lig_haddock.psf", - "md5": null, - "path": "/Users/vreys/Desktop/HADDOCK3/haddock3-dev/examples/thirdparty/prodigy/run-prodigy-prot-lig/0_topoaa", - "py/object": "haddock.libs.libontology.TopologyFile", - "rel_path": { - "py/reduce": [ - { - "py/type": "pathlib.PosixPath" - }, - { - "py/tuple": [ - "..", - "0_topoaa", - "prot-lig_haddock.psf" - ] - } - ] - }, - "restr_fname": null - }, - "unw_energies": null - } - } - ], - "output": [ - { - "py/id": 3 - } - ] -} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/params.cfg b/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/params.cfg deleted file mode 100644 index ede8f56fe..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/params.cfg +++ /dev/null @@ -1,16 +0,0 @@ -[prodigy] -ncores = 4 -max_cpus = true -mode = "local" -queue_limit = 100 -clean = true -offline = false -debug = false -scoring_mode = "ligand" -chains = [ "A", "B",] -ligand_resname = "G39" -ligand_chain = "B" -distance_cutoff = nan -accessibility_cutoff = 0.05 -temperature = 25.0 -to_pkd = true diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/prodigy.tsv b/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/prodigy.tsv deleted file mode 100644 index 19c327958..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/1_prodigy/prodigy.tsv +++ /dev/null @@ -1,2 +0,0 @@ -structure original_name md5 score -prot-lig_haddock.pdb prot-lig None None diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.param b/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.param deleted file mode 100644 index 74de15e0d..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.param +++ /dev/null @@ -1,137 +0,0 @@ -! Put in this file your ligand parameters if needed -! -! -! This file was generated by PRODRG version 070118.0614 -! PRODRG written/copyrighted by Daan van Aalten -! and Alexander Schuettelkopf -! -! Questions/comments to dava@davapc1.bioch.dundee.ac.uk -! -! When using this software in a publication, cite: -! A. W. Schuettelkopf and D. M. F. van Aalten (2004). -! PRODRG - a tool for high-throughput crystallography -! of protein-ligand complexes. -! Acta Crystallogr. D60, 1355--1363. -! -! -! *** NOTE *** IF YOU USE MORE THAN ONE PRODRG-GENERATED TOPOLOGY IN CNS, -! PLEASE CAREFULLY READ THE FAQ AS THIS MAY CAUSE PROBLEMS -! -! -set echo=off message=on end - -evaluate ($pd_x = 1.0) - -eval ($pd_v=$pd_x* 16000.0) BOND CA82 CA81 $pd_v 1.530 -eval ($pd_v=$pd_x* 12000.0) BOND CA81 CA8 $pd_v 1.530 -eval ($pd_v=$pd_x* 12000.0) BOND CA8 CA9 $pd_v 1.530 -eval ($pd_v=$pd_x* 12000.0) BOND CA8 OA7 $pd_v 1.435 -eval ($pd_v=$pd_x* 16000.0) BOND CA9 CA91 $pd_v 1.530 -eval ($pd_v=$pd_x* 12000.0) BOND OA7 CA6 $pd_v 1.435 -eval ($pd_v=$pd_x* 20000.0) BOND CA6 CA7 $pd_v 1.390 -eval ($pd_v=$pd_x* 16000.0) BOND CA6 CA5 $pd_v 1.530 -eval ($pd_v=$pd_x* 20000.0) BOND CA7 CA2 $pd_v 1.390 -eval ($pd_v=$pd_x* 16000.0) BOND CA2 CA1 $pd_v 1.530 -eval ($pd_v=$pd_x* 16000.0) BOND CA2 CA3 $pd_v 1.530 -eval ($pd_v=$pd_x* 20000.0) BOND CA1 OA1B $pd_v 1.250 -eval ($pd_v=$pd_x* 20000.0) BOND CA1 OA1A $pd_v 1.250 -eval ($pd_v=$pd_x* 16000.0) BOND CA3 CA4 $pd_v 1.530 -eval ($pd_v=$pd_x* 18000.0) BOND CA4 NA4 $pd_v 1.470 -eval ($pd_v=$pd_x* 16000.0) BOND CA4 CA5 $pd_v 1.530 -eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAB $pd_v 1.000 -eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAC $pd_v 1.000 -eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAA $pd_v 1.000 -eval ($pd_v=$pd_x* 18000.0) BOND CA5 NA5 $pd_v 1.470 -eval ($pd_v=$pd_x* 17900.0) BOND NA5 HAAD $pd_v 1.000 -eval ($pd_v=$pd_x* 20000.0) BOND NA5 CA10 $pd_v 1.330 -eval ($pd_v=$pd_x* 16000.0) BOND CA10 CA11 $pd_v 1.530 -eval ($pd_v=$pd_x* 24000.0) BOND CA10 OA10 $pd_v 1.230 - -eval ($pd_v=$pd_x* 880.0) ANGLE CA82 CA81 CA8 $pd_v 111.000 -eval ($pd_v=$pd_x* 480.0) ANGLE CA81 CA8 CA9 $pd_v 109.500 -eval ($pd_v=$pd_x* 544.0) ANGLE CA81 CA8 OA7 $pd_v 109.500 -eval ($pd_v=$pd_x* 544.0) ANGLE CA9 CA8 OA7 $pd_v 109.500 -eval ($pd_v=$pd_x* 880.0) ANGLE CA8 CA9 CA91 $pd_v 111.000 -eval ($pd_v=$pd_x* 640.0) ANGLE CA8 OA7 CA6 $pd_v 109.500 -eval ($pd_v=$pd_x* 544.0) ANGLE OA7 CA6 CA7 $pd_v 109.500 -eval ($pd_v=$pd_x* 544.0) ANGLE OA7 CA6 CA5 $pd_v 109.500 -eval ($pd_v=$pd_x* 544.0) ANGLE CA7 CA6 CA5 $pd_v 109.500 -eval ($pd_v=$pd_x* 800.0) ANGLE CA6 CA7 CA2 $pd_v 120.000 -eval ($pd_v=$pd_x* 800.0) ANGLE CA7 CA2 CA1 $pd_v 120.000 -eval ($pd_v=$pd_x* 800.0) ANGLE CA7 CA2 CA3 $pd_v 120.000 -eval ($pd_v=$pd_x* 800.0) ANGLE CA1 CA2 CA3 $pd_v 120.000 -eval ($pd_v=$pd_x* 800.0) ANGLE CA2 CA1 OA1B $pd_v 120.000 -eval ($pd_v=$pd_x* 800.0) ANGLE CA2 CA1 OA1A $pd_v 120.000 -eval ($pd_v=$pd_x* 960.0) ANGLE OA1B CA1 OA1A $pd_v 126.000 -eval ($pd_v=$pd_x* 880.0) ANGLE CA2 CA3 CA4 $pd_v 111.000 -eval ($pd_v=$pd_x* 880.0) ANGLE CA3 CA4 NA4 $pd_v 109.500 -eval ($pd_v=$pd_x* 880.0) ANGLE CA3 CA4 CA5 $pd_v 111.000 -eval ($pd_v=$pd_x* 880.0) ANGLE NA4 CA4 CA5 $pd_v 109.500 -eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAB $pd_v 109.500 -eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAC $pd_v 109.500 -eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAA $pd_v 109.500 -eval ($pd_v=$pd_x* 640.0) ANGLE HAAB NA4 HAAC $pd_v 109.500 -eval ($pd_v=$pd_x* 640.0) ANGLE HAAB NA4 HAAA $pd_v 109.500 -eval ($pd_v=$pd_x* 640.0) ANGLE HAAC NA4 HAAA $pd_v 109.500 -eval ($pd_v=$pd_x* 880.0) ANGLE CA6 CA5 CA4 $pd_v 111.000 -eval ($pd_v=$pd_x* 880.0) ANGLE CA6 CA5 NA5 $pd_v 109.500 -eval ($pd_v=$pd_x* 880.0) ANGLE CA4 CA5 NA5 $pd_v 109.500 -eval ($pd_v=$pd_x* 720.0) ANGLE CA5 NA5 HAAD $pd_v 115.000 -eval ($pd_v=$pd_x* 960.0) ANGLE CA5 NA5 CA10 $pd_v 122.000 -eval ($pd_v=$pd_x* 560.0) ANGLE HAAD NA5 CA10 $pd_v 123.000 -eval ($pd_v=$pd_x* 960.0) ANGLE NA5 CA10 CA11 $pd_v 115.000 -eval ($pd_v=$pd_x* 960.0) ANGLE NA5 CA10 OA10 $pd_v 124.000 -eval ($pd_v=$pd_x* 960.0) ANGLE CA11 CA10 OA10 $pd_v 121.000 - -eval ($pd_v=$pd_x* 800.0) IMPR CA2 CA7 CA3 CA1 $pd_v 0 0.000 -eval ($pd_v=$pd_x* 800.0) IMPR CA1 CA2 OA1A OA1B $pd_v 0 0.000 -eval ($pd_v=$pd_x* 800.0) IMPR NA5 CA5 HAAD CA10 $pd_v 0 0.000 -eval ($pd_v=$pd_x* 800.0) IMPR CA10 NA5 CA11 OA10 $pd_v 0 0.000 -eval ($pd_v=$pd_x* 400.0) IMPR CA8 CA81 CA9 OA7 $pd_v 0 35.264 -eval ($pd_v=$pd_x* 400.0) IMPR CA6 OA7 CA7 CA5 $pd_v 0 35.264 -eval ($pd_v=$pd_x* 400.0) IMPR CA4 CA3 NA4 CA5 $pd_v 0 35.264 -eval ($pd_v=$pd_x* 400.0) IMPR NA4 CA4 HAAC HAAB $pd_v 0 35.264 -eval ($pd_v=$pd_x* 400.0) IMPR CA5 CA6 NA5 CA4 $pd_v 0 35.264 - -eval ($pd_v=$pd_x* 19.6) DIHE OA7 CA8 CA81 CA82 $pd_v 3 0.000 -eval ($pd_v=$pd_x* 19.6) DIHE CA81 CA8 CA9 CA91 $pd_v 3 0.000 -eval ($pd_v=$pd_x* 8.1) DIHE CA81 CA8 OA7 CA6 $pd_v 3 0.000 -eval ($pd_v=$pd_x* 8.1) DIHE CA5 CA6 OA7 CA8 $pd_v 3 0.000 -eval ($pd_v=$pd_x* 1000.0) DIHE OA7 CA6 CA7 CA2 $pd_v 2 180.000 -eval ($pd_v=$pd_x* 19.6) DIHE OA7 CA6 CA5 NA5 $pd_v 3 0.000 -eval ($pd_v=$pd_x* 1000.0) DIHE CA3 CA2 CA7 CA6 $pd_v 2 180.000 -eval ($pd_v=$pd_x* 19.6) DIHE CA7 CA2 CA1 OA1A $pd_v 2 180.000 -eval ($pd_v=$pd_x* 0.1) DIHE CA7 CA2 CA3 CA4 $pd_v 6 0.000 -eval ($pd_v=$pd_x* 19.6) DIHE CA2 CA3 CA4 CA5 $pd_v 3 0.000 -eval ($pd_v=$pd_x* 8.1) DIHE CA3 CA4 NA4 HAAA $pd_v 3 0.000 -eval ($pd_v=$pd_x* 19.6) DIHE NA5 CA5 CA4 CA3 $pd_v 3 0.000 -eval ($pd_v=$pd_x* 0.1) DIHE CA6 CA5 NA5 CA10 $pd_v 6 180.000 -eval ($pd_v=$pd_x* 640.0) DIHE OA10 CA10 NA5 CA5 $pd_v 2 180.000 - - -NONBONDED CA82 0.10000 3.29633 0.10000 3.02906 -NONBONDED CA81 0.10000 3.29633 0.10000 3.02906 -NONBONDED CA8 0.10000 3.29633 0.10000 3.02906 -NONBONDED CA9 0.10000 3.29633 0.10000 3.02906 -NONBONDED CA91 0.10000 3.29633 0.10000 3.02906 -NONBONDED OA7 0.10000 2.58361 0.10000 2.31634 -NONBONDED CA6 0.10000 3.29633 0.10000 3.02906 -NONBONDED CA7 0.10000 3.29633 0.10000 3.02906 -NONBONDED CA2 0.10000 3.29633 0.10000 3.02906 -NONBONDED CA1 0.10000 3.29633 0.10000 3.02906 -NONBONDED OA1B 0.10000 2.58361 0.10000 2.31634 -NONBONDED OA1A 0.10000 2.58361 0.10000 2.31634 -NONBONDED CA3 0.10000 3.29633 0.10000 3.02906 -NONBONDED CA4 0.10000 3.29633 0.10000 3.02906 -NONBONDED NA4 0.10000 2.67270 0.10000 2.40543 -NONBONDED HAAB 0.10000 1.42544 0.10000 1.15817 -NONBONDED HAAC 0.10000 1.42544 0.10000 1.15817 -NONBONDED HAAA 0.10000 1.42544 0.10000 1.15817 -NONBONDED CA5 0.10000 3.29633 0.10000 3.02906 -NONBONDED NA5 0.10000 2.67270 0.10000 2.40543 -NONBONDED HAAD 0.10000 1.42544 0.10000 1.15817 -NONBONDED CA10 0.10000 3.29633 0.10000 3.02906 -NONBONDED CA11 0.10000 3.29633 0.10000 3.02906 -NONBONDED OA10 0.10000 2.58361 0.10000 2.31634 - -set echo=on message=on end diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.top b/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.top deleted file mode 100644 index 9f58ce52d..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/ligand-prodrg.top +++ /dev/null @@ -1,161 +0,0 @@ -! Put in this file your ligand topology if needed -! -! -! This file was generated by PRODRG version 070118.0614 -! PRODRG written/copyrighted by Daan van Aalten -! and Alexander Schuettelkopf -! -! Questions/comments to dava@davapc1.bioch.dundee.ac.uk -! -! When using this software in a publication, cite: -! A. W. Schuettelkopf and D. M. F. van Aalten (2004). -! PRODRG - a tool for high-throughput crystallography -! of protein-ligand complexes. -! Acta Crystallogr. D60, 1355--1363. -! -! -! *** NOTE *** IF YOU USE MORE THAN ONE PRODRG-GENERATED TOPOLOGY IN CNS, -! PLEASE CAREFULLY READ THE FAQ AS THIS MAY CAUSE PROBLEMS -! -! -set echo=false end -AUTOGENERATE ANGLES=FALSE END -MASS CA82 15.0350 ! equivalent to CH3 -MASS CA81 14.0270 ! equivalent to CH2 -MASS CA8 13.0190 ! equivalent to CS1 -MASS CA9 14.0270 ! equivalent to CH2 -MASS CA91 15.0350 ! equivalent to CH3 -MASS OA7 15.9994 ! equivalent to OS -MASS CA6 13.0190 ! equivalent to CS1 -MASS CA7 13.0190 ! equivalent to CR61 -MASS CA2 12.0110 ! equivalent to CB -MASS CA1 12.0110 ! equivalent to C -MASS OA1B 15.9994 ! equivalent to OM -MASS OA1A 15.9994 ! equivalent to OM -MASS CA3 14.0270 ! equivalent to CH2 -MASS CA4 13.0190 ! equivalent to CH1 -MASS NA4 14.0067 ! equivalent to NL -MASS HAAB 1.0080 ! equivalent to H -MASS HAAC 1.0080 ! equivalent to H -MASS HAAA 1.0080 ! equivalent to H -MASS CA5 13.0190 ! equivalent to CH1 -MASS NA5 14.0067 ! equivalent to N -MASS HAAD 1.0080 ! equivalent to H -MASS CA10 12.0110 ! equivalent to C -MASS CA11 15.0350 ! equivalent to CH3 -MASS OA10 15.9994 ! equivalent to O - -Residue G39 -GROUP - ATOM C82 TYPE= CA82 CHARGE= 0.024 END - ATOM C81 TYPE= CA81 CHARGE= 0.062 END - ATOM C8 TYPE= CA8 CHARGE= 0.211 END - ATOM C9 TYPE= CA9 CHARGE= 0.061 END - ATOM C91 TYPE= CA91 CHARGE= 0.024 END - ATOM O7 TYPE= OA7 CHARGE=-0.182 END - ATOM C6 TYPE= CA6 CHARGE= 0.211 END - ATOM C7 TYPE= CA7 CHARGE=-0.008 END - ATOM C2 TYPE= CA2 CHARGE=-0.022 END - ATOM C1 TYPE= CA1 CHARGE= 0.361 END - ATOM O1B TYPE= OA1B CHARGE=-0.756 END - ATOM O1A TYPE= OA1A CHARGE=-0.756 END - ATOM C3 TYPE= CA3 CHARGE= 0.062 END - ATOM C4 TYPE= CA4 CHARGE= 0.124 END - ATOM N4 TYPE= NA4 CHARGE= 0.646 END - ATOM HAB TYPE= HAAB CHARGE= 0.000 END - ATOM HAC TYPE= HAAC CHARGE= 0.001 END - ATOM HAA TYPE= HAAA CHARGE= 0.000 END - ATOM C5 TYPE= CA5 CHARGE= 0.124 END - ATOM N5 TYPE= NA5 CHARGE= 0.132 END - ATOM H07 TYPE= HAAD CHARGE= 0.000 END - ATOM C10 TYPE= CA10 CHARGE= 0.361 END - ATOM C11 TYPE= CA11 CHARGE= 0.024 END - ATOM O10 TYPE= OA10 CHARGE=-0.704 END - - BOND C82 C81 - BOND C81 C8 - BOND C8 C9 - BOND C8 O7 - BOND C9 C91 - BOND O7 C6 - BOND C6 C7 - BOND C6 C5 - BOND C7 C2 - BOND C2 C1 - BOND C2 C3 - BOND C1 O1B - BOND C1 O1A - BOND C3 C4 - BOND C4 N4 - BOND C4 C5 - BOND N4 HAB - BOND N4 HAC - BOND N4 HAA - BOND C5 N5 - BOND N5 H07 - BOND N5 C10 - BOND C10 C11 - BOND C10 O10 - - ANGLE C82 C81 C8 - ANGLE C81 C8 C9 - ANGLE C81 C8 O7 - ANGLE C9 C8 O7 - ANGLE C8 C9 C91 - ANGLE C8 O7 C6 - ANGLE O7 C6 C7 - ANGLE O7 C6 C5 - ANGLE C7 C6 C5 - ANGLE C6 C7 C2 - ANGLE C7 C2 C1 - ANGLE C7 C2 C3 - ANGLE C1 C2 C3 - ANGLE C2 C1 O1B - ANGLE C2 C1 O1A - ANGLE O1B C1 O1A - ANGLE C2 C3 C4 - ANGLE C3 C4 N4 - ANGLE C3 C4 C5 - ANGLE N4 C4 C5 - ANGLE C4 N4 HAB - ANGLE C4 N4 HAC - ANGLE C4 N4 HAA - ANGLE HAB N4 HAC - ANGLE HAB N4 HAA - ANGLE HAC N4 HAA - ANGLE C6 C5 C4 - ANGLE C6 C5 N5 - ANGLE C4 C5 N5 - ANGLE C5 N5 H07 - ANGLE C5 N5 C10 - ANGLE H07 N5 C10 - ANGLE N5 C10 C11 - ANGLE N5 C10 O10 - ANGLE C11 C10 O10 - - IMPROPER C2 C7 C3 C1 - IMPROPER C1 C2 O1A O1B - IMPROPER N5 C5 H07 C10 - IMPROPER C10 N5 C11 O10 - IMPROPER C8 C81 C9 O7 - IMPROPER C6 O7 C7 C5 - IMPROPER C4 C3 N4 C5 - IMPROPER N4 C4 HAC HAB - IMPROPER C5 C6 N5 C4 - - DIHEDRAL O7 C8 C81 C82 - DIHEDRAL C81 C8 C9 C91 - DIHEDRAL C81 C8 O7 C6 - DIHEDRAL C5 C6 O7 C8 - DIHEDRAL O7 C6 C7 C2 - DIHEDRAL O7 C6 C5 N5 - DIHEDRAL C3 C2 C7 C6 - DIHEDRAL C7 C2 C1 O1A - DIHEDRAL C7 C2 C3 C4 - DIHEDRAL C2 C3 C4 C5 - DIHEDRAL C3 C4 N4 HAA - DIHEDRAL N5 C5 C4 C3 - DIHEDRAL C6 C5 N5 C10 - DIHEDRAL O10 C10 N5 C5 -END -set echo=true end diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/prot-lig.pdb b/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/prot-lig.pdb deleted file mode 100644 index 14dfff9e6..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/data/0_topoaa/prot-lig.pdb +++ /dev/null @@ -1,2984 +0,0 @@ -ATOM 1 N VAL A 83 -0.603 65.642 77.183 1.00 23.27 -ATOM 2 CA VAL A 83 -0.883 67.005 76.630 1.00 24.70 -ATOM 3 C VAL A 83 -1.221 68.015 77.732 1.00 24.24 -ATOM 4 O VAL A 83 -1.851 67.665 78.731 1.00 23.78 -ATOM 5 CB VAL A 83 -2.050 66.965 75.617 1.00 25.58 -ATOM 6 CG1 VAL A 83 -2.332 68.365 75.094 1.00 27.08 -ATOM 7 CG2 VAL A 83 -1.694 66.047 74.443 1.00 26.86 -ATOM 8 N LYS A 84 -0.803 69.266 77.541 1.00 23.15 -ATOM 9 CA LYS A 84 -1.047 70.312 78.526 1.00 23.28 -ATOM 10 C LYS A 84 -2.520 70.643 78.728 1.00 22.34 -ATOM 11 O LYS A 84 -3.329 70.575 77.803 1.00 21.41 -ATOM 12 CB LYS A 84 -0.293 71.609 78.170 1.00 25.35 -ATOM 13 CG LYS A 84 1.234 71.495 78.128 1.00 27.98 -ATOM 14 CD LYS A 84 1.687 70.672 76.908 1.00 32.17 -ATOM 15 CE LYS A 84 3.218 70.699 76.721 1.00 35.02 -ATOM 16 NZ LYS A 84 3.669 69.985 75.468 1.00 32.46 -ATOM 17 N LEU A 85 -2.836 70.998 79.971 1.00 21.36 -ATOM 18 CA LEU A 85 -4.174 71.377 80.412 1.00 21.17 -ATOM 19 C LEU A 85 -4.571 72.749 79.852 1.00 21.63 -ATOM 20 O LEU A 85 -4.184 73.775 80.412 1.00 21.68 -ATOM 21 CB LEU A 85 -4.180 71.472 81.940 1.00 19.23 -ATOM 22 CG LEU A 85 -4.907 70.504 82.871 1.00 18.81 -ATOM 23 CD1 LEU A 85 -4.718 69.052 82.431 1.00 17.36 -ATOM 24 CD2 LEU A 85 -4.375 70.727 84.283 1.00 15.43 -ATOM 25 N ALA A 86 -5.324 72.783 78.758 1.00 22.41 -ATOM 26 CA ALA A 86 -5.764 74.068 78.209 1.00 23.07 -ATOM 27 C ALA A 86 -6.644 74.681 79.283 1.00 24.49 -ATOM 28 O ALA A 86 -7.432 73.968 79.940 1.00 26.72 -ATOM 29 CB ALA A 86 -6.582 73.860 76.947 1.00 21.36 -ATOM 30 N GLY A 87 -6.521 75.983 79.490 1.00 23.88 -ATOM 31 CA GLY A 87 -7.356 76.603 80.502 1.00 23.40 -ATOM 32 C GLY A 87 -8.233 77.644 79.853 1.00 23.10 -ATOM 33 O GLY A 87 -8.455 78.701 80.430 1.00 24.54 -ATOM 34 N ASN A 88 -8.734 77.345 78.658 1.00 22.81 -ATOM 35 CA ASN A 88 -9.557 78.291 77.901 1.00 23.45 -ATOM 36 C ASN A 88 -11.049 78.272 78.232 1.00 22.82 -ATOM 37 O ASN A 88 -11.773 79.227 77.934 1.00 22.04 -ATOM 38 CB ASN A 88 -9.371 78.065 76.388 1.00 23.46 -ATOM 39 CG ASN A 88 -9.739 76.650 75.945 1.00 25.27 -ATOM 40 OD1 ASN A 88 -9.875 76.376 74.744 1.00 26.52 -ATOM 41 ND2 ASN A 88 -9.889 75.744 76.907 1.00 24.57 -ATOM 42 N SER A 89 -11.496 77.184 78.850 1.00 22.01 -ATOM 43 CA SER A 89 -12.890 77.003 79.222 1.00 20.48 -ATOM 44 C SER A 89 -13.275 77.864 80.437 1.00 20.16 -ATOM 45 O SER A 89 -12.389 78.389 81.123 1.00 18.19 -ATOM 46 CB SER A 89 -13.118 75.525 79.503 1.00 20.37 -ATOM 47 OG SER A 89 -14.284 75.325 80.256 1.00 24.18 -ATOM 48 N SER A 90 -14.584 78.019 80.683 1.00 18.16 -ATOM 49 CA SER A 90 -15.089 78.818 81.809 1.00 18.71 -ATOM 50 C SER A 90 -15.584 77.952 82.951 1.00 18.51 -ATOM 51 O SER A 90 -15.737 76.750 82.795 1.00 17.89 -ATOM 52 CB SER A 90 -16.253 79.718 81.376 1.00 18.61 -ATOM 53 OG SER A 90 -15.818 80.825 80.605 1.00 21.87 -ATOM 54 N LEU A 91 -15.839 78.573 84.099 1.00 18.93 -ATOM 55 CA LEU A 91 -16.343 77.836 85.246 1.00 20.24 -ATOM 56 C LEU A 91 -17.727 77.294 84.928 1.00 21.74 -ATOM 57 O LEU A 91 -18.540 77.973 84.281 1.00 22.26 -ATOM 58 CB LEU A 91 -16.443 78.728 86.482 1.00 19.23 -ATOM 59 CG LEU A 91 -15.139 79.157 87.148 1.00 20.38 -ATOM 60 CD1 LEU A 91 -15.461 79.926 88.422 1.00 19.78 -ATOM 61 CD2 LEU A 91 -14.286 77.934 87.469 1.00 21.05 -ATOM 62 N CYS A 92 -17.988 76.072 85.388 1.00 22.34 -ATOM 63 CA CYS A 92 -19.276 75.421 85.167 1.00 23.87 -ATOM 64 C CYS A 92 -20.379 76.025 86.033 1.00 22.62 -ATOM 65 O CYS A 92 -20.200 76.259 87.231 1.00 22.68 -ATOM 66 CB CYS A 92 -19.208 73.924 85.499 1.00 24.29 -ATOM 67 SG CYS A 92 -17.950 72.903 84.654 1.00 28.63 -ATOM 68 N PRO A 93 -21.543 76.283 85.432 1.00 22.29 -ATOM 69 CA PRO A 93 -22.665 76.848 86.192 1.00 21.47 -ATOM 70 C PRO A 93 -23.051 75.833 87.276 1.00 20.56 -ATOM 71 O PRO A 93 -23.027 74.633 87.025 1.00 20.96 -ATOM 72 CB PRO A 93 -23.747 77.016 85.124 1.00 21.42 -ATOM 73 CG PRO A 93 -23.387 75.953 84.102 1.00 21.53 -ATOM 74 CD PRO A 93 -21.897 76.087 84.016 1.00 21.41 -ATOM 75 N ILE A 94 -23.410 76.306 88.467 1.00 19.54 -ATOM 76 CA ILE A 94 -23.755 75.413 89.576 1.00 18.82 -ATOM 77 C ILE A 94 -24.907 75.922 90.443 1.00 18.69 -ATOM 78 O ILE A 94 -25.173 77.126 90.499 1.00 19.16 -ATOM 79 CB ILE A 94 -22.543 75.231 90.521 1.00 18.77 -ATOM 80 CG1 ILE A 94 -22.121 76.607 91.064 1.00 18.20 -ATOM 81 CG2 ILE A 94 -21.393 74.553 89.789 1.00 16.48 -ATOM 82 CD1 ILE A 94 -20.922 76.594 92.003 1.00 19.30 -ATOM 83 N ASN A 95 -25.561 75.007 91.151 1.00 17.85 -ATOM 84 CA ASN A 95 -26.661 75.382 92.034 1.00 17.80 -ATOM 85 C ASN A 95 -26.351 75.192 93.516 1.00 16.85 -ATOM 86 O ASN A 95 -26.893 75.894 94.356 1.00 18.58 -ATOM 87 CB ASN A 95 -27.918 74.600 91.657 1.00 18.29 -ATOM 88 CG ASN A 95 -28.406 74.950 90.270 1.00 18.81 -ATOM 89 OD1 ASN A 95 -28.697 76.115 89.985 1.00 20.87 -ATOM 90 ND2 ASN A 95 -28.481 73.958 89.395 1.00 16.41 -ATOM 91 N GLY A 96 -25.468 74.252 93.831 1.00 16.59 -ATOM 92 CA GLY A 96 -25.111 73.989 95.216 1.00 15.59 -ATOM 93 C GLY A 96 -23.809 73.213 95.304 1.00 16.10 -ATOM 94 O GLY A 96 -23.030 73.221 94.355 1.00 15.13 -ATOM 95 N TRP A 97 -23.565 72.533 96.421 1.00 14.71 -ATOM 96 CA TRP A 97 -22.320 71.792 96.572 1.00 13.24 -ATOM 97 C TRP A 97 -22.503 70.374 97.104 1.00 12.70 -ATOM 98 O TRP A 97 -23.161 70.160 98.114 1.00 13.47 -ATOM 99 CB TRP A 97 -21.382 72.573 97.488 1.00 13.31 -ATOM 100 CG TRP A 97 -21.232 73.988 97.069 1.00 12.85 -ATOM 101 CD1 TRP A 97 -22.087 75.026 97.338 1.00 12.77 -ATOM 102 CD2 TRP A 97 -20.202 74.523 96.237 1.00 13.15 -ATOM 103 NE1 TRP A 97 -21.650 76.173 96.721 1.00 12.28 -ATOM 104 CE2 TRP A 97 -20.494 75.891 96.036 1.00 14.86 -ATOM 105 CE3 TRP A 97 -19.058 73.978 95.633 1.00 12.71 -ATOM 106 CZ2 TRP A 97 -19.679 76.723 95.253 1.00 15.46 -ATOM 107 CZ3 TRP A 97 -18.250 74.805 94.856 1.00 13.67 -ATOM 108 CH2 TRP A 97 -18.566 76.162 94.673 1.00 12.77 -ATOM 109 N ALA A 98 -21.910 69.408 96.415 1.00 12.12 -ATOM 110 CA ALA A 98 -22.016 68.013 96.813 1.00 11.95 -ATOM 111 C ALA A 98 -20.751 67.550 97.524 1.00 12.20 -ATOM 112 O ALA A 98 -19.644 67.910 97.136 1.00 12.01 -ATOM 113 CB ALA A 98 -22.275 67.153 95.595 1.00 11.01 -ATOM 114 N VAL A 99 -20.922 66.743 98.564 1.00 12.65 -ATOM 115 CA VAL A 99 -19.781 66.243 99.322 1.00 14.64 -ATOM 116 C VAL A 99 -18.885 65.404 98.439 1.00 13.18 -ATOM 117 O VAL A 99 -19.359 64.549 97.708 1.00 12.64 -ATOM 118 CB VAL A 99 -20.202 65.356 100.485 1.00 15.97 -ATOM 119 CG1 VAL A 99 -19.354 65.693 101.700 1.00 15.79 -ATOM 120 CG2 VAL A 99 -21.686 65.519 100.760 1.00 19.35 -ATOM 121 N TYR A 100 -17.585 65.637 98.533 1.00 13.63 -ATOM 122 CA TYR A 100 -16.639 64.906 97.718 1.00 14.52 -ATOM 123 C TYR A 100 -15.803 63.930 98.553 1.00 15.51 -ATOM 124 O TYR A 100 -15.587 62.787 98.130 1.00 15.83 -ATOM 125 CB TYR A 100 -15.742 65.898 96.968 1.00 13.53 -ATOM 126 CG TYR A 100 -14.919 65.285 95.858 1.00 14.01 -ATOM 127 CD1 TYR A 100 -15.522 64.571 94.824 1.00 13.99 -ATOM 128 CD2 TYR A 100 -13.539 65.423 95.838 1.00 14.32 -ATOM 129 CE1 TYR A 100 -14.767 64.009 93.802 1.00 11.98 -ATOM 130 CE2 TYR A 100 -12.774 64.867 94.817 1.00 13.82 -ATOM 131 CZ TYR A 100 -13.391 64.160 93.805 1.00 14.31 -ATOM 132 OH TYR A 100 -12.618 63.581 92.812 1.00 15.72 -ATOM 133 N SER A 101 -15.357 64.365 99.735 1.00 13.51 -ATOM 134 CA SER A 101 -14.539 63.503 100.590 1.00 12.62 -ATOM 135 C SER A 101 -14.416 63.900 102.068 1.00 13.97 -ATOM 136 O SER A 101 -14.744 65.019 102.476 1.00 14.57 -ATOM 137 CB SER A 101 -13.128 63.407 100.015 1.00 11.77 -ATOM 138 OG SER A 101 -12.451 64.647 100.141 1.00 11.08 -ATOM 139 N LYS A 102 -13.918 62.962 102.861 1.00 13.04 -ATOM 140 CA LYS A 102 -13.698 63.181 104.283 1.00 14.72 -ATOM 141 C LYS A 102 -12.652 62.157 104.725 1.00 14.61 -ATOM 142 O LYS A 102 -12.870 60.955 104.596 1.00 16.89 -ATOM 143 CB LYS A 102 -15.000 62.996 105.070 1.00 13.78 -ATOM 144 CG LYS A 102 -14.871 63.366 106.540 1.00 14.11 -ATOM 145 CD LYS A 102 -16.194 63.259 107.267 1.00 12.86 -ATOM 146 CE LYS A 102 -16.174 64.042 108.565 1.00 12.67 -ATOM 147 NZ LYS A 102 -15.160 63.556 109.541 1.00 11.15 -ATOM 148 N ASP A 103 -11.525 62.621 105.249 1.00 13.72 -ATOM 149 CA ASP A 103 -10.469 61.700 105.643 1.00 15.37 -ATOM 150 C ASP A 103 -10.456 61.196 107.081 1.00 15.71 -ATOM 151 O ASP A 103 -9.741 60.245 107.380 1.00 17.23 -ATOM 152 CB ASP A 103 -9.093 62.287 105.270 1.00 17.90 -ATOM 153 CG ASP A 103 -8.857 63.683 105.838 1.00 20.44 -ATOM 154 OD1 ASP A 103 -8.066 64.443 105.226 1.00 22.27 -ATOM 155 OD2 ASP A 103 -9.440 64.022 106.892 1.00 22.08 -ATOM 156 N ASN A 104 -11.242 61.815 107.961 1.00 14.75 -ATOM 157 CA ASN A 104 -11.313 61.404 109.361 1.00 14.37 -ATOM 158 C ASN A 104 -9.945 61.165 109.986 1.00 15.66 -ATOM 159 O ASN A 104 -9.837 60.437 110.967 1.00 15.47 -ATOM 160 CB ASN A 104 -12.127 60.118 109.486 1.00 13.83 -ATOM 161 CG ASN A 104 -13.608 60.354 109.346 1.00 13.58 -ATOM 162 OD1 ASN A 104 -14.266 59.777 108.485 1.00 15.86 -ATOM 163 ND2 ASN A 104 -14.142 61.204 110.196 1.00 9.58 -ATOM 164 N SER A 105 -8.914 61.798 109.441 1.00 15.35 -ATOM 165 CA SER A 105 -7.551 61.594 109.916 1.00 17.55 -ATOM 166 C SER A 105 -7.300 61.629 111.429 1.00 17.96 -ATOM 167 O SER A 105 -6.501 60.841 111.936 1.00 18.51 -ATOM 168 CB SER A 105 -6.605 62.581 109.233 1.00 17.63 -ATOM 169 OG SER A 105 -6.594 63.816 109.924 1.00 23.37 -ATOM 170 N ILE A 106 -7.963 62.522 112.155 1.00 18.17 -ATOM 171 CA ILE A 106 -7.737 62.603 113.598 1.00 18.14 -ATOM 172 C ILE A 106 -8.428 61.497 114.398 1.00 18.35 -ATOM 173 O ILE A 106 -7.839 60.940 115.335 1.00 18.93 -ATOM 174 CB ILE A 106 -8.127 63.997 114.134 1.00 17.39 -ATOM 175 CG1 ILE A 106 -7.303 65.057 113.382 1.00 16.56 -ATOM 176 CG2 ILE A 106 -7.862 64.079 115.637 1.00 15.87 -ATOM 177 CD1 ILE A 106 -7.657 66.483 113.685 1.00 16.68 -ATOM 178 N ARG A 107 -9.665 61.169 114.031 1.00 17.47 -ATOM 179 CA ARG A 107 -10.393 60.093 114.711 1.00 16.32 -ATOM 180 C ARG A 107 -9.552 58.829 114.574 1.00 15.83 -ATOM 181 O ARG A 107 -9.335 58.098 115.540 1.00 17.65 -ATOM 182 CB ARG A 107 -11.762 59.865 114.056 1.00 15.15 -ATOM 183 CG ARG A 107 -12.830 60.880 114.442 1.00 13.35 -ATOM 184 CD ARG A 107 -14.025 60.798 113.502 1.00 13.94 -ATOM 185 NE ARG A 107 -14.687 59.494 113.511 1.00 13.22 -ATOM 186 CZ ARG A 107 -15.594 59.117 114.409 1.00 13.77 -ATOM 187 NH1 ARG A 107 -16.141 57.912 114.334 1.00 11.16 -ATOM 188 NH2 ARG A 107 -15.959 59.946 115.382 1.00 11.90 -ATOM 189 N ILE A 108 -9.072 58.601 113.358 1.00 14.27 -ATOM 190 CA ILE A 108 -8.256 57.451 113.029 1.00 13.04 -ATOM 191 C ILE A 108 -6.905 57.517 113.730 1.00 13.67 -ATOM 192 O ILE A 108 -6.420 56.519 114.255 1.00 11.98 -ATOM 193 CB ILE A 108 -8.052 57.377 111.502 1.00 13.65 -ATOM 194 CG1 ILE A 108 -9.407 57.168 110.819 1.00 13.81 -ATOM 195 CG2 ILE A 108 -7.096 56.256 111.146 1.00 13.28 -ATOM 196 CD1 ILE A 108 -9.343 57.167 109.300 1.00 13.22 -ATOM 197 N GLY A 109 -6.308 58.706 113.739 1.00 14.21 -ATOM 198 CA GLY A 109 -5.014 58.896 114.371 1.00 15.84 -ATOM 199 C GLY A 109 -4.987 58.579 115.860 1.00 16.48 -ATOM 200 O GLY A 109 -3.915 58.444 116.450 1.00 16.67 -ATOM 201 N SER A 110 -6.162 58.480 116.473 1.00 16.06 -ATOM 202 CA SER A 110 -6.251 58.155 117.884 1.00 16.27 -ATOM 203 C SER A 110 -5.436 56.890 118.108 1.00 15.55 -ATOM 204 O SER A 110 -4.780 56.734 119.137 1.00 14.14 -ATOM 205 CB SER A 110 -7.706 57.909 118.276 1.00 15.85 -ATOM 206 OG SER A 110 -7.838 57.664 119.669 1.00 18.13 -ATOM 207 N LYS A 111 -5.477 55.998 117.121 1.00 15.81 -ATOM 208 CA LYS A 111 -4.741 54.745 117.185 1.00 15.80 -ATOM 209 C LYS A 111 -3.734 54.559 116.047 1.00 16.01 -ATOM 210 O LYS A 111 -2.581 54.200 116.289 1.00 15.66 -ATOM 211 CB LYS A 111 -5.709 53.558 117.187 1.00 15.08 -ATOM 212 CG LYS A 111 -4.982 52.226 117.118 1.00 14.89 -ATOM 213 CD LYS A 111 -5.910 51.032 117.078 1.00 15.11 -ATOM 214 CE LYS A 111 -5.080 49.763 116.936 1.00 15.83 -ATOM 215 NZ LYS A 111 -5.884 48.611 116.462 1.00 18.51 -ATOM 216 N GLY A 112 -4.179 54.801 114.815 1.00 15.96 -ATOM 217 CA GLY A 112 -3.331 54.630 113.648 1.00 15.85 -ATOM 218 C GLY A 112 -2.126 55.547 113.553 1.00 17.80 -ATOM 219 O GLY A 112 -2.011 56.530 114.297 1.00 18.94 -ATOM 220 N ASP A 113 -1.217 55.223 112.638 1.00 16.57 -ATOM 221 CA ASP A 113 -0.023 56.025 112.446 1.00 16.98 -ATOM 222 C ASP A 113 -0.298 57.147 111.432 1.00 17.49 -ATOM 223 O ASP A 113 0.174 57.106 110.293 1.00 18.73 -ATOM 224 CB ASP A 113 1.129 55.141 111.960 1.00 17.33 -ATOM 225 CG ASP A 113 1.374 53.946 112.867 1.00 17.36 -ATOM 226 OD1 ASP A 113 1.422 54.126 114.102 1.00 18.85 -ATOM 227 OD2 ASP A 113 1.527 52.821 112.342 1.00 18.65 -ATOM 228 N VAL A 114 -1.064 58.144 111.868 1.00 16.14 -ATOM 229 CA VAL A 114 -1.443 59.295 111.046 1.00 15.92 -ATOM 230 C VAL A 114 -0.568 60.516 111.355 1.00 16.10 -ATOM 231 O VAL A 114 -0.405 60.875 112.520 1.00 17.40 -ATOM 232 CB VAL A 114 -2.909 59.696 111.320 1.00 15.02 -ATOM 233 CG1 VAL A 114 -3.301 60.874 110.451 1.00 16.47 -ATOM 234 CG2 VAL A 114 -3.822 58.525 111.075 1.00 13.66 -ATOM 235 N PHE A 115 -0.005 61.153 110.330 1.00 14.08 -ATOM 236 CA PHE A 115 0.820 62.338 110.565 1.00 13.37 -ATOM 237 C PHE A 115 -0.011 63.412 111.255 1.00 14.32 -ATOM 238 O PHE A 115 -1.235 63.375 111.227 1.00 13.85 -ATOM 239 CB PHE A 115 1.310 62.960 109.257 1.00 11.30 -ATOM 240 CG PHE A 115 2.461 62.253 108.624 1.00 12.01 -ATOM 241 CD1 PHE A 115 2.318 61.652 107.377 1.00 11.21 -ATOM 242 CD2 PHE A 115 3.709 62.238 109.240 1.00 11.72 -ATOM 243 CE1 PHE A 115 3.401 61.046 106.744 1.00 12.34 -ATOM 244 CE2 PHE A 115 4.804 61.634 108.617 1.00 11.24 -ATOM 245 CZ PHE A 115 4.649 61.038 107.365 1.00 11.63 -ATOM 246 N VAL A 116 0.671 64.355 111.893 1.00 14.38 -ATOM 247 CA VAL A 116 0.008 65.495 112.492 1.00 15.12 -ATOM 248 C VAL A 116 0.246 66.523 111.389 1.00 15.22 -ATOM 249 O VAL A 116 1.335 66.563 110.805 1.00 15.50 -ATOM 250 CB VAL A 116 0.692 65.952 113.794 1.00 16.30 -ATOM 251 CG1 VAL A 116 2.197 65.888 113.635 1.00 20.03 -ATOM 252 CG2 VAL A 116 0.261 67.380 114.129 1.00 13.51 -ATOM 253 N ILE A 117 -0.750 67.344 111.083 1.00 15.31 -ATOM 254 CA ILE A 117 -0.589 68.310 110.000 1.00 14.57 -ATOM 255 C ILE A 117 -1.445 69.564 110.118 1.00 13.57 -ATOM 256 O ILE A 117 -2.301 69.671 110.981 1.00 15.45 -ATOM 257 CB ILE A 117 -0.980 67.679 108.651 1.00 14.88 -ATOM 258 CG1 ILE A 117 -2.486 67.423 108.643 1.00 13.93 -ATOM 259 CG2 ILE A 117 -0.264 66.374 108.442 1.00 14.75 -ATOM 260 CD1 ILE A 117 -3.037 67.067 107.303 1.00 14.94 -ATOM 261 N ARG A 118 -1.201 70.490 109.200 1.00 11.73 -ATOM 262 CA ARG A 118 -1.945 71.736 109.070 1.00 12.45 -ATOM 263 C ARG A 118 -1.812 72.131 107.601 1.00 12.34 -ATOM 264 O ARG A 118 -1.036 71.528 106.856 1.00 12.14 -ATOM 265 CB ARG A 118 -1.358 72.856 109.932 1.00 13.80 -ATOM 266 CG ARG A 118 -1.832 72.927 111.373 1.00 16.79 -ATOM 267 CD ARG A 118 -3.322 73.221 111.525 1.00 18.17 -ATOM 268 NE ARG A 118 -3.815 74.351 110.729 1.00 22.44 -ATOM 269 CZ ARG A 118 -3.545 75.640 110.938 1.00 21.46 -ATOM 270 NH1 ARG A 118 -4.072 76.550 110.127 1.00 20.63 -ATOM 271 NH2 ARG A 118 -2.759 76.027 111.939 1.00 21.26 -ATOM 272 N GLU A 119 -2.567 73.142 107.191 1.00 10.70 -ATOM 273 CA GLU A 119 -2.518 73.632 105.829 1.00 10.49 -ATOM 274 C GLU A 119 -2.672 72.541 104.756 1.00 10.17 -ATOM 275 O GLU A 119 -1.805 72.360 103.907 1.00 9.01 -ATOM 276 CB GLU A 119 -1.207 74.404 105.608 1.00 11.76 -ATOM 277 CG GLU A 119 -0.942 75.589 106.564 1.00 13.65 -ATOM 278 CD GLU A 119 -0.349 75.185 107.924 1.00 15.97 -ATOM 279 OE1 GLU A 119 0.522 74.281 107.973 1.00 16.55 -ATOM 280 OE2 GLU A 119 -0.737 75.788 108.944 1.00 15.78 -ATOM 281 N PRO A 120 -3.782 71.791 104.787 1.00 10.69 -ATOM 282 CA PRO A 120 -3.985 70.747 103.783 1.00 11.04 -ATOM 283 C PRO A 120 -4.705 71.355 102.592 1.00 11.60 -ATOM 284 O PRO A 120 -5.366 72.386 102.719 1.00 13.09 -ATOM 285 CB PRO A 120 -4.882 69.763 104.507 1.00 10.05 -ATOM 286 CG PRO A 120 -5.804 70.688 105.220 1.00 9.70 -ATOM 287 CD PRO A 120 -4.823 71.702 105.826 1.00 11.40 -ATOM 288 N PHE A 121 -4.581 70.729 101.434 1.00 12.64 -ATOM 289 CA PHE A 121 -5.282 71.231 100.259 1.00 14.08 -ATOM 290 C PHE A 121 -5.328 70.173 99.177 1.00 14.60 -ATOM 291 O PHE A 121 -4.473 69.290 99.130 1.00 16.45 -ATOM 292 CB PHE A 121 -4.643 72.531 99.747 1.00 13.80 -ATOM 293 CG PHE A 121 -3.262 72.371 99.158 1.00 14.38 -ATOM 294 CD1 PHE A 121 -3.095 71.990 97.824 1.00 15.23 -ATOM 295 CD2 PHE A 121 -2.130 72.681 99.909 1.00 13.66 -ATOM 296 CE1 PHE A 121 -1.817 71.930 97.243 1.00 13.13 -ATOM 297 CE2 PHE A 121 -0.849 72.624 99.340 1.00 14.59 -ATOM 298 CZ PHE A 121 -0.695 72.248 98.002 1.00 13.42 -ATOM 299 N ILE A 122 -6.344 70.248 98.325 1.00 15.20 -ATOM 300 CA ILE A 122 -6.505 69.282 97.253 1.00 14.78 -ATOM 301 C ILE A 122 -6.142 69.885 95.915 1.00 14.81 -ATOM 302 O ILE A 122 -6.286 71.073 95.717 1.00 16.89 -ATOM 303 CB ILE A 122 -7.960 68.771 97.202 1.00 14.83 -ATOM 304 CG1 ILE A 122 -8.286 68.044 98.513 1.00 13.97 -ATOM 305 CG2 ILE A 122 -8.159 67.866 95.996 1.00 11.24 -ATOM 306 CD1 ILE A 122 -9.748 67.692 98.691 1.00 14.88 -ATOM 307 N SER A 123 -5.649 69.052 95.009 1.00 15.53 -ATOM 308 CA SER A 123 -5.282 69.483 93.668 1.00 14.96 -ATOM 309 C SER A 123 -5.404 68.267 92.763 1.00 14.76 -ATOM 310 O SER A 123 -5.152 67.151 93.205 1.00 14.69 -ATOM 311 CB SER A 123 -3.857 70.022 93.646 1.00 15.30 -ATOM 312 OG SER A 123 -3.563 70.560 92.373 1.00 18.23 -ATOM 313 N CYS A 124 -5.784 68.475 91.505 1.00 15.16 -ATOM 314 CA CYS A 124 -5.977 67.354 90.581 1.00 16.84 -ATOM 315 C CYS A 124 -5.188 67.445 89.274 1.00 16.83 -ATOM 316 O CYS A 124 -4.939 68.531 88.749 1.00 18.06 -ATOM 317 CB CYS A 124 -7.471 67.208 90.232 1.00 16.96 -ATOM 318 SG CYS A 124 -8.655 67.276 91.627 1.00 22.73 -ATOM 319 N SER A 125 -4.805 66.290 88.750 1.00 16.73 -ATOM 320 CA SER A 125 -4.076 66.215 87.488 1.00 17.78 -ATOM 321 C SER A 125 -5.138 65.903 86.446 1.00 19.79 -ATOM 322 O SER A 125 -6.319 66.178 86.658 1.00 20.56 -ATOM 323 CB SER A 125 -3.083 65.060 87.524 1.00 16.89 -ATOM 324 OG SER A 125 -3.779 63.823 87.611 1.00 16.11 -ATOM 325 N HIS A 126 -4.731 65.318 85.326 1.00 21.17 -ATOM 326 CA HIS A 126 -5.708 64.948 84.322 1.00 20.84 -ATOM 327 C HIS A 126 -6.220 63.547 84.638 1.00 21.27 -ATOM 328 O HIS A 126 -7.238 63.117 84.102 1.00 23.14 -ATOM 329 CB HIS A 126 -5.102 65.009 82.916 1.00 21.16 -ATOM 330 CG HIS A 126 -3.923 64.113 82.710 1.00 22.16 -ATOM 331 ND1 HIS A 126 -2.787 64.180 83.492 1.00 22.75 -ATOM 332 CD2 HIS A 126 -3.680 63.163 81.777 1.00 20.67 -ATOM 333 CE1 HIS A 126 -1.898 63.311 83.045 1.00 23.10 -ATOM 334 NE2 HIS A 126 -2.416 62.681 82.003 1.00 21.79 -ATOM 335 N LEU A 127 -5.544 62.847 85.545 1.00 20.68 -ATOM 336 CA LEU A 127 -5.957 61.491 85.897 1.00 20.77 -ATOM 337 C LEU A 127 -6.519 61.292 87.301 1.00 21.72 -ATOM 338 O LEU A 127 -7.474 60.529 87.476 1.00 22.12 -ATOM 339 CB LEU A 127 -4.791 60.528 85.713 1.00 19.06 -ATOM 340 CG LEU A 127 -4.171 60.495 84.317 1.00 20.69 -ATOM 341 CD1 LEU A 127 -2.973 59.561 84.353 1.00 21.10 -ATOM 342 CD2 LEU A 127 -5.192 60.034 83.270 1.00 15.04 -ATOM 343 N GLU A 128 -5.937 61.965 88.296 1.00 21.47 -ATOM 344 CA GLU A 128 -6.380 61.798 89.683 1.00 22.46 -ATOM 345 C GLU A 128 -6.322 63.080 90.521 1.00 21.54 -ATOM 346 O GLU A 128 -5.742 64.076 90.106 1.00 20.95 -ATOM 347 CB GLU A 128 -5.507 60.745 90.379 1.00 23.16 -ATOM 348 CG GLU A 128 -4.214 61.330 90.963 1.00 27.75 -ATOM 349 CD GLU A 128 -3.334 60.310 91.696 1.00 31.85 -ATOM 350 OE1 GLU A 128 -3.862 59.506 92.512 1.00 34.15 -ATOM 351 OE2 GLU A 128 -2.101 60.329 91.468 1.00 32.16 -ATOM 352 N CYS A 129 -6.915 63.028 91.713 1.00 20.84 -ATOM 353 CA CYS A 129 -6.901 64.151 92.649 1.00 21.08 -ATOM 354 C CYS A 129 -6.124 63.744 93.887 1.00 19.35 -ATOM 355 O CYS A 129 -6.320 62.651 94.413 1.00 19.42 -ATOM 356 CB CYS A 129 -8.309 64.547 93.094 1.00 22.09 -ATOM 357 SG CYS A 129 -9.358 65.356 91.843 1.00 28.57 -ATOM 358 N ARG A 130 -5.256 64.628 94.361 1.00 18.34 -ATOM 359 CA ARG A 130 -4.462 64.332 95.539 1.00 16.33 -ATOM 360 C ARG A 130 -4.642 65.369 96.630 1.00 16.35 -ATOM 361 O ARG A 130 -5.147 66.463 96.395 1.00 17.66 -ATOM 362 CB ARG A 130 -2.979 64.262 95.179 1.00 16.02 -ATOM 363 CG ARG A 130 -2.605 63.203 94.173 1.00 13.77 -ATOM 364 CD ARG A 130 -1.089 63.174 93.979 1.00 16.39 -ATOM 365 NE ARG A 130 -0.368 62.730 95.175 1.00 15.64 -ATOM 366 CZ ARG A 130 -0.365 61.478 95.622 1.00 16.75 -ATOM 367 NH1 ARG A 130 0.317 61.164 96.717 1.00 15.36 -ATOM 368 NH2 ARG A 130 -1.040 60.537 94.971 1.00 14.93 -ATOM 369 N THR A 131 -4.213 65.008 97.831 1.00 16.46 -ATOM 370 CA THR A 131 -4.277 65.896 98.980 1.00 15.45 -ATOM 371 C THR A 131 -2.852 66.156 99.436 1.00 14.12 -ATOM 372 O THR A 131 -2.120 65.224 99.759 1.00 14.28 -ATOM 373 CB THR A 131 -5.056 65.264 100.157 1.00 16.85 -ATOM 374 OG1 THR A 131 -6.395 64.974 99.741 1.00 19.90 -ATOM 375 CG2 THR A 131 -5.109 66.216 101.348 1.00 13.61 -ATOM 376 N PHE A 132 -2.452 67.423 99.432 1.00 11.60 -ATOM 377 CA PHE A 132 -1.121 67.796 99.882 1.00 11.10 -ATOM 378 C PHE A 132 -1.286 68.330 101.293 1.00 12.34 -ATOM 379 O PHE A 132 -2.378 68.759 101.675 1.00 13.64 -ATOM 380 CB PHE A 132 -0.523 68.888 98.998 1.00 9.73 -ATOM 381 CG PHE A 132 -0.243 68.445 97.605 1.00 9.05 -ATOM 382 CD1 PHE A 132 -1.281 68.210 96.716 1.00 9.95 -ATOM 383 CD2 PHE A 132 1.063 68.219 97.190 1.00 10.02 -ATOM 384 CE1 PHE A 132 -1.024 67.751 95.433 1.00 11.72 -ATOM 385 CE2 PHE A 132 1.338 67.760 95.910 1.00 9.99 -ATOM 386 CZ PHE A 132 0.295 67.523 95.026 1.00 10.49 -ATOM 387 N PHE A 133 -0.212 68.309 102.068 1.00 11.56 -ATOM 388 CA PHE A 133 -0.275 68.811 103.434 1.00 12.76 -ATOM 389 C PHE A 133 1.109 69.042 103.991 1.00 12.54 -ATOM 390 O PHE A 133 2.084 68.514 103.475 1.00 14.92 -ATOM 391 CB PHE A 133 -1.036 67.818 104.316 1.00 13.40 -ATOM 392 CG PHE A 133 -0.623 66.396 104.107 1.00 12.74 -ATOM 393 CD1 PHE A 133 0.481 65.875 104.768 1.00 11.65 -ATOM 394 CD2 PHE A 133 -1.312 65.591 103.203 1.00 11.19 -ATOM 395 CE1 PHE A 133 0.896 64.574 104.532 1.00 11.99 -ATOM 396 CE2 PHE A 133 -0.906 64.284 102.959 1.00 9.08 -ATOM 397 CZ PHE A 133 0.197 63.775 103.621 1.00 10.66 -ATOM 398 N LEU A 134 1.194 69.853 105.034 1.00 12.98 -ATOM 399 CA LEU A 134 2.471 70.122 105.663 1.00 13.35 -ATOM 400 C LEU A 134 2.458 69.391 106.987 1.00 13.58 -ATOM 401 O LEU A 134 1.697 69.736 107.885 1.00 13.79 -ATOM 402 CB LEU A 134 2.664 71.623 105.878 1.00 14.01 -ATOM 403 CG LEU A 134 2.787 72.479 104.607 1.00 14.92 -ATOM 404 CD1 LEU A 134 2.923 73.941 104.989 1.00 16.45 -ATOM 405 CD2 LEU A 134 3.984 72.040 103.789 1.00 13.82 -ATOM 406 N THR A 135 3.287 68.365 107.099 1.00 13.16 -ATOM 407 CA THR A 135 3.346 67.591 108.325 1.00 14.13 -ATOM 408 C THR A 135 4.173 68.325 109.358 1.00 14.75 -ATOM 409 O THR A 135 4.788 69.348 109.070 1.00 15.08 -ATOM 410 CB THR A 135 4.041 66.242 108.125 1.00 14.70 -ATOM 411 OG1 THR A 135 5.457 66.461 108.073 1.00 13.58 -ATOM 412 CG2 THR A 135 3.575 65.567 106.838 1.00 14.11 -ATOM 413 N GLN A 136 4.189 67.773 110.564 1.00 15.42 -ATOM 414 CA GLN A 136 4.975 68.321 111.658 1.00 14.86 -ATOM 415 C GLN A 136 6.053 67.300 112.025 1.00 14.30 -ATOM 416 O GLN A 136 6.588 67.324 113.129 1.00 15.22 -ATOM 417 CB GLN A 136 4.084 68.610 112.867 1.00 15.30 -ATOM 418 CG GLN A 136 3.244 69.860 112.731 1.00 14.49 -ATOM 419 CD GLN A 136 4.069 71.114 112.869 1.00 14.17 -ATOM 420 OE1 GLN A 136 5.292 71.052 113.021 1.00 13.75 -ATOM 421 NE2 GLN A 136 3.409 72.266 112.817 1.00 13.78 -ATOM 422 N GLY A 137 6.352 66.397 111.093 1.00 12.52 -ATOM 423 CA GLY A 137 7.374 65.389 111.322 1.00 12.32 -ATOM 424 C GLY A 137 7.116 64.478 112.505 1.00 12.26 -ATOM 425 O GLY A 137 8.052 63.999 113.139 1.00 11.95 -ATOM 426 N ALA A 138 5.844 64.241 112.804 1.00 11.64 -ATOM 427 CA ALA A 138 5.469 63.384 113.917 1.00 12.14 -ATOM 428 C ALA A 138 4.072 62.821 113.715 1.00 12.16 -ATOM 429 O ALA A 138 3.336 63.234 112.816 1.00 13.25 -ATOM 430 CB ALA A 138 5.526 64.166 115.224 1.00 13.75 -ATOM 431 N LEU A 139 3.705 61.876 114.566 1.00 11.29 -ATOM 432 CA LEU A 139 2.401 61.252 114.472 1.00 10.17 -ATOM 433 C LEU A 139 1.505 61.676 115.624 1.00 10.47 -ATOM 434 O LEU A 139 1.989 62.142 116.659 1.00 10.95 -ATOM 435 CB LEU A 139 2.563 59.734 114.479 1.00 9.31 -ATOM 436 CG LEU A 139 3.488 59.151 113.411 1.00 9.14 -ATOM 437 CD1 LEU A 139 3.443 57.630 113.492 1.00 6.78 -ATOM 438 CD2 LEU A 139 3.056 59.631 112.027 1.00 9.30 -ATOM 439 N LEU A 140 0.197 61.518 115.438 1.00 9.18 -ATOM 440 CA LEU A 140 -0.757 61.856 116.477 1.00 10.38 -ATOM 441 C LEU A 140 -0.622 60.885 117.660 1.00 12.16 -ATOM 442 O LEU A 140 -0.257 59.728 117.478 1.00 10.42 -ATOM 443 CB LEU A 140 -2.180 61.798 115.920 1.00 8.34 -ATOM 444 CG LEU A 140 -2.610 62.960 115.023 1.00 6.62 -ATOM 445 CD1 LEU A 140 -3.965 62.667 114.402 1.00 5.72 -ATOM 446 CD2 LEU A 140 -2.661 64.229 115.837 1.00 6.32 -ATOM 447 N ASN A 141 -0.906 61.378 118.866 1.00 13.73 -ATOM 448 CA ASN A 141 -0.845 60.589 120.101 1.00 15.45 -ATOM 449 C ASN A 141 0.545 60.065 120.464 1.00 16.09 -ATOM 450 O ASN A 141 0.679 59.061 121.168 1.00 14.85 -ATOM 451 CB ASN A 141 -1.839 59.424 120.050 1.00 16.37 -ATOM 452 CG ASN A 141 -2.930 59.547 121.102 1.00 18.52 -ATOM 453 OD1 ASN A 141 -2.819 60.350 122.028 1.00 19.32 -ATOM 454 ND2 ASN A 141 -3.986 58.740 120.972 1.00 19.01 -ATOM 455 N ASP A 142 1.568 60.766 119.982 1.00 17.35 -ATOM 456 CA ASP A 142 2.967 60.443 120.260 1.00 16.99 -ATOM 457 C ASP A 142 3.572 61.678 120.916 1.00 17.21 -ATOM 458 O ASP A 142 3.108 62.789 120.679 1.00 16.10 -ATOM 459 CB ASP A 142 3.725 60.131 118.968 1.00 16.59 -ATOM 460 CG ASP A 142 5.212 59.950 119.202 1.00 19.46 -ATOM 461 OD1 ASP A 142 5.592 59.008 119.939 1.00 18.72 -ATOM 462 OD2 ASP A 142 5.999 60.757 118.658 1.00 19.65 -ATOM 463 N LYS A 143 4.599 61.501 121.742 1.00 17.87 -ATOM 464 CA LYS A 143 5.200 62.659 122.403 1.00 18.78 -ATOM 465 C LYS A 143 5.726 63.715 121.435 1.00 20.49 -ATOM 466 O LYS A 143 5.691 64.902 121.725 1.00 20.51 -ATOM 467 CB LYS A 143 6.327 62.234 123.346 1.00 18.10 -ATOM 468 CG LYS A 143 7.564 61.691 122.670 1.00 16.91 -ATOM 469 CD LYS A 143 8.563 61.357 123.750 1.00 17.38 -ATOM 470 CE LYS A 143 9.909 61.068 123.142 1.00 17.64 -ATOM 471 NZ LYS A 143 10.956 60.927 124.173 1.00 16.33 -ATOM 472 N HIS A 144 6.212 63.300 120.277 1.00 20.84 -ATOM 473 CA HIS A 144 6.745 64.284 119.342 1.00 21.75 -ATOM 474 C HIS A 144 5.720 65.188 118.708 1.00 22.31 -ATOM 475 O HIS A 144 6.039 66.040 117.883 1.00 21.29 -ATOM 476 CB HIS A 144 7.522 63.582 118.264 1.00 19.38 -ATOM 477 CG HIS A 144 8.702 62.849 118.796 1.00 19.76 -ATOM 478 ND1 HIS A 144 9.850 63.490 119.190 1.00 18.78 -ATOM 479 CD2 HIS A 144 8.887 61.536 119.060 1.00 19.56 -ATOM 480 CE1 HIS A 144 10.702 62.603 119.674 1.00 20.12 -ATOM 481 NE2 HIS A 144 10.140 61.412 119.606 1.00 20.06 -ATOM 482 N SER A 145 4.482 65.005 119.117 1.00 22.78 -ATOM 483 CA SER A 145 3.393 65.781 118.587 1.00 24.35 -ATOM 484 C SER A 145 3.206 66.993 119.468 1.00 25.73 -ATOM 485 O SER A 145 2.278 67.767 119.267 1.00 25.63 -ATOM 486 CB SER A 145 2.149 64.921 118.598 1.00 23.72 -ATOM 487 OG SER A 145 1.000 65.691 118.404 1.00 25.63 -ATOM 488 N ASN A 146 4.111 67.154 120.432 1.00 26.92 -ATOM 489 CA ASN A 146 4.051 68.255 121.377 1.00 29.14 -ATOM 490 C ASN A 146 3.702 69.619 120.769 1.00 31.40 -ATOM 491 O ASN A 146 2.719 69.733 120.046 1.00 35.76 -ATOM 492 CB ASN A 146 5.351 68.344 122.175 1.00 28.58 -ATOM 493 CG ASN A 146 5.105 68.729 123.617 1.00 28.25 -ATOM 494 OD1 ASN A 146 5.981 68.625 124.466 1.00 32.09 -ATOM 495 ND2 ASN A 146 3.898 69.177 123.898 1.00 28.39 -ATOM 496 N GLY A 147 4.479 70.656 121.060 1.00 29.48 -ATOM 497 CA GLY A 147 4.160 71.977 120.535 1.00 29.06 -ATOM 498 C GLY A 147 3.999 72.158 119.032 1.00 28.93 -ATOM 499 O GLY A 147 4.566 73.088 118.459 1.00 27.69 -ATOM 500 N THR A 148 3.214 71.293 118.398 1.00 28.93 -ATOM 501 CA THR A 148 2.984 71.349 116.960 1.00 30.72 -ATOM 502 C THR A 148 2.120 72.546 116.553 1.00 32.32 -ATOM 503 O THR A 148 1.466 72.550 115.510 1.00 32.96 -ATOM 504 CB THR A 148 2.345 70.037 116.469 1.00 29.97 -ATOM 505 OG1 THR A 148 1.276 69.664 117.342 1.00 27.37 -ATOM 506 CG2 THR A 148 3.379 68.930 116.451 1.00 29.61 -ATOM 507 N VAL A 149 2.146 73.576 117.385 1.00 34.07 -ATOM 508 CA VAL A 149 1.387 74.783 117.123 1.00 34.56 -ATOM 509 C VAL A 149 2.317 75.885 116.625 1.00 34.64 -ATOM 510 O VAL A 149 1.852 76.905 116.119 1.00 33.07 -ATOM 511 CB VAL A 149 0.707 75.278 118.403 1.00 35.42 -ATOM 512 CG1 VAL A 149 -0.421 76.236 118.065 1.00 35.39 -ATOM 513 CG2 VAL A 149 0.204 74.098 119.190 1.00 39.00 -ATOM 514 N LYS A 150 3.626 75.657 116.752 1.00 34.96 -ATOM 515 CA LYS A 150 4.654 76.635 116.376 1.00 36.65 -ATOM 516 C LYS A 150 4.674 77.225 114.962 1.00 36.13 -ATOM 517 O LYS A 150 5.222 78.317 114.767 1.00 38.05 -ATOM 518 CB LYS A 150 6.051 76.086 116.704 1.00 37.94 -ATOM 519 CG LYS A 150 6.377 74.755 116.046 1.00 42.58 -ATOM 520 CD LYS A 150 7.768 74.263 116.445 1.00 44.14 -ATOM 521 CE LYS A 150 8.019 72.834 115.965 1.00 43.96 -ATOM 522 NZ LYS A 150 9.401 72.384 116.297 1.00 44.57 -ATOM 523 N ASP A 151 4.092 76.533 113.988 1.00 32.40 -ATOM 524 CA ASP A 151 4.071 77.024 112.605 1.00 29.85 -ATOM 525 C ASP A 151 5.261 76.587 111.778 1.00 27.16 -ATOM 526 O ASP A 151 5.171 75.667 110.972 1.00 27.45 -ATOM 527 CB ASP A 151 4.028 78.552 112.528 1.00 30.57 -ATOM 528 CG ASP A 151 2.629 79.098 112.546 1.00 33.24 -ATOM 529 OD1 ASP A 151 1.773 78.515 111.854 1.00 34.72 -ATOM 530 OD2 ASP A 151 2.383 80.119 113.227 1.00 33.32 -ATOM 531 N ARG A 152 6.379 77.274 111.971 1.00 24.66 -ATOM 532 CA ARG A 152 7.587 76.992 111.207 1.00 23.84 -ATOM 533 C ARG A 152 8.675 76.252 111.995 1.00 23.80 -ATOM 534 O ARG A 152 8.967 76.574 113.151 1.00 25.22 -ATOM 535 CB ARG A 152 8.139 78.305 110.622 1.00 20.17 -ATOM 536 CG ARG A 152 7.115 79.092 109.788 1.00 18.08 -ATOM 537 CD ARG A 152 7.649 80.450 109.285 1.00 16.14 -ATOM 538 NE ARG A 152 7.933 81.440 110.330 1.00 11.59 -ATOM 539 CZ ARG A 152 7.027 81.994 111.136 1.00 11.15 -ATOM 540 NH1 ARG A 152 7.407 82.884 112.037 1.00 9.97 -ATOM 541 NH2 ARG A 152 5.749 81.660 111.056 1.00 9.14 -ATOM 542 N SER A 153 9.259 75.247 111.350 1.00 22.13 -ATOM 543 CA SER A 153 10.313 74.435 111.944 1.00 21.10 -ATOM 544 C SER A 153 11.014 73.629 110.850 1.00 20.20 -ATOM 545 O SER A 153 10.460 73.410 109.771 1.00 18.46 -ATOM 546 CB SER A 153 9.741 73.475 112.992 1.00 20.29 -ATOM 547 OG SER A 153 9.638 72.152 112.487 1.00 22.31 -ATOM 548 N PRO A 154 12.253 73.187 111.119 1.00 19.77 -ATOM 549 CA PRO A 154 13.078 72.400 110.193 1.00 19.09 -ATOM 550 C PRO A 154 12.494 71.030 109.842 1.00 19.97 -ATOM 551 O PRO A 154 12.870 70.440 108.830 1.00 21.37 -ATOM 552 CB PRO A 154 14.400 72.260 110.943 1.00 18.68 -ATOM 553 CG PRO A 154 14.458 73.501 111.773 1.00 20.13 -ATOM 554 CD PRO A 154 13.047 73.625 112.284 1.00 19.33 -ATOM 555 N HIS A 155 11.580 70.538 110.678 1.00 19.09 -ATOM 556 CA HIS A 155 10.965 69.219 110.496 1.00 19.11 -ATOM 557 C HIS A 155 9.682 69.227 109.677 1.00 19.11 -ATOM 558 O HIS A 155 9.126 68.177 109.361 1.00 20.75 -ATOM 559 CB HIS A 155 10.673 68.612 111.866 1.00 18.06 -ATOM 560 CG HIS A 155 11.810 68.741 112.825 1.00 16.37 -ATOM 561 ND1 HIS A 155 11.669 69.298 114.078 1.00 15.19 -ATOM 562 CD2 HIS A 155 13.120 68.427 112.697 1.00 15.11 -ATOM 563 CE1 HIS A 155 12.844 69.326 114.679 1.00 14.48 -ATOM 564 NE2 HIS A 155 13.742 68.804 113.862 1.00 14.98 -ATOM 565 N ARG A 156 9.207 70.415 109.346 1.00 19.43 -ATOM 566 CA ARG A 156 7.985 70.572 108.571 1.00 19.90 -ATOM 567 C ARG A 156 8.232 70.072 107.131 1.00 18.64 -ATOM 568 O ARG A 156 9.210 70.470 106.497 1.00 18.36 -ATOM 569 CB ARG A 156 7.617 72.058 108.564 1.00 22.63 -ATOM 570 CG ARG A 156 6.164 72.385 108.712 1.00 24.33 -ATOM 571 CD ARG A 156 5.682 72.321 110.137 1.00 24.77 -ATOM 572 NE ARG A 156 4.238 72.086 110.131 1.00 28.72 -ATOM 573 CZ ARG A 156 3.330 72.984 109.768 1.00 28.59 -ATOM 574 NH1 ARG A 156 2.039 72.670 109.784 1.00 28.23 -ATOM 575 NH2 ARG A 156 3.710 74.203 109.415 1.00 31.69 -ATOM 576 N THR A 157 7.365 69.196 106.623 1.00 16.36 -ATOM 577 CA THR A 157 7.518 68.683 105.264 1.00 14.26 -ATOM 578 C THR A 157 6.207 68.588 104.490 1.00 14.29 -ATOM 579 O THR A 157 5.146 68.326 105.060 1.00 15.55 -ATOM 580 CB THR A 157 8.172 67.287 105.239 1.00 14.42 -ATOM 581 OG1 THR A 157 7.309 66.338 105.875 1.00 12.21 -ATOM 582 CG2 THR A 157 9.521 67.314 105.937 1.00 14.38 -ATOM 583 N LEU A 158 6.303 68.798 103.182 1.00 12.76 -ATOM 584 CA LEU A 158 5.163 68.748 102.275 1.00 11.52 -ATOM 585 C LEU A 158 5.029 67.345 101.708 1.00 12.41 -ATOM 586 O LEU A 158 5.946 66.839 101.060 1.00 12.17 -ATOM 587 CB LEU A 158 5.369 69.733 101.123 1.00 10.49 -ATOM 588 CG LEU A 158 4.335 69.698 100.002 1.00 9.44 -ATOM 589 CD1 LEU A 158 3.004 70.145 100.554 1.00 9.91 -ATOM 590 CD2 LEU A 158 4.767 70.595 98.855 1.00 9.64 -ATOM 591 N MET A 159 3.883 66.720 101.949 1.00 12.21 -ATOM 592 CA MET A 159 3.642 65.369 101.455 1.00 12.43 -ATOM 593 C MET A 159 2.235 65.263 100.883 1.00 12.54 -ATOM 594 O MET A 159 1.434 66.184 101.043 1.00 11.04 -ATOM 595 CB MET A 159 3.846 64.364 102.588 1.00 12.43 -ATOM 596 CG MET A 159 5.265 64.377 103.135 1.00 14.11 -ATOM 597 SD MET A 159 5.577 63.201 104.483 1.00 15.72 -ATOM 598 CE MET A 159 6.136 61.769 103.587 1.00 15.45 -ATOM 599 N SER A 160 1.934 64.152 100.211 1.00 12.65 -ATOM 600 CA SER A 160 0.607 63.976 99.623 1.00 13.42 -ATOM 601 C SER A 160 0.123 62.534 99.560 1.00 13.89 -ATOM 602 O SER A 160 0.909 61.596 99.607 1.00 16.26 -ATOM 603 CB SER A 160 0.567 64.576 98.208 1.00 14.35 -ATOM 604 OG SER A 160 1.421 63.880 97.308 1.00 13.57 -ATOM 605 N CYS A 161 -1.189 62.374 99.454 1.00 13.60 -ATOM 606 CA CYS A 161 -1.816 61.065 99.352 1.00 14.96 -ATOM 607 C CYS A 161 -3.140 61.245 98.626 1.00 13.94 -ATOM 608 O CYS A 161 -3.607 62.366 98.445 1.00 13.94 -ATOM 609 CB CYS A 161 -2.053 60.463 100.739 1.00 15.56 -ATOM 610 SG CYS A 161 -3.216 61.368 101.776 1.00 17.03 -ATOM 611 N PRO A 162 -3.751 60.149 98.172 1.00 14.12 -ATOM 612 CA PRO A 162 -5.031 60.299 97.468 1.00 15.73 -ATOM 613 C PRO A 162 -6.146 60.873 98.345 1.00 15.28 -ATOM 614 O PRO A 162 -6.218 60.586 99.541 1.00 16.13 -ATOM 615 CB PRO A 162 -5.324 58.876 96.966 1.00 14.12 -ATOM 616 CG PRO A 162 -4.534 58.006 97.875 1.00 14.50 -ATOM 617 CD PRO A 162 -3.256 58.770 98.068 1.00 14.22 -ATOM 618 N VAL A 163 -7.005 61.693 97.744 1.00 15.09 -ATOM 619 CA VAL A 163 -8.106 62.312 98.477 1.00 16.49 -ATOM 620 C VAL A 163 -8.956 61.327 99.265 1.00 16.24 -ATOM 621 O VAL A 163 -9.288 60.246 98.784 1.00 15.60 -ATOM 622 CB VAL A 163 -9.050 63.106 97.542 1.00 15.94 -ATOM 623 CG1 VAL A 163 -8.470 64.469 97.259 1.00 16.20 -ATOM 624 CG2 VAL A 163 -9.257 62.351 96.250 1.00 16.55 -ATOM 625 N GLY A 164 -9.303 61.716 100.485 1.00 15.93 -ATOM 626 CA GLY A 164 -10.128 60.872 101.328 1.00 16.32 -ATOM 627 C GLY A 164 -9.346 59.985 102.275 1.00 16.33 -ATOM 628 O GLY A 164 -9.886 59.512 103.280 1.00 15.96 -ATOM 629 N GLU A 165 -8.074 59.760 101.964 1.00 16.52 -ATOM 630 CA GLU A 165 -7.233 58.916 102.799 1.00 16.59 -ATOM 631 C GLU A 165 -6.550 59.699 103.912 1.00 16.59 -ATOM 632 O GLU A 165 -6.176 60.859 103.738 1.00 17.31 -ATOM 633 CB GLU A 165 -6.179 58.212 101.941 1.00 16.72 -ATOM 634 CG GLU A 165 -6.735 57.090 101.090 1.00 19.33 -ATOM 635 CD GLU A 165 -5.690 56.483 100.184 1.00 20.82 -ATOM 636 OE1 GLU A 165 -4.503 56.483 100.572 1.00 22.85 -ATOM 637 OE2 GLU A 165 -6.051 55.999 99.091 1.00 22.37 -ATOM 638 N ALA A 166 -6.401 59.065 105.065 1.00 16.31 -ATOM 639 CA ALA A 166 -5.740 59.712 106.189 1.00 17.13 -ATOM 640 C ALA A 166 -4.246 59.758 105.871 1.00 17.18 -ATOM 641 O ALA A 166 -3.673 58.768 105.432 1.00 16.83 -ATOM 642 CB ALA A 166 -5.984 58.921 107.470 1.00 14.37 -ATOM 643 N PRO A 167 -3.601 60.916 106.072 1.00 18.06 -ATOM 644 CA PRO A 167 -2.167 61.033 105.791 1.00 18.13 -ATOM 645 C PRO A 167 -1.329 60.210 106.770 1.00 18.51 -ATOM 646 O PRO A 167 -1.409 60.388 107.991 1.00 19.87 -ATOM 647 CB PRO A 167 -1.917 62.533 105.901 1.00 18.19 -ATOM 648 CG PRO A 167 -2.911 62.958 106.930 1.00 18.93 -ATOM 649 CD PRO A 167 -4.155 62.204 106.518 1.00 17.97 -ATOM 650 N SER A 168 -0.531 59.303 106.218 1.00 18.19 -ATOM 651 CA SER A 168 0.314 58.415 107.002 1.00 16.81 -ATOM 652 C SER A 168 1.625 58.155 106.283 1.00 17.05 -ATOM 653 O SER A 168 1.734 58.369 105.083 1.00 17.56 -ATOM 654 CB SER A 168 -0.416 57.093 107.225 1.00 17.20 -ATOM 655 OG SER A 168 0.484 56.000 107.223 1.00 17.34 -ATOM 656 N PRO A 169 2.645 57.687 107.017 1.00 17.76 -ATOM 657 CA PRO A 169 3.961 57.388 106.457 1.00 16.84 -ATOM 658 C PRO A 169 3.908 56.133 105.603 1.00 16.72 -ATOM 659 O PRO A 169 4.902 55.736 104.994 1.00 19.79 -ATOM 660 CB PRO A 169 4.810 57.191 107.698 1.00 18.24 -ATOM 661 CG PRO A 169 3.834 56.543 108.644 1.00 18.22 -ATOM 662 CD PRO A 169 2.630 57.427 108.468 1.00 18.74 -ATOM 663 N TYR A 169A 2.737 55.514 105.558 1.00 14.35 -ATOM 664 CA TYR A 169A 2.552 54.291 104.802 1.00 13.55 -ATOM 665 C TYR A 169A 1.834 54.558 103.493 1.00 13.83 -ATOM 666 O TYR A 169A 1.915 53.766 102.560 1.00 13.20 -ATOM 667 CB TYR A 169A 1.748 53.287 105.636 1.00 11.83 -ATOM 668 CG TYR A 169A 2.282 53.094 107.044 1.00 13.24 -ATOM 669 CD1 TYR A 169A 1.422 52.747 108.091 1.00 13.30 -ATOM 670 CD2 TYR A 169A 3.640 53.285 107.340 1.00 11.45 -ATOM 671 CE1 TYR A 169A 1.892 52.603 109.389 1.00 11.97 -ATOM 672 CE2 TYR A 169A 4.118 53.142 108.634 1.00 10.85 -ATOM 673 CZ TYR A 169A 3.237 52.802 109.654 1.00 12.54 -ATOM 674 OH TYR A 169A 3.691 52.654 110.942 1.00 13.81 -ATOM 675 N ASN A 170 1.129 55.679 103.416 1.00 14.72 -ATOM 676 CA ASN A 170 0.392 55.996 102.204 1.00 14.49 -ATOM 677 C ASN A 170 0.765 57.346 101.605 1.00 14.78 -ATOM 678 O ASN A 170 0.175 57.760 100.609 1.00 15.13 -ATOM 679 CB ASN A 170 -1.114 55.950 102.497 1.00 13.54 -ATOM 680 CG ASN A 170 -1.639 57.229 103.140 1.00 14.47 -ATOM 681 OD1 ASN A 170 -0.953 57.881 103.915 1.00 12.69 -ATOM 682 ND2 ASN A 170 -2.880 57.574 102.825 1.00 16.36 -ATOM 683 N SER A 171 1.758 58.015 102.191 1.00 14.96 -ATOM 684 CA SER A 171 2.155 59.342 101.724 1.00 15.74 -ATOM 685 C SER A 171 3.406 59.482 100.877 1.00 16.29 -ATOM 686 O SER A 171 4.470 58.951 101.201 1.00 16.68 -ATOM 687 CB SER A 171 2.278 60.294 102.913 1.00 15.80 -ATOM 688 OG SER A 171 1.006 60.585 103.455 1.00 13.97 -ATOM 689 N ARG A 172 3.264 60.225 99.789 1.00 15.46 -ATOM 690 CA ARG A 172 4.375 60.488 98.898 1.00 15.65 -ATOM 691 C ARG A 172 5.103 61.709 99.443 1.00 14.88 -ATOM 692 O ARG A 172 4.458 62.670 99.857 1.00 15.76 -ATOM 693 CB ARG A 172 3.861 60.801 97.497 1.00 18.25 -ATOM 694 CG ARG A 172 4.953 61.282 96.557 1.00 24.32 -ATOM 695 CD ARG A 172 4.385 61.876 95.287 1.00 27.91 -ATOM 696 NE ARG A 172 3.642 60.907 94.489 1.00 31.75 -ATOM 697 CZ ARG A 172 2.870 61.250 93.461 1.00 35.48 -ATOM 698 NH1 ARG A 172 2.220 60.314 92.765 1.00 36.39 -ATOM 699 NH2 ARG A 172 2.735 62.539 93.137 1.00 36.25 -ATOM 700 N PHE A 173 6.431 61.680 99.464 1.00 13.97 -ATOM 701 CA PHE A 173 7.177 62.843 99.941 1.00 14.19 -ATOM 702 C PHE A 173 7.262 63.827 98.776 1.00 15.27 -ATOM 703 O PHE A 173 7.448 63.418 97.629 1.00 16.03 -ATOM 704 CB PHE A 173 8.593 62.477 100.378 1.00 11.87 -ATOM 705 CG PHE A 173 9.394 63.658 100.856 1.00 12.10 -ATOM 706 CD1 PHE A 173 9.288 64.107 102.172 1.00 12.60 -ATOM 707 CD2 PHE A 173 10.223 64.355 99.978 1.00 9.95 -ATOM 708 CE1 PHE A 173 10.001 65.241 102.606 1.00 12.52 -ATOM 709 CE2 PHE A 173 10.934 65.484 100.401 1.00 10.21 -ATOM 710 CZ PHE A 173 10.825 65.928 101.713 1.00 11.44 -ATOM 711 N GLU A 174 7.136 65.117 99.068 1.00 14.59 -ATOM 712 CA GLU A 174 7.180 66.126 98.026 1.00 15.86 -ATOM 713 C GLU A 174 8.316 67.129 98.207 1.00 16.68 -ATOM 714 O GLU A 174 9.098 67.364 97.280 1.00 16.53 -ATOM 715 CB GLU A 174 5.843 66.863 97.976 1.00 15.82 -ATOM 716 CG GLU A 174 4.637 65.944 97.799 1.00 19.64 -ATOM 717 CD GLU A 174 4.461 65.452 96.368 1.00 20.00 -ATOM 718 OE1 GLU A 174 3.522 64.663 96.116 1.00 20.92 -ATOM 719 OE2 GLU A 174 5.256 65.862 95.493 1.00 21.74 -ATOM 720 N SER A 175 8.414 67.720 99.395 1.00 15.95 -ATOM 721 CA SER A 175 9.463 68.702 99.638 1.00 16.43 -ATOM 722 C SER A 175 9.549 69.084 101.113 1.00 15.99 -ATOM 723 O SER A 175 8.646 68.774 101.887 1.00 16.16 -ATOM 724 CB SER A 175 9.192 69.953 98.787 1.00 15.73 -ATOM 725 OG SER A 175 10.357 70.750 98.652 1.00 18.70 -ATOM 726 N VAL A 176 10.646 69.733 101.504 1.00 14.56 -ATOM 727 CA VAL A 176 10.814 70.185 102.885 1.00 14.64 -ATOM 728 C VAL A 176 10.205 71.589 102.921 1.00 14.61 -ATOM 729 O VAL A 176 10.632 72.470 102.169 1.00 14.91 -ATOM 730 CB VAL A 176 12.305 70.277 103.290 1.00 14.07 -ATOM 731 CG1 VAL A 176 12.412 70.792 104.707 1.00 12.39 -ATOM 732 CG2 VAL A 176 12.987 68.908 103.162 1.00 12.09 -ATOM 733 N ALA A 177 9.206 71.805 103.774 1.00 13.74 -ATOM 734 CA ALA A 177 8.581 73.117 103.808 1.00 13.52 -ATOM 735 C ALA A 177 7.637 73.420 104.959 1.00 14.47 -ATOM 736 O ALA A 177 6.999 72.525 105.520 1.00 14.07 -ATOM 737 CB ALA A 177 7.841 73.336 102.512 1.00 13.42 -ATOM 738 N TRP A 178 7.552 74.701 105.301 1.00 12.76 -ATOM 739 CA TRP A 178 6.623 75.138 106.323 1.00 14.37 -ATOM 740 C TRP A 178 5.613 76.071 105.651 1.00 14.73 -ATOM 741 O TRP A 178 4.874 76.804 106.303 1.00 15.75 -ATOM 742 CB TRP A 178 7.330 75.819 107.519 1.00 15.18 -ATOM 743 CG TRP A 178 8.476 76.752 107.229 1.00 16.55 -ATOM 744 CD1 TRP A 178 9.800 76.525 107.488 1.00 17.15 -ATOM 745 CD2 TRP A 178 8.401 78.065 106.659 1.00 17.97 -ATOM 746 NE1 TRP A 178 10.553 77.611 107.116 1.00 17.58 -ATOM 747 CE2 TRP A 178 9.722 78.572 106.602 1.00 18.01 -ATOM 748 CE3 TRP A 178 7.349 78.863 106.186 1.00 17.54 -ATOM 749 CZ2 TRP A 178 10.019 79.841 106.091 1.00 16.69 -ATOM 750 CZ3 TRP A 178 7.645 80.125 105.673 1.00 18.26 -ATOM 751 CH2 TRP A 178 8.972 80.599 105.630 1.00 18.07 -ATOM 752 N SER A 179 5.594 76.018 104.323 1.00 15.21 -ATOM 753 CA SER A 179 4.683 76.811 103.502 1.00 14.69 -ATOM 754 C SER A 179 4.796 76.248 102.081 1.00 15.08 -ATOM 755 O SER A 179 5.909 76.085 101.576 1.00 16.07 -ATOM 756 CB SER A 179 5.091 78.287 103.528 1.00 14.20 -ATOM 757 OG SER A 179 4.072 79.110 102.984 1.00 12.31 -ATOM 758 N ALA A 180 3.663 75.957 101.436 1.00 14.15 -ATOM 759 CA ALA A 180 3.697 75.365 100.099 1.00 14.26 -ATOM 760 C ALA A 180 2.550 75.663 99.142 1.00 14.78 -ATOM 761 O ALA A 180 1.605 76.387 99.452 1.00 15.64 -ATOM 762 CB ALA A 180 3.833 73.860 100.224 1.00 14.35 -ATOM 763 N SER A 181 2.665 75.069 97.961 1.00 14.71 -ATOM 764 CA SER A 181 1.672 75.187 96.905 1.00 16.39 -ATOM 765 C SER A 181 2.019 74.110 95.893 1.00 17.26 -ATOM 766 O SER A 181 3.134 73.581 95.923 1.00 17.76 -ATOM 767 CB SER A 181 1.739 76.566 96.241 1.00 16.73 -ATOM 768 OG SER A 181 0.825 76.649 95.164 1.00 15.59 -ATOM 769 N ALA A 182 1.071 73.775 95.013 1.00 17.66 -ATOM 770 CA ALA A 182 1.300 72.762 93.979 1.00 16.85 -ATOM 771 C ALA A 182 0.155 72.692 92.979 1.00 16.50 -ATOM 772 O ALA A 182 -0.989 72.993 93.313 1.00 17.67 -ATOM 773 CB ALA A 182 1.506 71.398 94.618 1.00 16.60 -ATOM 774 N CYS A 183 0.478 72.308 91.747 1.00 16.55 -ATOM 775 CA CYS A 183 -0.517 72.163 90.681 1.00 17.23 -ATOM 776 C CYS A 183 0.039 71.295 89.557 1.00 16.74 -ATOM 777 O CYS A 183 1.255 71.215 89.377 1.00 16.65 -ATOM 778 CB CYS A 183 -0.942 73.534 90.133 1.00 18.35 -ATOM 779 SG CYS A 183 0.437 74.657 89.757 1.00 19.85 -ATOM 780 N HIS A 184 -0.856 70.630 88.827 1.00 16.65 -ATOM 781 CA HIS A 184 -0.480 69.751 87.714 1.00 16.62 -ATOM 782 C HIS A 184 -0.830 70.447 86.398 1.00 17.43 -ATOM 783 O HIS A 184 -1.959 70.901 86.224 1.00 17.68 -ATOM 784 CB HIS A 184 -1.235 68.421 87.825 1.00 15.68 -ATOM 785 CG HIS A 184 -0.647 67.316 86.995 1.00 15.85 -ATOM 786 ND1 HIS A 184 0.017 66.237 87.549 1.00 12.45 -ATOM 787 CD2 HIS A 184 -0.603 67.129 85.654 1.00 13.21 -ATOM 788 CE1 HIS A 184 0.441 65.442 86.587 1.00 12.37 -ATOM 789 NE2 HIS A 184 0.080 65.960 85.425 1.00 11.38 -ATOM 790 N ASP A 185 0.127 70.520 85.473 1.00 18.02 -ATOM 791 CA ASP A 185 -0.088 71.207 84.192 1.00 18.48 -ATOM 792 C ASP A 185 -0.532 70.324 83.040 1.00 18.85 -ATOM 793 O ASP A 185 -0.493 70.745 81.883 1.00 19.77 -ATOM 794 CB ASP A 185 1.188 71.927 83.758 1.00 18.12 -ATOM 795 CG ASP A 185 2.287 70.961 83.320 1.00 19.36 -ATOM 796 OD1 ASP A 185 2.087 69.727 83.403 1.00 22.51 -ATOM 797 OD2 ASP A 185 3.358 71.433 82.891 1.00 19.12 -ATOM 798 N GLY A 186 -0.946 69.104 83.345 1.00 19.50 -ATOM 799 CA GLY A 186 -1.363 68.196 82.292 1.00 19.99 -ATOM 800 C GLY A 186 -0.292 67.150 82.038 1.00 20.02 -ATOM 801 O GLY A 186 -0.596 66.033 81.623 1.00 19.56 -ATOM 802 N THR A 187 0.964 67.512 82.301 1.00 19.63 -ATOM 803 CA THR A 187 2.074 66.596 82.097 1.00 19.77 -ATOM 804 C THR A 187 2.663 66.112 83.430 1.00 20.52 -ATOM 805 O THR A 187 2.736 64.905 83.681 1.00 20.76 -ATOM 806 CB THR A 187 3.197 67.259 81.237 1.00 20.36 -ATOM 807 OG1 THR A 187 2.702 67.523 79.919 1.00 17.91 -ATOM 808 CG2 THR A 187 4.413 66.343 81.126 1.00 18.53 -ATOM 809 N SER A 188 3.090 67.041 84.282 1.00 19.43 -ATOM 810 CA SER A 188 3.674 66.654 85.561 1.00 18.54 -ATOM 811 C SER A 188 3.284 67.596 86.684 1.00 18.42 -ATOM 812 O SER A 188 2.775 68.705 86.452 1.00 17.95 -ATOM 813 CB SER A 188 5.200 66.605 85.460 1.00 20.57 -ATOM 814 OG SER A 188 5.733 67.884 85.167 1.00 20.00 -ATOM 815 N TRP A 189 3.542 67.140 87.906 1.00 16.60 -ATOM 816 CA TRP A 189 3.257 67.914 89.100 1.00 14.42 -ATOM 817 C TRP A 189 4.303 68.974 89.347 1.00 14.89 -ATOM 818 O TRP A 189 5.495 68.756 89.149 1.00 16.37 -ATOM 819 CB TRP A 189 3.205 67.024 90.345 1.00 11.76 -ATOM 820 CG TRP A 189 1.915 66.313 90.525 1.00 10.33 -ATOM 821 CD1 TRP A 189 1.665 65.014 90.248 1.00 7.66 -ATOM 822 CD2 TRP A 189 0.672 66.882 90.966 1.00 8.70 -ATOM 823 NE1 TRP A 189 0.345 64.726 90.481 1.00 12.11 -ATOM 824 CE2 TRP A 189 -0.290 65.856 90.924 1.00 8.28 -ATOM 825 CE3 TRP A 189 0.282 68.160 91.394 1.00 9.83 -ATOM 826 CZ2 TRP A 189 -1.628 66.062 91.285 1.00 8.52 -ATOM 827 CZ3 TRP A 189 -1.055 68.370 91.757 1.00 8.96 -ATOM 828 CH2 TRP A 189 -1.989 67.322 91.699 1.00 8.47 -ATOM 829 N LEU A 190 3.838 70.128 89.788 1.00 14.56 -ATOM 830 CA LEU A 190 4.714 71.224 90.136 1.00 13.95 -ATOM 831 C LEU A 190 4.485 71.440 91.626 1.00 13.37 -ATOM 832 O LEU A 190 3.357 71.685 92.048 1.00 13.74 -ATOM 833 CB LEU A 190 4.334 72.496 89.363 1.00 13.34 -ATOM 834 CG LEU A 190 4.723 73.824 90.028 1.00 14.53 -ATOM 835 CD1 LEU A 190 6.235 73.907 90.211 1.00 14.05 -ATOM 836 CD2 LEU A 190 4.230 74.980 89.185 1.00 14.25 -ATOM 837 N THR A 191 5.533 71.310 92.427 1.00 13.26 -ATOM 838 CA THR A 191 5.384 71.553 93.856 1.00 14.83 -ATOM 839 C THR A 191 6.250 72.741 94.247 1.00 14.74 -ATOM 840 O THR A 191 7.291 72.998 93.636 1.00 15.06 -ATOM 841 CB THR A 191 5.788 70.335 94.736 1.00 13.66 -ATOM 842 OG1 THR A 191 7.133 69.948 94.446 1.00 13.69 -ATOM 843 CG2 THR A 191 4.842 69.172 94.509 1.00 11.41 -ATOM 844 N ILE A 192 5.801 73.461 95.268 1.00 14.08 -ATOM 845 CA ILE A 192 6.501 74.629 95.772 1.00 13.48 -ATOM 846 C ILE A 192 6.616 74.520 97.293 1.00 14.02 -ATOM 847 O ILE A 192 5.610 74.515 98.008 1.00 13.60 -ATOM 848 CB ILE A 192 5.745 75.921 95.381 1.00 12.78 -ATOM 849 CG1 ILE A 192 5.768 76.094 93.859 1.00 12.04 -ATOM 850 CG2 ILE A 192 6.383 77.120 96.033 1.00 11.88 -ATOM 851 CD1 ILE A 192 4.840 77.168 93.345 1.00 9.66 -ATOM 852 N GLY A 193 7.855 74.418 97.772 1.00 14.28 -ATOM 853 CA GLY A 193 8.104 74.300 99.198 1.00 13.24 -ATOM 854 C GLY A 193 9.115 75.285 99.755 1.00 13.46 -ATOM 855 O GLY A 193 10.286 75.310 99.361 1.00 14.00 -ATOM 856 N ILE A 194 8.648 76.102 100.691 1.00 13.81 -ATOM 857 CA ILE A 194 9.479 77.111 101.332 1.00 13.65 -ATOM 858 C ILE A 194 10.003 76.612 102.678 1.00 14.57 -ATOM 859 O ILE A 194 9.253 76.050 103.482 1.00 14.81 -ATOM 860 CB ILE A 194 8.675 78.404 101.586 1.00 12.89 -ATOM 861 CG1 ILE A 194 8.058 78.899 100.280 1.00 11.80 -ATOM 862 CG2 ILE A 194 9.569 79.460 102.221 1.00 8.82 -ATOM 863 CD1 ILE A 194 7.137 80.090 100.455 1.00 11.28 -ATOM 864 N SER A 195 11.292 76.830 102.919 1.00 14.67 -ATOM 865 CA SER A 195 11.916 76.428 104.172 1.00 13.97 -ATOM 866 C SER A 195 13.059 77.403 104.489 1.00 13.92 -ATOM 867 O SER A 195 13.301 78.344 103.734 1.00 14.53 -ATOM 868 CB SER A 195 12.430 74.985 104.058 1.00 13.25 -ATOM 869 OG SER A 195 12.734 74.444 105.333 1.00 15.17 -ATOM 870 N GLY A 196 13.757 77.183 105.599 1.00 13.69 -ATOM 871 CA GLY A 196 14.849 78.066 105.965 1.00 13.88 -ATOM 872 C GLY A 196 14.416 79.048 107.034 1.00 14.64 -ATOM 873 O GLY A 196 13.262 79.015 107.452 1.00 16.74 -ATOM 874 N PRO A 197 15.304 79.947 107.486 1.00 14.34 -ATOM 875 CA PRO A 197 14.966 80.931 108.524 1.00 13.98 -ATOM 876 C PRO A 197 14.046 82.043 108.023 1.00 14.68 -ATOM 877 O PRO A 197 13.959 82.304 106.819 1.00 13.28 -ATOM 878 CB PRO A 197 16.332 81.454 108.948 1.00 13.21 -ATOM 879 CG PRO A 197 17.075 81.466 107.640 1.00 14.14 -ATOM 880 CD PRO A 197 16.691 80.129 107.019 1.00 14.10 -ATOM 881 N ASP A 198 13.370 82.707 108.951 1.00 14.35 -ATOM 882 CA ASP A 198 12.458 83.786 108.588 1.00 14.81 -ATOM 883 C ASP A 198 13.113 84.920 107.801 1.00 14.85 -ATOM 884 O ASP A 198 12.466 85.554 106.970 1.00 14.91 -ATOM 885 CB ASP A 198 11.792 84.346 109.841 1.00 14.02 -ATOM 886 CG ASP A 198 10.942 83.311 110.552 1.00 15.60 -ATOM 887 OD1 ASP A 198 10.681 82.252 109.945 1.00 14.62 -ATOM 888 OD2 ASP A 198 10.533 83.554 111.709 1.00 15.98 -ATOM 889 N ASN A 199 14.394 85.172 108.047 1.00 15.38 -ATOM 890 CA ASN A 199 15.086 86.242 107.347 1.00 15.07 -ATOM 891 C ASN A 199 15.774 85.858 106.042 1.00 15.78 -ATOM 892 O ASN A 199 16.567 86.643 105.526 1.00 17.47 -ATOM 893 CB ASN A 199 16.116 86.897 108.263 1.00 16.04 -ATOM 894 CG ASN A 199 17.181 85.929 108.717 1.00 16.30 -ATOM 895 OD1 ASN A 199 17.629 85.079 107.953 1.00 15.08 -ATOM 896 ND2 ASN A 199 17.600 86.061 109.962 1.00 16.62 -ATOM 897 N GLY A 200 15.496 84.670 105.508 1.00 15.75 -ATOM 898 CA GLY A 200 16.118 84.282 104.247 1.00 14.71 -ATOM 899 C GLY A 200 15.541 83.019 103.630 1.00 16.41 -ATOM 900 O GLY A 200 16.248 82.282 102.943 1.00 15.71 -ATOM 901 N ALA A 201 14.253 82.773 103.858 1.00 14.50 -ATOM 902 CA ALA A 201 13.607 81.576 103.346 1.00 14.60 -ATOM 903 C ALA A 201 13.690 81.441 101.826 1.00 15.35 -ATOM 904 O ALA A 201 13.641 82.428 101.097 1.00 14.62 -ATOM 905 CB ALA A 201 12.150 81.539 103.800 1.00 14.23 -ATOM 906 N VAL A 202 13.822 80.204 101.359 1.00 13.56 -ATOM 907 CA VAL A 202 13.904 79.937 99.937 1.00 16.11 -ATOM 908 C VAL A 202 12.898 78.880 99.510 1.00 16.30 -ATOM 909 O VAL A 202 12.806 77.807 100.114 1.00 16.24 -ATOM 910 CB VAL A 202 15.337 79.484 99.505 1.00 16.86 -ATOM 911 CG1 VAL A 202 15.984 78.673 100.597 1.00 20.69 -ATOM 912 CG2 VAL A 202 15.258 78.626 98.247 1.00 16.22 -ATOM 913 N ALA A 203 12.137 79.207 98.468 1.00 15.86 -ATOM 914 CA ALA A 203 11.141 78.297 97.926 1.00 16.91 -ATOM 915 C ALA A 203 11.836 77.430 96.897 1.00 16.41 -ATOM 916 O ALA A 203 12.491 77.943 95.997 1.00 18.30 -ATOM 917 CB ALA A 203 10.006 79.073 97.279 1.00 14.00 -ATOM 918 N VAL A 204 11.708 76.118 97.047 1.00 16.44 -ATOM 919 CA VAL A 204 12.330 75.182 96.122 1.00 16.22 -ATOM 920 C VAL A 204 11.241 74.630 95.219 1.00 16.64 -ATOM 921 O VAL A 204 10.335 73.958 95.693 1.00 18.11 -ATOM 922 CB VAL A 204 13.000 74.004 96.884 1.00 16.21 -ATOM 923 CG1 VAL A 204 13.651 73.044 95.893 1.00 16.33 -ATOM 924 CG2 VAL A 204 14.038 74.531 97.866 1.00 11.84 -ATOM 925 N LEU A 205 11.322 74.919 93.924 1.00 16.63 -ATOM 926 CA LEU A 205 10.320 74.437 92.980 1.00 16.67 -ATOM 927 C LEU A 205 10.752 73.115 92.388 1.00 17.74 -ATOM 928 O LEU A 205 11.932 72.923 92.077 1.00 18.84 -ATOM 929 CB LEU A 205 10.117 75.416 91.823 1.00 16.03 -ATOM 930 CG LEU A 205 9.851 76.900 92.058 1.00 17.28 -ATOM 931 CD1 LEU A 205 9.144 77.442 90.825 1.00 16.88 -ATOM 932 CD2 LEU A 205 9.008 77.124 93.275 1.00 16.63 -ATOM 933 N LYS A 206 9.798 72.203 92.224 1.00 16.47 -ATOM 934 CA LYS A 206 10.101 70.910 91.640 1.00 16.33 -ATOM 935 C LYS A 206 9.100 70.526 90.571 1.00 16.01 -ATOM 936 O LYS A 206 7.894 70.752 90.711 1.00 14.46 -ATOM 937 CB LYS A 206 10.107 69.811 92.698 1.00 17.02 -ATOM 938 CG LYS A 206 11.212 69.898 93.731 1.00 18.08 -ATOM 939 CD LYS A 206 11.089 68.734 94.695 1.00 17.22 -ATOM 940 CE LYS A 206 12.080 68.823 95.831 1.00 17.22 -ATOM 941 NZ LYS A 206 11.876 67.675 96.752 1.00 18.88 -ATOM 942 N TYR A 207 9.621 69.953 89.493 1.00 15.13 -ATOM 943 CA TYR A 207 8.790 69.475 88.411 1.00 15.30 -ATOM 944 C TYR A 207 9.071 67.973 88.417 1.00 17.12 -ATOM 945 O TYR A 207 10.227 67.548 88.380 1.00 18.83 -ATOM 946 CB TYR A 207 9.203 70.131 87.091 1.00 13.70 -ATOM 947 CG TYR A 207 8.162 70.025 85.997 1.00 12.91 -ATOM 948 CD1 TYR A 207 8.376 69.216 84.878 1.00 11.58 -ATOM 949 CD2 TYR A 207 6.955 70.730 86.081 1.00 10.05 -ATOM 950 CE1 TYR A 207 7.419 69.109 83.871 1.00 8.67 -ATOM 951 CE2 TYR A 207 5.994 70.627 85.079 1.00 8.71 -ATOM 952 CZ TYR A 207 6.234 69.813 83.980 1.00 9.88 -ATOM 953 OH TYR A 207 5.287 69.684 82.993 1.00 13.41 -ATOM 954 N ASN A 208 8.012 67.177 88.501 1.00 17.55 -ATOM 955 CA ASN A 208 8.119 65.721 88.556 1.00 17.60 -ATOM 956 C ASN A 208 9.107 65.258 89.625 1.00 16.90 -ATOM 957 O ASN A 208 9.823 64.276 89.437 1.00 16.39 -ATOM 958 CB ASN A 208 8.521 65.132 87.201 1.00 18.87 -ATOM 959 CG ASN A 208 7.825 63.797 86.920 1.00 21.68 -ATOM 960 OD1 ASN A 208 7.767 62.911 87.779 1.00 19.65 -ATOM 961 ND2 ASN A 208 7.288 63.653 85.710 1.00 25.42 -ATOM 962 N GLY A 209 9.150 65.975 90.744 1.00 15.89 -ATOM 963 CA GLY A 209 10.039 65.596 91.830 1.00 16.40 -ATOM 964 C GLY A 209 11.485 66.053 91.757 1.00 16.90 -ATOM 965 O GLY A 209 12.258 65.781 92.672 1.00 16.45 -ATOM 966 N ILE A 210 11.865 66.731 90.677 1.00 16.86 -ATOM 967 CA ILE A 210 13.237 67.214 90.537 1.00 17.52 -ATOM 968 C ILE A 210 13.270 68.736 90.512 1.00 15.69 -ATOM 969 O ILE A 210 12.503 69.377 89.789 1.00 15.92 -ATOM 970 CB ILE A 210 13.921 66.647 89.259 1.00 18.33 -ATOM 971 CG1 ILE A 210 13.080 66.966 88.028 1.00 23.38 -ATOM 972 CG2 ILE A 210 14.068 65.136 89.380 1.00 19.17 -ATOM 973 CD1 ILE A 210 13.357 66.058 86.819 1.00 25.05 -ATOM 974 N ILE A 211 14.158 69.298 91.325 1.00 13.73 -ATOM 975 CA ILE A 211 14.318 70.742 91.439 1.00 14.42 -ATOM 976 C ILE A 211 14.547 71.441 90.090 1.00 14.33 -ATOM 977 O ILE A 211 15.494 71.116 89.375 1.00 12.95 -ATOM 978 CB ILE A 211 15.484 71.088 92.399 1.00 13.13 -ATOM 979 CG1 ILE A 211 15.191 70.522 93.796 1.00 12.89 -ATOM 980 CG2 ILE A 211 15.671 72.588 92.459 1.00 12.43 -ATOM 981 CD1 ILE A 211 16.200 70.899 94.862 1.00 12.42 -ATOM 982 N THR A 212 13.668 72.393 89.757 1.00 14.25 -ATOM 983 CA THR A 212 13.747 73.146 88.499 1.00 14.24 -ATOM 984 C THR A 212 14.023 74.647 88.677 1.00 16.12 -ATOM 985 O THR A 212 14.270 75.356 87.701 1.00 17.58 -ATOM 986 CB THR A 212 12.457 73.019 87.675 1.00 12.14 -ATOM 987 OG1 THR A 212 11.323 73.222 88.529 1.00 13.02 -ATOM 988 CG2 THR A 212 12.378 71.672 87.011 1.00 8.11 -ATOM 989 N ASP A 213 13.960 75.134 89.912 1.00 16.31 -ATOM 990 CA ASP A 213 14.237 76.537 90.177 1.00 18.02 -ATOM 991 C ASP A 213 14.207 76.844 91.667 1.00 18.66 -ATOM 992 O ASP A 213 13.748 76.039 92.465 1.00 18.52 -ATOM 993 CB ASP A 213 13.227 77.439 89.459 1.00 20.01 -ATOM 994 CG ASP A 213 13.772 78.839 89.221 1.00 21.40 -ATOM 995 OD1 ASP A 213 14.929 79.094 89.632 1.00 19.78 -ATOM 996 OD2 ASP A 213 13.057 79.674 88.617 1.00 21.95 -ATOM 997 N THR A 214 14.710 78.020 92.027 1.00 20.06 -ATOM 998 CA THR A 214 14.730 78.489 93.413 1.00 19.90 -ATOM 999 C THR A 214 14.381 79.979 93.466 1.00 19.53 -ATOM 1000 O THR A 214 14.735 80.734 92.569 1.00 19.00 -ATOM 1001 CB THR A 214 16.119 78.278 94.062 1.00 19.71 -ATOM 1002 OG1 THR A 214 16.133 77.034 94.772 1.00 19.73 -ATOM 1003 CG2 THR A 214 16.432 79.402 95.021 1.00 19.77 -ATOM 1004 N ILE A 215 13.682 80.387 94.521 1.00 20.02 -ATOM 1005 CA ILE A 215 13.297 81.781 94.708 1.00 19.70 -ATOM 1006 C ILE A 215 13.598 82.158 96.151 1.00 21.02 -ATOM 1007 O ILE A 215 12.970 81.630 97.070 1.00 20.95 -ATOM 1008 CB ILE A 215 11.795 81.976 94.477 1.00 20.44 -ATOM 1009 CG1 ILE A 215 11.398 81.396 93.115 1.00 20.30 -ATOM 1010 CG2 ILE A 215 11.444 83.456 94.560 1.00 18.77 -ATOM 1011 CD1 ILE A 215 9.894 81.275 92.921 1.00 21.91 -ATOM 1012 N LYS A 216 14.561 83.057 96.356 1.00 21.91 -ATOM 1013 CA LYS A 216 14.918 83.495 97.707 1.00 22.79 -ATOM 1014 C LYS A 216 14.113 84.713 98.133 1.00 21.11 -ATOM 1015 O LYS A 216 13.692 85.506 97.298 1.00 20.34 -ATOM 1016 CB LYS A 216 16.416 83.823 97.798 1.00 26.84 -ATOM 1017 CG LYS A 216 16.961 84.715 96.654 1.00 33.31 -ATOM 1018 CD LYS A 216 18.473 85.028 96.845 1.00 35.34 -ATOM 1019 CE LYS A 216 19.166 85.488 95.542 1.00 35.90 -ATOM 1020 NZ LYS A 216 19.311 84.392 94.514 1.00 34.35 -ATOM 1021 N SER A 217 13.897 84.840 99.440 1.00 21.03 -ATOM 1022 CA SER A 217 13.158 85.960 100.022 1.00 20.08 -ATOM 1023 C SER A 217 13.775 87.258 99.515 1.00 20.87 -ATOM 1024 O SER A 217 14.998 87.363 99.441 1.00 20.37 -ATOM 1025 CB SER A 217 13.260 85.900 101.549 1.00 19.57 -ATOM 1026 OG SER A 217 12.803 87.093 102.164 1.00 18.17 -ATOM 1027 N TRP A 218 12.940 88.239 99.169 1.00 20.53 -ATOM 1028 CA TRP A 218 13.439 89.518 98.658 1.00 21.29 -ATOM 1029 C TRP A 218 13.279 90.680 99.639 1.00 22.57 -ATOM 1030 O TRP A 218 13.714 91.806 99.359 1.00 23.16 -ATOM 1031 CB TRP A 218 12.764 89.857 97.323 1.00 19.09 -ATOM 1032 CG TRP A 218 11.284 90.047 97.405 1.00 19.09 -ATOM 1033 CD1 TRP A 218 10.623 91.201 97.682 1.00 18.47 -ATOM 1034 CD2 TRP A 218 10.275 89.043 97.206 1.00 17.64 -ATOM 1035 NE1 TRP A 218 9.263 90.987 97.665 1.00 18.95 -ATOM 1036 CE2 TRP A 218 9.023 89.670 97.377 1.00 17.86 -ATOM 1037 CE3 TRP A 218 10.311 87.676 96.900 1.00 17.01 -ATOM 1038 CZ2 TRP A 218 7.812 88.977 97.252 1.00 16.86 -ATOM 1039 CZ3 TRP A 218 9.113 86.989 96.775 1.00 16.49 -ATOM 1040 CH2 TRP A 218 7.876 87.644 96.951 1.00 17.12 -ATOM 1041 N ARG A 219 12.672 90.395 100.788 1.00 22.35 -ATOM 1042 CA ARG A 219 12.456 91.388 101.839 1.00 23.85 -ATOM 1043 C ARG A 219 12.930 90.827 103.180 1.00 23.12 -ATOM 1044 O ARG A 219 12.836 91.490 104.213 1.00 22.27 -ATOM 1045 CB ARG A 219 10.966 91.748 101.944 1.00 27.83 -ATOM 1046 CG ARG A 219 10.473 92.719 100.882 1.00 32.52 -ATOM 1047 CD ARG A 219 11.072 94.105 101.111 1.00 36.73 -ATOM 1048 NE ARG A 219 10.860 94.981 99.962 1.00 42.65 -ATOM 1049 CZ ARG A 219 11.556 96.095 99.736 1.00 46.40 -ATOM 1050 NH1 ARG A 219 12.509 96.474 100.588 1.00 46.53 -ATOM 1051 NH2 ARG A 219 11.324 96.817 98.641 1.00 47.83 -ATOM 1052 N ASN A 220 13.424 89.594 103.155 1.00 22.06 -ATOM 1053 CA ASN A 220 13.913 88.927 104.356 1.00 21.70 -ATOM 1054 C ASN A 220 12.917 88.919 105.511 1.00 21.14 -ATOM 1055 O ASN A 220 13.292 89.170 106.654 1.00 21.07 -ATOM 1056 CB ASN A 220 15.212 89.571 104.843 1.00 22.13 -ATOM 1057 CG ASN A 220 16.327 89.484 103.826 1.00 22.35 -ATOM 1058 OD1 ASN A 220 16.275 88.695 102.876 1.00 24.78 -ATOM 1059 ND2 ASN A 220 17.354 90.287 104.027 1.00 21.25 -ATOM 1060 N ASN A 221 11.652 88.636 105.231 1.00 19.94 -ATOM 1061 CA ASN A 221 10.675 88.591 106.308 1.00 18.24 -ATOM 1062 C ASN A 221 9.594 87.539 106.067 1.00 18.45 -ATOM 1063 O ASN A 221 8.444 87.858 105.756 1.00 18.58 -ATOM 1064 CB ASN A 221 10.050 89.971 106.518 1.00 15.30 -ATOM 1065 CG ASN A 221 9.119 90.016 107.712 1.00 13.88 -ATOM 1066 OD1 ASN A 221 9.035 89.067 108.491 1.00 13.89 -ATOM 1067 ND2 ASN A 221 8.417 91.131 107.867 1.00 13.96 -ATOM 1068 N ILE A 222 10.001 86.281 106.213 1.00 17.92 -ATOM 1069 CA ILE A 222 9.132 85.122 106.062 1.00 17.46 -ATOM 1070 C ILE A 222 8.481 84.939 104.693 1.00 18.31 -ATOM 1071 O ILE A 222 7.258 85.065 104.564 1.00 19.09 -ATOM 1072 CB ILE A 222 8.024 85.142 107.135 1.00 17.38 -ATOM 1073 CG1 ILE A 222 8.653 85.375 108.510 1.00 17.48 -ATOM 1074 CG2 ILE A 222 7.265 83.814 107.148 1.00 16.00 -ATOM 1075 CD1 ILE A 222 7.642 85.457 109.633 1.00 17.28 -ATOM 1076 N LEU A 223 9.282 84.642 103.669 1.00 17.87 -ATOM 1077 CA LEU A 223 8.715 84.417 102.336 1.00 17.68 -ATOM 1078 C LEU A 223 7.676 83.307 102.493 1.00 16.86 -ATOM 1079 O LEU A 223 7.967 82.248 103.052 1.00 18.58 -ATOM 1080 CB LEU A 223 9.798 83.979 101.343 1.00 17.39 -ATOM 1081 CG LEU A 223 9.298 83.453 99.991 1.00 15.33 -ATOM 1082 CD1 LEU A 223 8.748 84.577 99.120 1.00 14.72 -ATOM 1083 CD2 LEU A 223 10.445 82.775 99.296 1.00 15.84 -ATOM 1084 N ARG A 224 6.466 83.555 102.013 1.00 16.16 -ATOM 1085 CA ARG A 224 5.386 82.589 102.141 1.00 15.25 -ATOM 1086 C ARG A 224 4.525 82.542 100.887 1.00 17.33 -ATOM 1087 O ARG A 224 4.617 83.427 100.026 1.00 17.63 -ATOM 1088 CB ARG A 224 4.534 82.931 103.368 1.00 15.94 -ATOM 1089 CG ARG A 224 4.292 84.431 103.591 1.00 13.60 -ATOM 1090 CD ARG A 224 3.724 84.711 104.991 1.00 13.60 -ATOM 1091 NE ARG A 224 3.363 86.117 105.180 1.00 14.30 -ATOM 1092 CZ ARG A 224 4.230 87.128 105.149 1.00 13.33 -ATOM 1093 NH1 ARG A 224 3.812 88.372 105.326 1.00 11.92 -ATOM 1094 NH2 ARG A 224 5.522 86.899 104.944 1.00 16.20 -ATOM 1095 N THR A 225 3.686 81.511 100.780 1.00 17.09 -ATOM 1096 CA THR A 225 2.850 81.366 99.599 1.00 16.04 -ATOM 1097 C THR A 225 1.401 80.912 99.853 1.00 15.72 -ATOM 1098 O THR A 225 0.877 81.042 100.963 1.00 15.84 -ATOM 1099 CB THR A 225 3.549 80.428 98.565 1.00 16.09 -ATOM 1100 OG1 THR A 225 2.916 80.567 97.288 1.00 16.81 -ATOM 1101 CG2 THR A 225 3.487 78.971 99.014 1.00 16.31 -ATOM 1102 N GLN A 226 0.779 80.366 98.812 1.00 14.72 -ATOM 1103 CA GLN A 226 -0.618 79.949 98.823 1.00 15.51 -ATOM 1104 C GLN A 226 -1.198 79.017 99.873 1.00 16.28 -ATOM 1105 O GLN A 226 -2.249 79.311 100.432 1.00 16.26 -ATOM 1106 CB GLN A 226 -0.987 79.379 97.462 1.00 15.49 -ATOM 1107 CG GLN A 226 -0.769 80.325 96.310 1.00 16.37 -ATOM 1108 CD GLN A 226 -1.419 79.815 95.044 1.00 18.64 -ATOM 1109 OE1 GLN A 226 -2.649 79.694 94.972 1.00 19.04 -ATOM 1110 NE2 GLN A 226 -0.603 79.500 94.039 1.00 17.39 -ATOM 1111 N GLU A 227 -0.546 77.889 100.125 1.00 16.63 -ATOM 1112 CA GLU A 227 -1.070 76.916 101.077 1.00 17.34 -ATOM 1113 C GLU A 227 -2.335 76.294 100.458 1.00 17.58 -ATOM 1114 O GLU A 227 -3.255 75.884 101.165 1.00 17.17 -ATOM 1115 CB GLU A 227 -1.394 77.577 102.431 1.00 18.30 -ATOM 1116 CG GLU A 227 -0.250 78.417 103.031 1.00 21.61 -ATOM 1117 CD GLU A 227 0.943 77.590 103.502 1.00 22.82 -ATOM 1118 OE1 GLU A 227 1.419 76.720 102.739 1.00 22.58 -ATOM 1119 OE2 GLU A 227 1.420 77.822 104.643 1.00 26.66 -ATOM 1120 N SER A 228 -2.364 76.266 99.120 1.00 18.04 -ATOM 1121 CA SER A 228 -3.443 75.673 98.314 1.00 17.11 -ATOM 1122 C SER A 228 -2.865 75.430 96.917 1.00 17.69 -ATOM 1123 O SER A 228 -1.654 75.523 96.732 1.00 18.70 -ATOM 1124 CB SER A 228 -4.702 76.562 98.243 1.00 15.77 -ATOM 1125 OG SER A 228 -4.458 77.845 97.713 1.00 16.72 -ATOM 1126 N GLU A 229 -3.702 75.133 95.931 1.00 17.57 -ATOM 1127 CA GLU A 229 -3.183 74.833 94.602 1.00 17.95 -ATOM 1128 C GLU A 229 -2.904 76.050 93.742 1.00 19.18 -ATOM 1129 O GLU A 229 -3.588 77.064 93.848 1.00 21.05 -ATOM 1130 CB GLU A 229 -4.145 73.905 93.843 1.00 17.55 -ATOM 1131 CG GLU A 229 -5.455 74.572 93.451 1.00 18.04 -ATOM 1132 CD GLU A 229 -6.276 73.790 92.417 1.00 21.04 -ATOM 1133 OE1 GLU A 229 -7.278 74.353 91.910 1.00 22.18 -ATOM 1134 OE2 GLU A 229 -5.937 72.624 92.107 1.00 19.92 -ATOM 1135 N CYS A 230 -1.879 75.944 92.899 1.00 18.58 -ATOM 1136 CA CYS A 230 -1.543 77.011 91.981 1.00 17.96 -ATOM 1137 C CYS A 230 -2.349 76.718 90.730 1.00 17.75 -ATOM 1138 O CYS A 230 -2.863 75.615 90.578 1.00 18.47 -ATOM 1139 CB CYS A 230 -0.043 77.035 91.666 1.00 19.57 -ATOM 1140 SG CYS A 230 0.860 75.448 91.577 1.00 20.47 -ATOM 1141 N ALA A 231 -2.467 77.688 89.834 1.00 16.75 -ATOM 1142 CA ALA A 231 -3.271 77.488 88.631 1.00 15.71 -ATOM 1143 C ALA A 231 -2.463 77.357 87.343 1.00 14.41 -ATOM 1144 O ALA A 231 -1.535 78.119 87.105 1.00 11.66 -ATOM 1145 CB ALA A 231 -4.288 78.625 88.503 1.00 13.01 -ATOM 1146 N CYS A 232 -2.821 76.390 86.508 1.00 15.49 -ATOM 1147 CA CYS A 232 -2.097 76.210 85.252 1.00 18.33 -ATOM 1148 C CYS A 232 -2.986 76.478 84.044 1.00 17.57 -ATOM 1149 O CYS A 232 -4.144 76.096 84.021 1.00 17.12 -ATOM 1150 CB CYS A 232 -1.511 74.794 85.155 1.00 19.17 -ATOM 1151 SG CYS A 232 -0.420 74.247 86.524 1.00 24.32 -ATOM 1152 N VAL A 233 -2.429 77.149 83.045 1.00 19.06 -ATOM 1153 CA VAL A 233 -3.152 77.462 81.815 1.00 19.04 -ATOM 1154 C VAL A 233 -2.256 77.314 80.591 1.00 19.53 -ATOM 1155 O VAL A 233 -1.123 77.794 80.585 1.00 20.82 -ATOM 1156 CB VAL A 233 -3.674 78.903 81.834 1.00 19.55 -ATOM 1157 CG1 VAL A 233 -4.174 79.289 80.452 1.00 20.27 -ATOM 1158 CG2 VAL A 233 -4.784 79.031 82.849 1.00 19.12 -ATOM 1159 N ASN A 234 -2.756 76.639 79.561 1.00 19.31 -ATOM 1160 CA ASN A 234 -2.002 76.471 78.317 1.00 18.99 -ATOM 1161 C ASN A 234 -0.517 76.146 78.509 1.00 18.57 -ATOM 1162 O ASN A 234 0.320 76.604 77.748 1.00 20.21 -ATOM 1163 CB ASN A 234 -2.184 77.747 77.460 1.00 20.56 -ATOM 1164 CG ASN A 234 -1.309 77.780 76.203 1.00 20.42 -ATOM 1165 OD1 ASN A 234 -1.147 76.777 75.504 1.00 19.14 -ATOM 1166 ND2 ASN A 234 -0.760 78.960 75.903 1.00 19.19 -ATOM 1167 N GLY A 235 -0.189 75.359 79.527 1.00 17.82 -ATOM 1168 CA GLY A 235 1.199 74.985 79.741 1.00 16.50 -ATOM 1169 C GLY A 235 1.986 75.832 80.723 1.00 17.60 -ATOM 1170 O GLY A 235 3.190 75.647 80.874 1.00 17.35 -ATOM 1171 N SER A 236 1.317 76.765 81.394 1.00 17.84 -ATOM 1172 CA SER A 236 1.990 77.626 82.365 1.00 16.59 -ATOM 1173 C SER A 236 1.208 77.613 83.672 1.00 17.57 -ATOM 1174 O SER A 236 -0.028 77.570 83.678 1.00 17.29 -ATOM 1175 CB SER A 236 2.075 79.060 81.847 1.00 13.78 -ATOM 1176 OG SER A 236 2.628 79.102 80.551 1.00 15.90 -ATOM 1177 N CYS A 237 1.928 77.645 84.783 1.00 17.52 -ATOM 1178 CA CYS A 237 1.283 77.647 86.082 1.00 18.25 -ATOM 1179 C CYS A 237 1.661 78.941 86.788 1.00 17.52 -ATOM 1180 O CYS A 237 2.790 79.412 86.668 1.00 19.08 -ATOM 1181 CB CYS A 237 1.722 76.425 86.881 1.00 18.69 -ATOM 1182 SG CYS A 237 1.471 74.843 86.006 1.00 24.99 -ATOM 1183 N PHE A 238 0.709 79.522 87.508 1.00 16.21 -ATOM 1184 CA PHE A 238 0.947 80.777 88.197 1.00 17.13 -ATOM 1185 C PHE A 238 0.657 80.673 89.692 1.00 18.10 -ATOM 1186 O PHE A 238 -0.274 79.977 90.117 1.00 17.83 -ATOM 1187 CB PHE A 238 0.070 81.886 87.606 1.00 18.08 -ATOM 1188 CG PHE A 238 0.034 81.915 86.104 1.00 17.47 -ATOM 1189 CD1 PHE A 238 -0.723 80.991 85.395 1.00 16.41 -ATOM 1190 CD2 PHE A 238 0.737 82.886 85.399 1.00 17.84 -ATOM 1191 CE1 PHE A 238 -0.783 81.031 84.011 1.00 16.39 -ATOM 1192 CE2 PHE A 238 0.686 82.938 84.015 1.00 17.48 -ATOM 1193 CZ PHE A 238 -0.078 82.006 83.317 1.00 18.09 -ATOM 1194 N THR A 239 1.450 81.383 90.485 1.00 17.33 -ATOM 1195 CA THR A 239 1.275 81.368 91.928 1.00 18.69 -ATOM 1196 C THR A 239 1.481 82.775 92.470 1.00 16.95 -ATOM 1197 O THR A 239 1.864 83.686 91.739 1.00 16.98 -ATOM 1198 CB THR A 239 2.296 80.406 92.589 1.00 19.82 -ATOM 1199 OG1 THR A 239 1.947 80.183 93.962 1.00 20.69 -ATOM 1200 CG2 THR A 239 3.694 80.996 92.515 1.00 20.11 -ATOM 1201 N VAL A 240 1.214 82.941 93.757 1.00 16.21 -ATOM 1202 CA VAL A 240 1.375 84.225 94.421 1.00 15.43 -ATOM 1203 C VAL A 240 2.209 84.019 95.682 1.00 16.34 -ATOM 1204 O VAL A 240 2.050 83.015 96.381 1.00 16.76 -ATOM 1205 CB VAL A 240 0.015 84.821 94.828 1.00 14.04 -ATOM 1206 CG1 VAL A 240 0.228 86.123 95.581 1.00 11.84 -ATOM 1207 CG2 VAL A 240 -0.851 85.040 93.597 1.00 12.13 -ATOM 1208 N MET A 241 3.105 84.961 95.957 1.00 16.27 -ATOM 1209 CA MET A 241 3.953 84.892 97.139 1.00 16.44 -ATOM 1210 C MET A 241 3.995 86.250 97.831 1.00 15.64 -ATOM 1211 O MET A 241 3.777 87.292 97.209 1.00 13.83 -ATOM 1212 CB MET A 241 5.380 84.451 96.774 1.00 16.12 -ATOM 1213 CG MET A 241 5.462 83.104 96.079 1.00 17.09 -ATOM 1214 SD MET A 241 7.139 82.417 96.050 1.00 19.59 -ATOM 1215 CE MET A 241 6.853 80.814 96.712 1.00 19.24 -ATOM 1216 N THR A 242 4.276 86.223 99.126 1.00 15.52 -ATOM 1217 CA THR A 242 4.334 87.431 99.928 1.00 17.74 -ATOM 1218 C THR A 242 5.589 87.429 100.784 1.00 19.29 -ATOM 1219 O THR A 242 6.012 86.387 101.291 1.00 20.92 -ATOM 1220 CB THR A 242 3.118 87.529 100.872 1.00 18.00 -ATOM 1221 OG1 THR A 242 1.920 87.654 100.099 1.00 16.57 -ATOM 1222 CG2 THR A 242 3.254 88.729 101.807 1.00 18.87 -ATOM 1223 N ASP A 243 6.185 88.602 100.938 1.00 20.13 -ATOM 1224 CA ASP A 243 7.375 88.755 101.755 1.00 20.39 -ATOM 1225 C ASP A 243 7.196 90.091 102.444 1.00 21.62 -ATOM 1226 O ASP A 243 6.955 91.116 101.796 1.00 22.88 -ATOM 1227 CB ASP A 243 8.631 88.754 100.881 1.00 20.85 -ATOM 1228 CG ASP A 243 9.893 88.397 101.660 1.00 20.14 -ATOM 1229 OD1 ASP A 243 10.912 88.088 101.008 1.00 18.95 -ATOM 1230 OD2 ASP A 243 9.869 88.428 102.913 1.00 19.21 -ATOM 1231 N GLY A 244 7.292 90.080 103.762 1.00 21.25 -ATOM 1232 CA GLY A 244 7.116 91.303 104.508 1.00 21.20 -ATOM 1233 C GLY A 244 6.270 91.037 105.738 1.00 21.87 -ATOM 1234 O GLY A 244 6.097 89.889 106.146 1.00 22.84 -ATOM 1235 N PRO A 245 5.729 92.088 106.358 1.00 21.51 -ATOM 1236 CA PRO A 245 4.901 91.946 107.560 1.00 20.46 -ATOM 1237 C PRO A 245 3.490 91.381 107.369 1.00 18.97 -ATOM 1238 O PRO A 245 2.806 91.699 106.395 1.00 18.63 -ATOM 1239 CB PRO A 245 4.849 93.375 108.120 1.00 20.01 -ATOM 1240 CG PRO A 245 6.088 94.021 107.572 1.00 21.17 -ATOM 1241 CD PRO A 245 6.121 93.495 106.159 1.00 22.47 -ATOM 1242 N SER A 246 3.068 90.537 108.305 1.00 16.47 -ATOM 1243 CA SER A 246 1.716 90.014 108.275 1.00 17.78 -ATOM 1244 C SER A 246 0.980 91.093 109.065 1.00 17.84 -ATOM 1245 O SER A 246 -0.235 91.062 109.243 1.00 17.71 -ATOM 1246 CB SER A 246 1.632 88.650 108.977 1.00 17.06 -ATOM 1247 OG SER A 246 2.086 88.686 110.319 1.00 17.05 -ATOM 1248 N ASN A 247 1.775 92.079 109.477 1.00 18.92 -ATOM 1249 CA ASN A 247 1.379 93.229 110.282 1.00 19.28 -ATOM 1250 C ASN A 247 0.971 94.522 109.551 1.00 19.62 -ATOM 1251 O ASN A 247 0.338 95.388 110.149 1.00 18.83 -ATOM 1252 CB ASN A 247 2.532 93.573 111.222 1.00 17.32 -ATOM 1253 CG ASN A 247 2.131 93.498 112.664 1.00 18.57 -ATOM 1254 OD1 ASN A 247 0.952 93.336 112.972 1.00 21.15 -ATOM 1255 ND2 ASN A 247 3.100 93.621 113.563 1.00 16.08 -ATOM 1256 N GLY A 248 1.367 94.673 108.288 1.00 19.48 -ATOM 1257 CA GLY A 248 1.038 95.873 107.537 1.00 18.63 -ATOM 1258 C GLY A 248 1.415 95.707 106.072 1.00 20.78 -ATOM 1259 O GLY A 248 1.420 94.579 105.561 1.00 19.82 -ATOM 1260 N GLN A 249 1.729 96.816 105.395 1.00 20.62 -ATOM 1261 CA GLN A 249 2.108 96.794 103.979 1.00 19.77 -ATOM 1262 C GLN A 249 3.204 95.767 103.722 1.00 19.68 -ATOM 1263 O GLN A 249 4.280 95.851 104.307 1.00 20.48 -ATOM 1264 CB GLN A 249 2.640 98.168 103.540 1.00 20.37 -ATOM 1265 CG GLN A 249 1.855 98.864 102.433 1.00 21.92 -ATOM 1266 CD GLN A 249 1.507 97.948 101.273 1.00 23.74 -ATOM 1267 OE1 GLN A 249 2.339 97.171 100.805 1.00 27.13 -ATOM 1268 NE2 GLN A 249 0.274 98.042 100.798 1.00 23.97 -ATOM 1269 N ALA A 250 2.942 94.807 102.844 1.00 18.79 -ATOM 1270 CA ALA A 250 3.944 93.799 102.512 1.00 17.00 -ATOM 1271 C ALA A 250 4.130 93.773 101.000 1.00 16.74 -ATOM 1272 O ALA A 250 3.350 94.378 100.269 1.00 17.10 -ATOM 1273 CB ALA A 250 3.515 92.434 103.017 1.00 16.68 -ATOM 1274 N SER A 251 5.162 93.078 100.533 1.00 15.85 -ATOM 1275 CA SER A 251 5.443 92.997 99.108 1.00 14.41 -ATOM 1276 C SER A 251 4.795 91.749 98.505 1.00 14.77 -ATOM 1277 O SER A 251 4.950 90.637 99.015 1.00 15.16 -ATOM 1278 CB SER A 251 6.962 92.992 98.877 1.00 15.66 -ATOM 1279 OG SER A 251 7.296 92.980 97.496 1.00 16.54 -ATOM 1280 N TYR A 252 4.070 91.943 97.411 1.00 14.28 -ATOM 1281 CA TYR A 252 3.385 90.849 96.746 1.00 14.04 -ATOM 1282 C TYR A 252 3.882 90.613 95.323 1.00 15.37 -ATOM 1283 O TYR A 252 4.092 91.559 94.556 1.00 17.17 -ATOM 1284 CB TYR A 252 1.888 91.138 96.720 1.00 12.14 -ATOM 1285 CG TYR A 252 1.416 91.819 97.973 1.00 12.56 -ATOM 1286 CD1 TYR A 252 1.040 93.159 97.964 1.00 10.94 -ATOM 1287 CD2 TYR A 252 1.411 91.141 99.193 1.00 13.62 -ATOM 1288 CE1 TYR A 252 0.678 93.810 99.143 1.00 11.43 -ATOM 1289 CE2 TYR A 252 1.051 91.784 100.374 1.00 13.38 -ATOM 1290 CZ TYR A 252 0.689 93.112 100.343 1.00 11.77 -ATOM 1291 OH TYR A 252 0.339 93.728 101.516 1.00 13.26 -ATOM 1292 N LYS A 253 4.048 89.344 94.964 1.00 15.35 -ATOM 1293 CA LYS A 253 4.506 88.997 93.628 1.00 15.47 -ATOM 1294 C LYS A 253 3.765 87.822 92.993 1.00 15.71 -ATOM 1295 O LYS A 253 3.369 86.872 93.671 1.00 15.63 -ATOM 1296 CB LYS A 253 5.997 88.672 93.650 1.00 16.29 -ATOM 1297 CG LYS A 253 6.906 89.824 93.993 1.00 16.45 -ATOM 1298 CD LYS A 253 8.328 89.408 93.716 1.00 18.46 -ATOM 1299 CE LYS A 253 9.331 90.478 94.091 1.00 19.78 -ATOM 1300 NZ LYS A 253 10.679 90.094 93.579 1.00 20.99 -ATOM 1301 N ILE A 254 3.594 87.902 91.678 1.00 15.00 -ATOM 1302 CA ILE A 254 2.945 86.851 90.900 1.00 16.74 -ATOM 1303 C ILE A 254 4.011 86.173 90.056 1.00 17.50 -ATOM 1304 O ILE A 254 4.766 86.841 89.346 1.00 16.97 -ATOM 1305 CB ILE A 254 1.918 87.403 89.921 1.00 17.38 -ATOM 1306 CG1 ILE A 254 0.695 87.927 90.660 1.00 19.83 -ATOM 1307 CG2 ILE A 254 1.527 86.318 88.949 1.00 19.77 -ATOM 1308 CD1 ILE A 254 -0.284 88.615 89.733 1.00 21.52 -ATOM 1309 N PHE A 255 4.071 84.849 90.112 1.00 17.67 -ATOM 1310 CA PHE A 255 5.063 84.141 89.325 1.00 16.41 -ATOM 1311 C PHE A 255 4.433 83.287 88.243 1.00 15.89 -ATOM 1312 O PHE A 255 3.390 82.674 88.444 1.00 16.19 -ATOM 1313 CB PHE A 255 5.942 83.274 90.227 1.00 17.18 -ATOM 1314 CG PHE A 255 6.676 84.048 91.287 1.00 16.90 -ATOM 1315 CD1 PHE A 255 6.007 84.518 92.414 1.00 18.38 -ATOM 1316 CD2 PHE A 255 8.036 84.306 91.162 1.00 17.18 -ATOM 1317 CE1 PHE A 255 6.687 85.233 93.405 1.00 17.18 -ATOM 1318 CE2 PHE A 255 8.721 85.018 92.143 1.00 16.39 -ATOM 1319 CZ PHE A 255 8.044 85.480 93.267 1.00 17.09 -ATOM 1320 N LYS A 256 5.064 83.288 87.075 1.00 16.28 -ATOM 1321 CA LYS A 256 4.609 82.491 85.944 1.00 15.77 -ATOM 1322 C LYS A 256 5.728 81.495 85.693 1.00 16.39 -ATOM 1323 O LYS A 256 6.895 81.881 85.604 1.00 18.78 -ATOM 1324 CB LYS A 256 4.409 83.351 84.700 1.00 14.02 -ATOM 1325 CG LYS A 256 4.025 82.521 83.485 1.00 14.64 -ATOM 1326 CD LYS A 256 4.015 83.319 82.198 1.00 14.42 -ATOM 1327 CE LYS A 256 3.668 82.419 81.034 1.00 15.57 -ATOM 1328 NZ LYS A 256 3.453 83.195 79.803 1.00 17.47 -ATOM 1329 N MET A 257 5.391 80.218 85.580 1.00 16.02 -ATOM 1330 CA MET A 257 6.423 79.217 85.367 1.00 16.13 -ATOM 1331 C MET A 257 6.076 78.169 84.338 1.00 15.67 -ATOM 1332 O MET A 257 4.905 77.886 84.090 1.00 15.76 -ATOM 1333 CB MET A 257 6.763 78.552 86.697 1.00 17.02 -ATOM 1334 CG MET A 257 5.651 78.663 87.693 1.00 19.14 -ATOM 1335 SD MET A 257 6.209 78.980 89.387 1.00 20.04 -ATOM 1336 CE MET A 257 4.666 78.803 90.187 1.00 18.42 -ATOM 1337 N GLU A 258 7.117 77.602 83.742 1.00 15.11 -ATOM 1338 CA GLU A 258 6.969 76.569 82.728 1.00 17.34 -ATOM 1339 C GLU A 258 7.953 75.437 83.034 1.00 17.75 -ATOM 1340 O GLU A 258 9.167 75.649 83.105 1.00 18.45 -ATOM 1341 CB GLU A 258 7.200 77.179 81.335 1.00 16.82 -ATOM 1342 CG GLU A 258 6.150 78.248 81.001 1.00 20.00 -ATOM 1343 CD GLU A 258 6.322 78.905 79.634 1.00 21.70 -ATOM 1344 OE1 GLU A 258 5.491 79.785 79.306 1.00 20.98 -ATOM 1345 OE2 GLU A 258 7.273 78.550 78.892 1.00 24.44 -ATOM 1346 N LYS A 259 7.407 74.239 83.230 1.00 18.65 -ATOM 1347 CA LYS A 259 8.181 73.053 83.574 1.00 18.46 -ATOM 1348 C LYS A 259 8.910 73.294 84.878 1.00 18.40 -ATOM 1349 O LYS A 259 10.021 72.802 85.080 1.00 18.47 -ATOM 1350 CB LYS A 259 9.192 72.721 82.491 1.00 20.45 -ATOM 1351 CG LYS A 259 8.591 72.421 81.147 1.00 23.51 -ATOM 1352 CD LYS A 259 9.701 72.020 80.189 1.00 26.95 -ATOM 1353 CE LYS A 259 9.295 72.236 78.735 1.00 29.70 -ATOM 1354 NZ LYS A 259 10.400 71.825 77.810 1.00 33.29 -ATOM 1355 N GLY A 260 8.287 74.080 85.751 1.00 18.13 -ATOM 1356 CA GLY A 260 8.873 74.372 87.047 1.00 17.29 -ATOM 1357 C GLY A 260 9.911 75.478 87.105 1.00 17.89 -ATOM 1358 O GLY A 260 10.545 75.677 88.140 1.00 18.33 -ATOM 1359 N LYS A 261 10.099 76.202 86.007 1.00 18.80 -ATOM 1360 CA LYS A 261 11.077 77.290 85.981 1.00 19.44 -ATOM 1361 C LYS A 261 10.370 78.640 85.841 1.00 17.56 -ATOM 1362 O LYS A 261 9.460 78.787 85.022 1.00 17.74 -ATOM 1363 CB LYS A 261 12.068 77.077 84.820 1.00 20.88 -ATOM 1364 CG LYS A 261 13.096 78.192 84.644 1.00 24.29 -ATOM 1365 CD LYS A 261 14.158 77.861 83.583 1.00 25.75 -ATOM 1366 CE LYS A 261 15.360 77.107 84.171 1.00 30.06 -ATOM 1367 NZ LYS A 261 15.102 75.659 84.558 1.00 30.49 -ATOM 1368 N VAL A 262 10.778 79.617 86.649 1.00 16.06 -ATOM 1369 CA VAL A 262 10.179 80.953 86.596 1.00 15.30 -ATOM 1370 C VAL A 262 10.578 81.648 85.292 1.00 15.37 -ATOM 1371 O VAL A 262 11.743 81.965 85.100 1.00 16.59 -ATOM 1372 CB VAL A 262 10.636 81.832 87.797 1.00 13.91 -ATOM 1373 CG1 VAL A 262 10.070 83.234 87.664 1.00 11.83 -ATOM 1374 CG2 VAL A 262 10.177 81.214 89.107 1.00 11.51 -ATOM 1375 N VAL A 263 9.613 81.869 84.401 1.00 14.98 -ATOM 1376 CA VAL A 263 9.881 82.519 83.113 1.00 16.11 -ATOM 1377 C VAL A 263 9.571 84.016 83.143 1.00 17.55 -ATOM 1378 O VAL A 263 10.046 84.771 82.288 1.00 18.00 -ATOM 1379 CB VAL A 263 9.071 81.867 81.956 1.00 15.38 -ATOM 1380 CG1 VAL A 263 9.633 80.500 81.634 1.00 14.63 -ATOM 1381 CG2 VAL A 263 7.604 81.745 82.346 1.00 13.23 -ATOM 1382 N LYS A 264 8.757 84.428 84.116 1.00 17.88 -ATOM 1383 CA LYS A 264 8.396 85.828 84.311 1.00 17.64 -ATOM 1384 C LYS A 264 7.827 86.029 85.699 1.00 18.40 -ATOM 1385 O LYS A 264 7.310 85.097 86.303 1.00 18.77 -ATOM 1386 CB LYS A 264 7.362 86.298 83.300 1.00 17.85 -ATOM 1387 CG LYS A 264 7.054 87.780 83.459 1.00 17.69 -ATOM 1388 CD LYS A 264 6.217 88.317 82.331 1.00 19.96 -ATOM 1389 CE LYS A 264 6.270 89.837 82.314 1.00 21.57 -ATOM 1390 NZ LYS A 264 5.504 90.403 81.165 1.00 24.30 -ATOM 1391 N SER A 265 7.920 87.255 86.199 1.00 19.91 -ATOM 1392 CA SER A 265 7.412 87.590 87.522 1.00 19.50 -ATOM 1393 C SER A 265 7.120 89.077 87.608 1.00 19.57 -ATOM 1394 O SER A 265 7.826 89.895 87.016 1.00 21.74 -ATOM 1395 CB SER A 265 8.445 87.242 88.585 1.00 20.27 -ATOM 1396 OG SER A 265 9.453 88.238 88.636 1.00 19.91 -ATOM 1397 N VAL A 266 6.088 89.432 88.359 1.00 18.91 -ATOM 1398 CA VAL A 266 5.728 90.830 88.520 1.00 17.61 -ATOM 1399 C VAL A 266 5.368 91.116 89.960 1.00 18.38 -ATOM 1400 O VAL A 266 4.799 90.264 90.645 1.00 17.12 -ATOM 1401 CB VAL A 266 4.524 91.201 87.652 1.00 18.22 -ATOM 1402 CG1 VAL A 266 4.139 92.639 87.910 1.00 17.04 -ATOM 1403 CG2 VAL A 266 4.851 90.977 86.181 1.00 18.53 -ATOM 1404 N GLU A 267 5.710 92.310 90.434 1.00 20.06 -ATOM 1405 CA GLU A 267 5.363 92.668 91.797 1.00 22.23 -ATOM 1406 C GLU A 267 4.155 93.570 91.736 1.00 22.36 -ATOM 1407 O GLU A 267 4.137 94.533 90.981 1.00 23.90 -ATOM 1408 CB GLU A 267 6.494 93.402 92.504 1.00 22.29 -ATOM 1409 CG GLU A 267 6.158 93.677 93.963 1.00 23.38 -ATOM 1410 CD GLU A 267 7.309 94.294 94.711 1.00 25.29 -ATOM 1411 OE1 GLU A 267 8.461 93.855 94.509 1.00 26.74 -ATOM 1412 OE2 GLU A 267 7.063 95.209 95.516 1.00 27.37 -ATOM 1413 N LEU A 268 3.142 93.252 92.529 1.00 22.34 -ATOM 1414 CA LEU A 268 1.935 94.050 92.538 1.00 22.47 -ATOM 1415 C LEU A 268 2.127 95.431 93.160 1.00 22.71 -ATOM 1416 O LEU A 268 2.804 95.605 94.183 1.00 21.44 -ATOM 1417 CB LEU A 268 0.822 93.308 93.278 1.00 22.51 -ATOM 1418 CG LEU A 268 0.406 91.946 92.711 1.00 22.16 -ATOM 1419 CD1 LEU A 268 -0.806 91.448 93.482 1.00 19.54 -ATOM 1420 CD2 LEU A 268 0.076 92.066 91.219 1.00 21.22 -ATOM 1421 N ASP A 269 1.526 96.412 92.505 1.00 23.65 -ATOM 1422 CA ASP A 269 1.552 97.788 92.958 1.00 23.74 -ATOM 1423 C ASP A 269 0.227 97.900 93.703 1.00 23.76 -ATOM 1424 O ASP A 269 -0.742 98.472 93.204 1.00 23.92 -ATOM 1425 CB ASP A 269 1.574 98.728 91.753 1.00 24.07 -ATOM 1426 CG ASP A 269 1.772 100.179 92.145 1.00 23.92 -ATOM 1427 OD1 ASP A 269 2.024 100.450 93.336 1.00 24.00 -ATOM 1428 OD2 ASP A 269 1.688 101.049 91.251 1.00 26.05 -ATOM 1429 N ALA A 270 0.191 97.323 94.896 1.00 23.43 -ATOM 1430 CA ALA A 270 -1.017 97.316 95.694 1.00 22.54 -ATOM 1431 C ALA A 270 -0.881 98.086 96.999 1.00 21.28 -ATOM 1432 O ALA A 270 -0.808 97.504 98.083 1.00 21.28 -ATOM 1433 CB ALA A 270 -1.429 95.878 95.973 1.00 23.08 -ATOM 1434 N PRO A 271 -0.828 99.414 96.916 1.00 19.82 -ATOM 1435 CA PRO A 271 -0.709 100.142 98.178 1.00 18.93 -ATOM 1436 C PRO A 271 -2.004 100.008 98.988 1.00 17.93 -ATOM 1437 O PRO A 271 -3.101 100.056 98.433 1.00 16.66 -ATOM 1438 CB PRO A 271 -0.429 101.573 97.721 1.00 19.07 -ATOM 1439 CG PRO A 271 -1.123 101.648 96.382 1.00 19.01 -ATOM 1440 CD PRO A 271 -0.743 100.325 95.761 1.00 19.84 -ATOM 1441 N ASN A 272 -1.853 99.823 100.297 1.00 18.05 -ATOM 1442 CA ASN A 272 -2.966 99.670 101.239 1.00 17.66 -ATOM 1443 C ASN A 272 -3.688 98.319 101.114 1.00 18.77 -ATOM 1444 O ASN A 272 -4.724 98.081 101.739 1.00 17.93 -ATOM 1445 CB ASN A 272 -3.959 100.824 101.085 1.00 15.09 -ATOM 1446 CG ASN A 272 -4.929 100.908 102.245 1.00 14.89 -ATOM 1447 OD1 ASN A 272 -4.531 100.839 103.404 1.00 12.31 -ATOM 1448 ND2 ASN A 272 -6.204 101.064 101.937 1.00 15.61 -ATOM 1449 N TYR A 273 -3.123 97.434 100.297 1.00 19.10 -ATOM 1450 CA TYR A 273 -3.671 96.098 100.106 1.00 18.81 -ATOM 1451 C TYR A 273 -2.814 95.114 100.909 1.00 18.33 -ATOM 1452 O TYR A 273 -1.695 95.439 101.299 1.00 16.95 -ATOM 1453 CB TYR A 273 -3.599 95.698 98.636 1.00 18.80 -ATOM 1454 CG TYR A 273 -4.723 96.190 97.771 1.00 18.77 -ATOM 1455 CD1 TYR A 273 -4.884 97.542 97.498 1.00 18.48 -ATOM 1456 CD2 TYR A 273 -5.598 95.283 97.166 1.00 19.28 -ATOM 1457 CE1 TYR A 273 -5.883 97.981 96.639 1.00 18.53 -ATOM 1458 CE2 TYR A 273 -6.594 95.708 96.309 1.00 17.62 -ATOM 1459 CZ TYR A 273 -6.731 97.054 96.048 1.00 18.72 -ATOM 1460 OH TYR A 273 -7.703 97.458 95.170 1.00 20.82 -ATOM 1461 N HIS A 274 -3.341 93.919 101.153 1.00 18.37 -ATOM 1462 CA HIS A 274 -2.586 92.887 101.861 1.00 18.21 -ATOM 1463 C HIS A 274 -3.000 91.542 101.301 1.00 18.35 -ATOM 1464 O HIS A 274 -4.185 91.201 101.309 1.00 17.69 -ATOM 1465 CB HIS A 274 -2.859 92.914 103.365 1.00 17.96 -ATOM 1466 CG HIS A 274 -1.788 92.256 104.181 1.00 18.41 -ATOM 1467 ND1 HIS A 274 -1.991 91.086 104.883 1.00 17.22 -ATOM 1468 CD2 HIS A 274 -0.507 92.621 104.431 1.00 18.59 -ATOM 1469 CE1 HIS A 274 -0.887 90.766 105.532 1.00 16.76 -ATOM 1470 NE2 HIS A 274 0.031 91.681 105.275 1.00 17.51 -ATOM 1471 N TYR A 275 -2.024 90.789 100.803 1.00 18.22 -ATOM 1472 CA TYR A 275 -2.293 89.481 100.230 1.00 16.41 -ATOM 1473 C TYR A 275 -1.562 88.355 100.921 1.00 16.40 -ATOM 1474 O TYR A 275 -0.352 88.412 101.115 1.00 15.31 -ATOM 1475 CB TYR A 275 -1.915 89.443 98.750 1.00 17.39 -ATOM 1476 CG TYR A 275 -2.797 90.278 97.860 1.00 19.38 -ATOM 1477 CD1 TYR A 275 -2.401 91.544 97.442 1.00 19.77 -ATOM 1478 CD2 TYR A 275 -4.037 89.808 97.449 1.00 19.77 -ATOM 1479 CE1 TYR A 275 -3.224 92.321 96.631 1.00 20.45 -ATOM 1480 CE2 TYR A 275 -4.865 90.577 96.647 1.00 20.45 -ATOM 1481 CZ TYR A 275 -4.453 91.831 96.240 1.00 20.43 -ATOM 1482 OH TYR A 275 -5.279 92.587 95.444 1.00 22.17 -ATOM 1483 N GLU A 276 -2.309 87.317 101.276 1.00 17.45 -ATOM 1484 CA GLU A 276 -1.734 86.145 101.908 1.00 18.16 -ATOM 1485 C GLU A 276 -2.593 84.916 101.704 1.00 17.63 -ATOM 1486 O GLU A 276 -3.814 85.003 101.667 1.00 19.63 -ATOM 1487 CB GLU A 276 -1.493 86.397 103.401 1.00 19.83 -ATOM 1488 CG GLU A 276 0.003 86.550 103.701 1.00 24.91 -ATOM 1489 CD GLU A 276 0.290 87.481 104.851 1.00 26.23 -ATOM 1490 OE1 GLU A 276 1.470 87.656 105.200 1.00 27.86 -ATOM 1491 OE2 GLU A 276 -0.664 88.044 105.412 1.00 30.74 -ATOM 1492 N GLU A 277 -1.937 83.775 101.538 1.00 17.18 -ATOM 1493 CA GLU A 277 -2.619 82.508 101.349 1.00 15.52 -ATOM 1494 C GLU A 277 -3.742 82.577 100.317 1.00 16.08 -ATOM 1495 O GLU A 277 -4.887 82.209 100.593 1.00 17.71 -ATOM 1496 CB GLU A 277 -3.152 82.039 102.696 1.00 15.54 -ATOM 1497 CG GLU A 277 -2.106 82.140 103.796 1.00 14.26 -ATOM 1498 CD GLU A 277 -2.611 81.691 105.150 1.00 14.37 -ATOM 1499 OE1 GLU A 277 -3.804 81.900 105.446 1.00 15.24 -ATOM 1500 OE2 GLU A 277 -1.810 81.145 105.927 1.00 15.56 -ATOM 1501 N CYS A 278 -3.400 83.048 99.122 1.00 16.28 -ATOM 1502 CA CYS A 278 -4.352 83.162 98.022 1.00 15.76 -ATOM 1503 C CYS A 278 -4.822 81.818 97.492 1.00 15.62 -ATOM 1504 O CYS A 278 -4.075 80.838 97.473 1.00 15.51 -ATOM 1505 CB CYS A 278 -3.730 83.910 96.840 1.00 15.98 -ATOM 1506 SG CYS A 278 -3.392 85.668 97.129 1.00 18.94 -ATOM 1507 N SER A 279 -6.069 81.794 97.049 1.00 14.09 -ATOM 1508 CA SER A 279 -6.645 80.610 96.454 1.00 14.16 -ATOM 1509 C SER A 279 -6.870 81.054 95.013 1.00 14.41 -ATOM 1510 O SER A 279 -7.693 81.929 94.743 1.00 13.79 -ATOM 1511 CB SER A 279 -7.957 80.261 97.149 1.00 15.96 -ATOM 1512 OG SER A 279 -7.729 79.938 98.511 1.00 17.65 -ATOM 1513 N CYS A 280 -6.112 80.484 94.087 1.00 13.99 -ATOM 1514 CA CYS A 280 -6.240 80.893 92.696 1.00 14.62 -ATOM 1515 C CYS A 280 -6.788 79.819 91.778 1.00 15.94 -ATOM 1516 O CYS A 280 -6.360 78.671 91.822 1.00 16.02 -ATOM 1517 CB CYS A 280 -4.894 81.338 92.149 1.00 15.13 -ATOM 1518 SG CYS A 280 -3.970 82.597 93.092 1.00 16.83 -ATOM 1519 N TYR A 281 -7.738 80.204 90.935 1.00 16.95 -ATOM 1520 CA TYR A 281 -8.320 79.273 89.991 1.00 16.38 -ATOM 1521 C TYR A 281 -8.287 79.829 88.575 1.00 17.17 -ATOM 1522 O TYR A 281 -8.368 81.039 88.356 1.00 16.39 -ATOM 1523 CB TYR A 281 -9.769 78.935 90.369 1.00 15.76 -ATOM 1524 CG TYR A 281 -10.743 80.091 90.293 1.00 17.35 -ATOM 1525 CD1 TYR A 281 -11.004 80.886 91.409 1.00 18.39 -ATOM 1526 CD2 TYR A 281 -11.416 80.385 89.106 1.00 17.36 -ATOM 1527 CE1 TYR A 281 -11.918 81.946 91.342 1.00 18.30 -ATOM 1528 CE2 TYR A 281 -12.324 81.436 89.029 1.00 17.74 -ATOM 1529 CZ TYR A 281 -12.570 82.212 90.147 1.00 18.03 -ATOM 1530 OH TYR A 281 -13.458 83.257 90.060 1.00 18.79 -ATOM 1531 N PRO A 282 -8.151 78.938 87.588 1.00 18.77 -ATOM 1532 CA PRO A 282 -8.118 79.383 86.193 1.00 17.47 -ATOM 1533 C PRO A 282 -9.547 79.575 85.694 1.00 18.09 -ATOM 1534 O PRO A 282 -10.465 78.905 86.172 1.00 17.09 -ATOM 1535 CB PRO A 282 -7.399 78.234 85.488 1.00 18.10 -ATOM 1536 CG PRO A 282 -7.865 77.031 86.280 1.00 17.58 -ATOM 1537 CD PRO A 282 -7.783 77.514 87.708 1.00 16.47 -ATOM 1538 N ASN A 283 -9.727 80.501 84.750 1.00 18.47 -ATOM 1539 CA ASN A 283 -11.038 80.780 84.167 1.00 17.74 -ATOM 1540 C ASN A 283 -10.917 81.585 82.862 1.00 17.41 -ATOM 1541 O ASN A 283 -10.389 82.699 82.845 1.00 15.74 -ATOM 1542 CB ASN A 283 -11.930 81.520 85.179 1.00 19.18 -ATOM 1543 CG ASN A 283 -13.310 81.830 84.620 1.00 20.22 -ATOM 1544 OD1 ASN A 283 -13.495 82.823 83.918 1.00 22.25 -ATOM 1545 ND2 ASN A 283 -14.278 80.968 84.908 1.00 19.62 -ATOM 1546 N ALA A 284 -11.406 81.000 81.772 1.00 16.49 -ATOM 1547 CA ALA A 284 -11.352 81.631 80.461 1.00 16.58 -ATOM 1548 C ALA A 284 -9.943 82.124 80.114 1.00 16.81 -ATOM 1549 O ALA A 284 -9.762 83.247 79.638 1.00 16.92 -ATOM 1550 CB ALA A 284 -12.353 82.785 80.393 1.00 15.43 -ATOM 1551 N GLY A 285 -8.949 81.280 80.370 1.00 17.17 -ATOM 1552 CA GLY A 285 -7.571 81.617 80.052 1.00 18.52 -ATOM 1553 C GLY A 285 -6.827 82.563 80.976 1.00 20.18 -ATOM 1554 O GLY A 285 -5.684 82.926 80.689 1.00 21.24 -ATOM 1555 N GLU A 286 -7.454 82.959 82.079 1.00 20.52 -ATOM 1556 CA GLU A 286 -6.831 83.867 83.032 1.00 20.91 -ATOM 1557 C GLU A 286 -6.969 83.326 84.447 1.00 20.93 -ATOM 1558 O GLU A 286 -7.704 82.368 84.681 1.00 21.44 -ATOM 1559 CB GLU A 286 -7.478 85.245 82.926 1.00 23.35 -ATOM 1560 CG GLU A 286 -7.332 85.839 81.542 1.00 28.20 -ATOM 1561 CD GLU A 286 -7.936 87.223 81.417 1.00 30.02 -ATOM 1562 OE1 GLU A 286 -7.568 88.113 82.216 1.00 31.04 -ATOM 1563 OE2 GLU A 286 -8.773 87.422 80.510 1.00 31.75 -ATOM 1564 N ILE A 287 -6.273 83.948 85.393 1.00 19.37 -ATOM 1565 CA ILE A 287 -6.306 83.488 86.768 1.00 18.48 -ATOM 1566 C ILE A 287 -6.954 84.488 87.708 1.00 19.16 -ATOM 1567 O ILE A 287 -6.761 85.701 87.576 1.00 19.81 -ATOM 1568 CB ILE A 287 -4.879 83.184 87.283 1.00 18.70 -ATOM 1569 CG1 ILE A 287 -4.299 81.996 86.522 1.00 19.38 -ATOM 1570 CG2 ILE A 287 -4.903 82.862 88.776 1.00 18.59 -ATOM 1571 CD1 ILE A 287 -4.041 82.263 85.062 1.00 21.60 -ATOM 1572 N THR A 288 -7.722 83.966 88.660 1.00 17.27 -ATOM 1573 CA THR A 288 -8.389 84.787 89.660 1.00 15.45 -ATOM 1574 C THR A 288 -8.030 84.267 91.049 1.00 16.00 -ATOM 1575 O THR A 288 -8.109 83.065 91.318 1.00 15.30 -ATOM 1576 CB THR A 288 -9.909 84.725 89.510 1.00 14.52 -ATOM 1577 OG1 THR A 288 -10.267 85.106 88.181 1.00 15.99 -ATOM 1578 CG2 THR A 288 -10.581 85.663 90.505 1.00 13.45 -ATOM 1579 N CYS A 289 -7.634 85.172 91.930 1.00 15.73 -ATOM 1580 CA CYS A 289 -7.287 84.777 93.278 1.00 15.74 -ATOM 1581 C CYS A 289 -8.054 85.592 94.312 1.00 15.92 -ATOM 1582 O CYS A 289 -8.225 86.801 94.172 1.00 15.90 -ATOM 1583 CB CYS A 289 -5.798 84.976 93.541 1.00 17.68 -ATOM 1584 SG CYS A 289 -4.593 84.367 92.321 1.00 18.32 -ATOM 1585 N VAL A 290 -8.519 84.906 95.349 1.00 15.22 -ATOM 1586 CA VAL A 290 -9.220 85.531 96.458 1.00 14.10 -ATOM 1587 C VAL A 290 -8.328 85.108 97.609 1.00 15.24 -ATOM 1588 O VAL A 290 -8.080 83.922 97.801 1.00 15.10 -ATOM 1589 CB VAL A 290 -10.644 84.976 96.619 1.00 13.95 -ATOM 1590 CG1 VAL A 290 -11.262 85.470 97.924 1.00 12.44 -ATOM 1591 CG2 VAL A 290 -11.497 85.428 95.437 1.00 12.77 -ATOM 1592 N CYS A 291 -7.832 86.087 98.359 1.00 15.70 -ATOM 1593 CA CYS A 291 -6.898 85.823 99.432 1.00 14.63 -ATOM 1594 C CYS A 291 -7.319 86.302 100.803 1.00 15.19 -ATOM 1595 O CYS A 291 -8.461 86.680 101.029 1.00 13.69 -ATOM 1596 CB CYS A 291 -5.570 86.468 99.071 1.00 15.07 -ATOM 1597 SG CYS A 291 -5.257 86.491 97.276 1.00 16.85 -ATOM 1598 N ARG A 292 -6.349 86.301 101.710 1.00 15.88 -ATOM 1599 CA ARG A 292 -6.556 86.714 103.090 1.00 15.74 -ATOM 1600 C ARG A 292 -5.842 88.020 103.447 1.00 16.56 -ATOM 1601 O ARG A 292 -4.658 88.173 103.149 1.00 16.27 -ATOM 1602 CB ARG A 292 -6.055 85.603 104.011 1.00 14.39 -ATOM 1603 CG ARG A 292 -5.768 86.016 105.436 1.00 14.25 -ATOM 1604 CD ARG A 292 -5.104 84.856 106.154 1.00 15.20 -ATOM 1605 NE ARG A 292 -4.765 85.151 107.538 1.00 15.02 -ATOM 1606 CZ ARG A 292 -4.438 84.221 108.433 1.00 17.19 -ATOM 1607 NH1 ARG A 292 -4.135 84.568 109.686 1.00 14.78 -ATOM 1608 NH2 ARG A 292 -4.428 82.939 108.080 1.00 13.64 -ATOM 1609 N ASP A 293 -6.566 88.958 104.066 1.00 16.62 -ATOM 1610 CA ASP A 293 -5.974 90.225 104.515 1.00 17.40 -ATOM 1611 C ASP A 293 -5.850 90.113 106.037 1.00 17.07 -ATOM 1612 O ASP A 293 -6.847 90.190 106.784 1.00 17.74 -ATOM 1613 CB ASP A 293 -6.842 91.432 104.134 1.00 19.84 -ATOM 1614 CG ASP A 293 -6.264 92.758 104.645 1.00 22.07 -ATOM 1615 OD1 ASP A 293 -6.524 93.814 104.017 1.00 22.11 -ATOM 1616 OD2 ASP A 293 -5.561 92.747 105.684 1.00 21.93 -ATOM 1617 N ASN A 294 -4.611 89.920 106.477 1.00 15.19 -ATOM 1618 CA ASN A 294 -4.282 89.728 107.884 1.00 15.13 -ATOM 1619 C ASN A 294 -3.913 91.048 108.551 1.00 14.99 -ATOM 1620 O ASN A 294 -3.764 91.147 109.776 1.00 13.97 -ATOM 1621 CB ASN A 294 -3.103 88.752 107.978 1.00 14.01 -ATOM 1622 CG ASN A 294 -2.946 88.157 109.354 1.00 14.61 -ATOM 1623 OD1 ASN A 294 -3.820 87.434 109.825 1.00 14.78 -ATOM 1624 ND2 ASN A 294 -1.827 88.455 110.011 1.00 13.33 -ATOM 1625 N TRP A 295 -3.775 92.062 107.715 1.00 15.09 -ATOM 1626 CA TRP A 295 -3.389 93.384 108.152 1.00 14.75 -ATOM 1627 C TRP A 295 -4.528 94.226 108.725 1.00 15.69 -ATOM 1628 O TRP A 295 -4.571 94.494 109.930 1.00 13.11 -ATOM 1629 CB TRP A 295 -2.730 94.075 106.968 1.00 14.51 -ATOM 1630 CG TRP A 295 -2.400 95.504 107.142 1.00 14.23 -ATOM 1631 CD1 TRP A 295 -2.323 96.204 108.310 1.00 14.46 -ATOM 1632 CD2 TRP A 295 -2.060 96.417 106.102 1.00 13.53 -ATOM 1633 NE1 TRP A 295 -1.957 97.503 108.061 1.00 15.12 -ATOM 1634 CE2 TRP A 295 -1.788 97.662 106.708 1.00 15.21 -ATOM 1635 CE3 TRP A 295 -1.956 96.307 104.710 1.00 12.55 -ATOM 1636 CZ2 TRP A 295 -1.419 98.795 105.969 1.00 14.06 -ATOM 1637 CZ3 TRP A 295 -1.587 97.434 103.974 1.00 13.82 -ATOM 1638 CH2 TRP A 295 -1.325 98.661 104.608 1.00 13.31 -ATOM 1639 N HIS A 296 -5.460 94.612 107.860 1.00 16.92 -ATOM 1640 CA HIS A 296 -6.567 95.461 108.269 1.00 17.76 -ATOM 1641 C HIS A 296 -7.843 95.284 107.436 1.00 18.19 -ATOM 1642 O HIS A 296 -8.479 96.265 107.060 1.00 19.49 -ATOM 1643 CB HIS A 296 -6.102 96.920 108.197 1.00 19.33 -ATOM 1644 CG HIS A 296 -5.546 97.308 106.857 1.00 19.42 -ATOM 1645 ND1 HIS A 296 -5.721 96.542 105.729 1.00 21.58 -ATOM 1646 CD2 HIS A 296 -4.896 98.428 106.458 1.00 20.17 -ATOM 1647 CE1 HIS A 296 -5.208 97.174 104.682 1.00 19.36 -ATOM 1648 NE2 HIS A 296 -4.705 98.318 105.099 1.00 20.39 -ATOM 1649 N GLY A 297 -8.223 94.040 107.159 1.00 19.59 -ATOM 1650 CA GLY A 297 -9.414 93.798 106.360 1.00 18.92 -ATOM 1651 C GLY A 297 -10.291 92.629 106.789 1.00 20.10 -ATOM 1652 O GLY A 297 -9.803 91.521 107.020 1.00 20.07 -ATOM 1653 N SER A 298 -11.593 92.895 106.895 1.00 20.85 -ATOM 1654 CA SER A 298 -12.596 91.897 107.270 1.00 21.33 -ATOM 1655 C SER A 298 -13.129 91.202 106.020 1.00 21.13 -ATOM 1656 O SER A 298 -13.686 90.110 106.093 1.00 22.10 -ATOM 1657 CB SER A 298 -13.783 92.553 107.978 1.00 19.96 -ATOM 1658 OG SER A 298 -13.526 92.718 109.345 1.00 22.31 -ATOM 1659 N ASN A 299 -12.998 91.872 104.884 1.00 18.78 -ATOM 1660 CA ASN A 299 -13.450 91.325 103.616 1.00 18.07 -ATOM 1661 C ASN A 299 -12.224 90.775 102.880 1.00 17.38 -ATOM 1662 O ASN A 299 -11.090 91.035 103.281 1.00 17.23 -ATOM 1663 CB ASN A 299 -14.145 92.421 102.800 1.00 19.01 -ATOM 1664 CG ASN A 299 -13.326 93.700 102.716 1.00 19.50 -ATOM 1665 OD1 ASN A 299 -12.586 94.045 103.650 1.00 20.20 -ATOM 1666 ND2 ASN A 299 -13.471 94.423 101.608 1.00 17.42 -ATOM 1667 N ARG A 300 -12.439 90.025 101.806 1.00 15.65 -ATOM 1668 CA ARG A 300 -11.304 89.448 101.101 1.00 15.45 -ATOM 1669 C ARG A 300 -10.807 90.206 99.878 1.00 14.91 -ATOM 1670 O ARG A 300 -11.595 90.692 99.070 1.00 15.66 -ATOM 1671 CB ARG A 300 -11.605 87.988 100.726 1.00 13.13 -ATOM 1672 CG ARG A 300 -11.760 87.090 101.948 1.00 10.90 -ATOM 1673 CD ARG A 300 -11.649 85.611 101.610 1.00 12.43 -ATOM 1674 NE ARG A 300 -11.766 84.781 102.813 1.00 14.24 -ATOM 1675 CZ ARG A 300 -10.793 84.582 103.702 1.00 13.14 -ATOM 1676 NH1 ARG A 300 -11.014 83.818 104.766 1.00 12.19 -ATOM 1677 NH2 ARG A 300 -9.593 85.122 103.521 1.00 11.87 -ATOM 1678 N PRO A 301 -9.476 90.349 99.755 1.00 14.35 -ATOM 1679 CA PRO A 301 -8.868 91.045 98.617 1.00 15.33 -ATOM 1680 C PRO A 301 -8.702 90.066 97.450 1.00 15.66 -ATOM 1681 O PRO A 301 -8.688 88.851 97.656 1.00 15.46 -ATOM 1682 CB PRO A 301 -7.530 91.510 99.180 1.00 14.51 -ATOM 1683 CG PRO A 301 -7.174 90.386 100.114 1.00 14.76 -ATOM 1684 CD PRO A 301 -8.486 90.141 100.828 1.00 13.14 -ATOM 1685 N TRP A 302 -8.578 90.591 96.232 1.00 16.43 -ATOM 1686 CA TRP A 302 -8.415 89.739 95.053 1.00 16.39 -ATOM 1687 C TRP A 302 -7.460 90.270 93.985 1.00 16.05 -ATOM 1688 O TRP A 302 -7.142 91.459 93.938 1.00 16.92 -ATOM 1689 CB TRP A 302 -9.776 89.467 94.399 1.00 15.24 -ATOM 1690 CG TRP A 302 -10.526 90.701 93.936 1.00 15.15 -ATOM 1691 CD1 TRP A 302 -11.523 91.348 94.604 1.00 15.17 -ATOM 1692 CD2 TRP A 302 -10.393 91.376 92.675 1.00 14.38 -ATOM 1693 NE1 TRP A 302 -12.027 92.371 93.839 1.00 14.59 -ATOM 1694 CE2 TRP A 302 -11.353 92.412 92.649 1.00 13.94 -ATOM 1695 CE3 TRP A 302 -9.560 91.202 91.562 1.00 14.20 -ATOM 1696 CZ2 TRP A 302 -11.510 93.269 91.557 1.00 13.69 -ATOM 1697 CZ3 TRP A 302 -9.715 92.056 90.472 1.00 14.67 -ATOM 1698 CH2 TRP A 302 -10.687 93.076 90.482 1.00 14.11 -ATOM 1699 N VAL A 303 -7.008 89.367 93.125 1.00 15.50 -ATOM 1700 CA VAL A 303 -6.113 89.721 92.031 1.00 17.00 -ATOM 1701 C VAL A 303 -6.419 88.774 90.899 1.00 17.39 -ATOM 1702 O VAL A 303 -6.537 87.570 91.106 1.00 16.83 -ATOM 1703 CB VAL A 303 -4.615 89.500 92.346 1.00 17.21 -ATOM 1704 CG1 VAL A 303 -3.760 90.223 91.306 1.00 16.85 -ATOM 1705 CG2 VAL A 303 -4.288 89.959 93.711 1.00 18.65 -ATOM 1706 N SER A 304 -6.557 89.319 89.703 1.00 17.52 -ATOM 1707 CA SER A 304 -6.810 88.490 88.547 1.00 19.38 -ATOM 1708 C SER A 304 -5.774 88.965 87.555 1.00 19.75 -ATOM 1709 O SER A 304 -5.351 90.124 87.607 1.00 19.43 -ATOM 1710 CB SER A 304 -8.228 88.701 88.022 1.00 18.24 -ATOM 1711 OG SER A 304 -8.466 90.068 87.767 1.00 24.22 -ATOM 1712 N PHE A 305 -5.332 88.070 86.683 1.00 19.58 -ATOM 1713 CA PHE A 305 -4.327 88.442 85.709 1.00 21.72 -ATOM 1714 C PHE A 305 -4.279 87.521 84.503 1.00 23.12 -ATOM 1715 O PHE A 305 -4.718 86.375 84.566 1.00 24.34 -ATOM 1716 CB PHE A 305 -2.958 88.511 86.389 1.00 19.16 -ATOM 1717 CG PHE A 305 -2.617 87.296 87.200 1.00 17.70 -ATOM 1718 CD1 PHE A 305 -1.955 86.222 86.630 1.00 17.21 -ATOM 1719 CD2 PHE A 305 -2.941 87.239 88.549 1.00 18.41 -ATOM 1720 CE1 PHE A 305 -1.618 85.110 87.395 1.00 17.82 -ATOM 1721 CE2 PHE A 305 -2.608 86.132 89.320 1.00 17.71 -ATOM 1722 CZ PHE A 305 -1.944 85.069 88.742 1.00 16.47 -ATOM 1723 N ASN A 306 -3.751 88.056 83.407 1.00 24.71 -ATOM 1724 CA ASN A 306 -3.607 87.352 82.138 1.00 27.34 -ATOM 1725 C ASN A 306 -2.321 86.508 82.130 1.00 26.13 -ATOM 1726 O ASN A 306 -1.581 86.473 83.112 1.00 25.41 -ATOM 1727 CB ASN A 306 -3.582 88.396 81.008 1.00 32.70 -ATOM 1728 CG ASN A 306 -3.269 87.795 79.650 1.00 39.43 -ATOM 1729 OD1 ASN A 306 -3.695 86.666 79.324 1.00 43.18 -ATOM 1730 ND2 ASN A 306 -2.528 88.548 78.833 1.00 42.48 -ATOM 1731 N GLN A 308 -2.049 85.835 81.021 1.00 25.29 -ATOM 1732 CA GLN A 308 -0.859 85.010 80.925 1.00 25.40 -ATOM 1733 C GLN A 308 0.433 85.781 80.743 1.00 25.71 -ATOM 1734 O GLN A 308 1.484 85.179 80.539 1.00 27.13 -ATOM 1735 CB GLN A 308 -1.025 83.981 79.817 1.00 25.12 -ATOM 1736 CG GLN A 308 -1.873 82.817 80.276 1.00 25.67 -ATOM 1737 CD GLN A 308 -2.533 82.093 79.133 1.00 27.06 -ATOM 1738 OE1 GLN A 308 -1.863 81.514 78.274 1.00 26.71 -ATOM 1739 NE2 GLN A 308 -3.864 82.125 79.108 1.00 27.62 -ATOM 1740 N ASN A 309 0.348 87.108 80.809 1.00 25.55 -ATOM 1741 CA ASN A 309 1.521 87.966 80.723 1.00 25.28 -ATOM 1742 C ASN A 309 1.563 88.805 81.992 1.00 24.35 -ATOM 1743 O ASN A 309 2.109 89.907 82.011 1.00 24.01 -ATOM 1744 CB ASN A 309 1.464 88.879 79.503 1.00 29.15 -ATOM 1745 CG ASN A 309 1.753 88.144 78.227 1.00 32.68 -ATOM 1746 OD1 ASN A 309 2.818 87.519 78.081 1.00 35.07 -ATOM 1747 ND2 ASN A 309 0.810 88.199 77.285 1.00 33.77 -ATOM 1748 N LEU A 310 0.951 88.278 83.047 1.00 23.08 -ATOM 1749 CA LEU A 310 0.929 88.940 84.342 1.00 21.65 -ATOM 1750 C LEU A 310 0.387 90.370 84.343 1.00 21.38 -ATOM 1751 O LEU A 310 0.746 91.178 85.196 1.00 20.58 -ATOM 1752 CB LEU A 310 2.334 88.900 84.948 1.00 21.49 -ATOM 1753 CG LEU A 310 2.742 87.616 85.684 1.00 21.20 -ATOM 1754 CD1 LEU A 310 1.992 86.410 85.160 1.00 20.86 -ATOM 1755 CD2 LEU A 310 4.240 87.424 85.550 1.00 21.56 -ATOM 1756 N GLU A 311 -0.453 90.693 83.368 1.00 21.18 -ATOM 1757 CA GLU A 311 -1.081 92.001 83.340 1.00 20.87 -ATOM 1758 C GLU A 311 -2.211 91.719 84.323 1.00 20.55 -ATOM 1759 O GLU A 311 -2.943 90.736 84.161 1.00 19.65 -ATOM 1760 CB GLU A 311 -1.605 92.305 81.940 1.00 22.96 -ATOM 1761 CG GLU A 311 -0.491 92.357 80.915 1.00 27.26 -ATOM 1762 CD GLU A 311 -0.986 92.291 79.477 1.00 30.89 -ATOM 1763 OE1 GLU A 311 -1.760 91.363 79.144 1.00 34.30 -ATOM 1764 OE2 GLU A 311 -0.592 93.157 78.668 1.00 32.81 -ATOM 1765 N TYR A 312 -2.352 92.567 85.338 1.00 19.26 -ATOM 1766 CA TYR A 312 -3.338 92.330 86.383 1.00 18.85 -ATOM 1767 C TYR A 312 -4.286 93.458 86.796 1.00 19.80 -ATOM 1768 O TYR A 312 -4.181 94.601 86.358 1.00 20.05 -ATOM 1769 CB TYR A 312 -2.587 91.869 87.625 1.00 17.70 -ATOM 1770 CG TYR A 312 -1.670 92.951 88.166 1.00 16.10 -ATOM 1771 CD1 TYR A 312 -2.170 93.978 88.971 1.00 15.75 -ATOM 1772 CD2 TYR A 312 -0.325 92.992 87.812 1.00 15.39 -ATOM 1773 CE1 TYR A 312 -1.354 95.020 89.406 1.00 15.64 -ATOM 1774 CE2 TYR A 312 0.502 94.033 88.242 1.00 15.42 -ATOM 1775 CZ TYR A 312 -0.023 95.043 89.039 1.00 15.48 -ATOM 1776 OH TYR A 312 0.776 96.069 89.468 1.00 15.28 -ATOM 1777 N GLN A 313 -5.196 93.092 87.693 1.00 21.32 -ATOM 1778 CA GLN A 313 -6.195 93.987 88.268 1.00 22.33 -ATOM 1779 C GLN A 313 -6.398 93.518 89.701 1.00 20.79 -ATOM 1780 O GLN A 313 -6.397 92.317 89.974 1.00 20.50 -ATOM 1781 CB GLN A 313 -7.526 93.869 87.533 1.00 24.53 -ATOM 1782 CG GLN A 313 -7.513 94.345 86.102 1.00 28.85 -ATOM 1783 CD GLN A 313 -8.892 94.240 85.454 1.00 32.32 -ATOM 1784 OE1 GLN A 313 -9.095 94.683 84.321 1.00 35.54 -ATOM 1785 NE2 GLN A 313 -9.846 93.650 86.171 1.00 33.23 -ATOM 1786 N ILE A 314 -6.588 94.456 90.612 1.00 20.41 -ATOM 1787 CA ILE A 314 -6.789 94.105 92.011 1.00 20.02 -ATOM 1788 C ILE A 314 -8.100 94.679 92.533 1.00 20.42 -ATOM 1789 O ILE A 314 -8.746 95.477 91.866 1.00 21.39 -ATOM 1790 CB ILE A 314 -5.638 94.646 92.862 1.00 18.62 -ATOM 1791 CG1 ILE A 314 -5.457 96.140 92.573 1.00 18.32 -ATOM 1792 CG2 ILE A 314 -4.363 93.871 92.566 1.00 19.58 -ATOM 1793 CD1 ILE A 314 -4.252 96.785 93.248 1.00 16.62 -ATOM 1794 N GLY A 315 -8.485 94.264 93.733 1.00 20.83 -ATOM 1795 CA GLY A 315 -9.700 94.768 94.336 1.00 19.25 -ATOM 1796 C GLY A 315 -10.021 94.028 95.617 1.00 19.79 -ATOM 1797 O GLY A 315 -9.214 93.235 96.107 1.00 17.16 -ATOM 1798 N TYR A 316 -11.203 94.313 96.160 1.00 19.70 -ATOM 1799 CA TYR A 316 -11.698 93.669 97.368 1.00 20.21 -ATOM 1800 C TYR A 316 -13.152 93.275 97.071 1.00 20.84 -ATOM 1801 O TYR A 316 -13.847 93.961 96.313 1.00 22.32 -ATOM 1802 CB TYR A 316 -11.648 94.632 98.572 1.00 20.12 -ATOM 1803 CG TYR A 316 -10.339 94.656 99.356 1.00 20.35 -ATOM 1804 CD1 TYR A 316 -9.189 95.260 98.836 1.00 20.06 -ATOM 1805 CD2 TYR A 316 -10.254 94.076 100.627 1.00 19.46 -ATOM 1806 CE1 TYR A 316 -7.977 95.284 99.573 1.00 20.35 -ATOM 1807 CE2 TYR A 316 -9.056 94.091 101.368 1.00 19.43 -ATOM 1808 CZ TYR A 316 -7.921 94.693 100.839 1.00 19.85 -ATOM 1809 OH TYR A 316 -6.745 94.689 101.567 1.00 16.51 -ATOM 1810 N ILE A 317 -13.606 92.161 97.635 1.00 19.07 -ATOM 1811 CA ILE A 317 -14.982 91.728 97.431 1.00 17.54 -ATOM 1812 C ILE A 317 -15.822 92.749 98.183 1.00 17.68 -ATOM 1813 O ILE A 317 -15.615 92.973 99.382 1.00 18.06 -ATOM 1814 CB ILE A 317 -15.200 90.316 97.993 1.00 16.55 -ATOM 1815 CG1 ILE A 317 -14.337 89.320 97.202 1.00 16.27 -ATOM 1816 CG2 ILE A 317 -16.672 89.961 97.926 1.00 17.05 -ATOM 1817 CD1 ILE A 317 -14.373 87.897 97.716 1.00 14.15 -ATOM 1818 N CYS A 318 -16.769 93.360 97.481 1.00 17.55 -ATOM 1819 CA CYS A 318 -17.585 94.420 98.057 1.00 17.96 -ATOM 1820 C CYS A 318 -18.764 94.046 98.957 1.00 18.60 -ATOM 1821 O CYS A 318 -19.248 94.884 99.721 1.00 19.89 -ATOM 1822 CB CYS A 318 -18.092 95.327 96.937 1.00 19.47 -ATOM 1823 SG CYS A 318 -16.936 95.803 95.605 1.00 20.75 -ATOM 1824 N SER A 319 -19.219 92.800 98.873 1.00 18.21 -ATOM 1825 CA SER A 319 -20.355 92.305 99.649 1.00 17.20 -ATOM 1826 C SER A 319 -20.331 92.575 101.159 1.00 17.35 -ATOM 1827 O SER A 319 -19.296 92.470 101.811 1.00 16.66 -ATOM 1828 CB SER A 319 -20.498 90.794 99.414 1.00 17.64 -ATOM 1829 OG SER A 319 -21.642 90.254 100.053 1.00 16.88 -ATOM 1830 N GLY A 320 -21.493 92.921 101.705 1.00 18.21 -ATOM 1831 CA GLY A 320 -21.608 93.154 103.133 1.00 18.50 -ATOM 1832 C GLY A 320 -21.669 91.816 103.864 1.00 19.31 -ATOM 1833 O GLY A 320 -22.024 91.743 105.043 1.00 18.51 -ATOM 1834 N VAL A 321 -21.356 90.744 103.141 1.00 19.60 -ATOM 1835 CA VAL A 321 -21.334 89.399 103.711 1.00 19.60 -ATOM 1836 C VAL A 321 -19.856 89.131 103.834 1.00 19.42 -ATOM 1837 O VAL A 321 -19.255 88.465 102.998 1.00 19.91 -ATOM 1838 CB VAL A 321 -21.986 88.365 102.768 1.00 19.75 -ATOM 1839 CG1 VAL A 321 -21.932 86.966 103.389 1.00 18.97 -ATOM 1840 CG2 VAL A 321 -23.429 88.766 102.500 1.00 19.10 -ATOM 1841 N PHE A 322 -19.274 89.700 104.879 1.00 19.37 -ATOM 1842 CA PHE A 322 -17.846 89.598 105.126 1.00 19.61 -ATOM 1843 C PHE A 322 -17.342 88.160 105.165 1.00 19.69 -ATOM 1844 O PHE A 322 -17.880 87.321 105.903 1.00 20.23 -ATOM 1845 CB PHE A 322 -17.527 90.345 106.415 1.00 20.52 -ATOM 1846 CG PHE A 322 -18.082 91.744 106.444 1.00 20.88 -ATOM 1847 CD1 PHE A 322 -18.971 92.136 107.449 1.00 21.01 -ATOM 1848 CD2 PHE A 322 -17.722 92.670 105.467 1.00 20.09 -ATOM 1849 CE1 PHE A 322 -19.492 93.436 107.482 1.00 19.61 -ATOM 1850 CE2 PHE A 322 -18.235 93.970 105.486 1.00 19.22 -ATOM 1851 CZ PHE A 322 -19.121 94.353 106.497 1.00 20.99 -ATOM 1852 N GLY A 323 -16.296 87.891 104.383 1.00 18.32 -ATOM 1853 CA GLY A 323 -15.756 86.546 104.296 1.00 18.97 -ATOM 1854 C GLY A 323 -14.558 86.126 105.136 1.00 19.98 -ATOM 1855 O GLY A 323 -14.267 84.940 105.198 1.00 20.66 -ATOM 1856 N ASP A 324 -13.855 87.065 105.767 1.00 18.62 -ATOM 1857 CA ASP A 324 -12.688 86.736 106.595 1.00 17.59 -ATOM 1858 C ASP A 324 -13.148 86.376 108.011 1.00 18.02 -ATOM 1859 O ASP A 324 -14.298 86.609 108.373 1.00 17.87 -ATOM 1860 CB ASP A 324 -11.734 87.952 106.661 1.00 17.36 -ATOM 1861 CG ASP A 324 -10.338 87.596 107.186 1.00 16.53 -ATOM 1862 OD1 ASP A 324 -9.541 88.528 107.482 1.00 17.05 -ATOM 1863 OD2 ASP A 324 -10.036 86.386 107.294 1.00 17.08 -ATOM 1864 N ASN A 325 -12.256 85.784 108.802 1.00 17.90 -ATOM 1865 CA ASN A 325 -12.560 85.450 110.206 1.00 17.88 -ATOM 1866 C ASN A 325 -11.283 85.759 110.999 1.00 18.23 -ATOM 1867 O ASN A 325 -10.237 85.163 110.759 1.00 18.17 -ATOM 1868 CB ASN A 325 -12.985 83.991 110.355 1.00 17.46 -ATOM 1869 CG ASN A 325 -13.128 83.567 111.824 1.00 17.80 -ATOM 1870 OD1 ASN A 325 -12.177 83.105 112.441 1.00 18.59 -ATOM 1871 ND2 ASN A 325 -14.319 83.738 112.381 1.00 16.87 -ATOM 1872 N PRO A 326 -11.381 86.599 112.040 1.00 19.35 -ATOM 1873 CA PRO A 326 -12.549 87.360 112.500 1.00 17.69 -ATOM 1874 C PRO A 326 -13.136 88.329 111.516 1.00 17.38 -ATOM 1875 O PRO A 326 -12.541 88.613 110.480 1.00 16.75 -ATOM 1876 CB PRO A 326 -12.028 88.050 113.753 1.00 17.86 -ATOM 1877 CG PRO A 326 -10.655 88.416 113.352 1.00 18.60 -ATOM 1878 CD PRO A 326 -10.148 87.144 112.658 1.00 18.78 -ATOM 1879 N ARG A 327 -14.305 88.847 111.869 1.00 16.81 -ATOM 1880 CA ARG A 327 -15.038 89.788 111.045 1.00 17.44 -ATOM 1881 C ARG A 327 -16.190 90.311 111.904 1.00 19.31 -ATOM 1882 O ARG A 327 -16.557 89.686 112.899 1.00 21.27 -ATOM 1883 CB ARG A 327 -15.630 89.070 109.828 1.00 15.81 -ATOM 1884 CG ARG A 327 -16.691 88.025 110.195 1.00 12.82 -ATOM 1885 CD ARG A 327 -17.501 87.611 108.971 1.00 12.38 -ATOM 1886 NE ARG A 327 -18.529 86.614 109.271 1.00 10.72 -ATOM 1887 CZ ARG A 327 -18.314 85.303 109.368 1.00 10.11 -ATOM 1888 NH1 ARG A 327 -19.323 84.492 109.644 1.00 12.25 -ATOM 1889 NH2 ARG A 327 -17.106 84.793 109.179 1.00 8.06 -ATOM 1890 N PRO A 328 -16.774 91.460 111.530 1.00 18.97 -ATOM 1891 CA PRO A 328 -17.891 92.032 112.285 1.00 18.79 -ATOM 1892 C PRO A 328 -19.175 91.409 111.754 1.00 19.38 -ATOM 1893 O PRO A 328 -19.152 90.722 110.732 1.00 20.57 -ATOM 1894 CB PRO A 328 -17.809 93.509 111.933 1.00 18.09 -ATOM 1895 CG PRO A 328 -17.420 93.450 110.486 1.00 17.41 -ATOM 1896 CD PRO A 328 -16.319 92.397 110.484 1.00 18.00 -ATOM 1897 N ASN A 329 -20.290 91.636 112.440 1.00 20.00 -ATOM 1898 CA ASN A 329 -21.571 91.116 111.965 1.00 20.64 -ATOM 1899 C ASN A 329 -21.822 91.723 110.585 1.00 20.73 -ATOM 1900 O ASN A 329 -21.322 92.803 110.286 1.00 20.42 -ATOM 1901 CB ASN A 329 -22.710 91.528 112.903 1.00 19.97 -ATOM 1902 CG ASN A 329 -22.623 90.860 114.243 1.00 20.87 -ATOM 1903 OD1 ASN A 329 -22.572 89.639 114.328 1.00 23.63 -ATOM 1904 ND2 ASN A 329 -22.607 91.653 115.305 1.00 21.79 -ATOM 1905 N ASP A 330 -22.604 91.031 109.762 1.00 21.64 -ATOM 1906 CA ASP A 330 -22.921 91.495 108.415 1.00 22.76 -ATOM 1907 C ASP A 330 -23.576 92.872 108.358 1.00 24.07 -ATOM 1908 O ASP A 330 -24.437 93.210 109.181 1.00 24.56 -ATOM 1909 CB ASP A 330 -23.824 90.487 107.705 1.00 23.14 -ATOM 1910 CG ASP A 330 -23.110 89.183 107.395 1.00 24.88 -ATOM 1911 OD1 ASP A 330 -21.887 89.223 107.126 1.00 24.81 -ATOM 1912 OD2 ASP A 330 -23.773 88.121 107.406 1.00 24.33 -ATOM 1913 N GLY A 331 -23.166 93.664 107.373 1.00 23.60 -ATOM 1914 CA GLY A 331 -23.727 94.992 107.231 1.00 23.77 -ATOM 1915 C GLY A 331 -23.452 95.601 105.871 1.00 23.25 -ATOM 1916 O GLY A 331 -23.762 95.012 104.827 1.00 23.19 -ATOM 1917 N THR A 332 -22.869 96.792 105.890 1.00 22.68 -ATOM 1918 CA THR A 332 -22.541 97.493 104.665 1.00 23.15 -ATOM 1919 C THR A 332 -21.078 97.210 104.358 1.00 22.70 -ATOM 1920 O THR A 332 -20.194 97.527 105.155 1.00 21.60 -ATOM 1921 CB THR A 332 -22.750 99.005 104.829 1.00 24.25 -ATOM 1922 OG1 THR A 332 -24.032 99.253 105.427 1.00 25.74 -ATOM 1923 CG2 THR A 332 -22.688 99.697 103.469 1.00 23.98 -ATOM 1924 N GLY A 333 -20.840 96.600 103.203 1.00 21.87 -ATOM 1925 CA GLY A 333 -19.499 96.246 102.820 1.00 22.05 -ATOM 1926 C GLY A 333 -18.740 97.398 102.224 1.00 22.53 -ATOM 1927 O GLY A 333 -19.127 98.551 102.343 1.00 22.76 -ATOM 1928 N SER A 335 -17.632 97.084 101.577 1.00 23.16 -ATOM 1929 CA SER A 335 -16.817 98.110 100.962 1.00 23.73 -ATOM 1930 C SER A 335 -15.968 97.473 99.887 1.00 24.68 -ATOM 1931 O SER A 335 -15.516 96.348 100.021 1.00 24.15 -ATOM 1932 CB SER A 335 -15.903 98.747 101.989 1.00 24.08 -ATOM 1933 OG SER A 335 -14.912 99.531 101.344 1.00 24.52 -ATOM 1934 N CYS A 336 -15.739 98.194 98.806 1.00 25.58 -ATOM 1935 CA CYS A 336 -14.931 97.624 97.750 1.00 26.83 -ATOM 1936 C CYS A 336 -13.448 97.779 98.140 1.00 25.76 -ATOM 1937 O CYS A 336 -12.533 97.430 97.370 1.00 25.96 -ATOM 1938 CB CYS A 336 -15.238 98.297 96.419 1.00 26.49 -ATOM 1939 SG CYS A 336 -16.821 97.838 95.644 1.00 30.14 -ATOM 1940 N GLY A 339 -13.205 98.256 99.361 1.00 24.87 -ATOM 1941 CA GLY A 339 -11.832 98.409 99.810 1.00 23.44 -ATOM 1942 C GLY A 339 -11.706 97.699 101.132 1.00 22.92 -ATOM 1943 O GLY A 339 -12.665 97.072 101.595 1.00 22.02 -ATOM 1944 N PRO A 340 -10.541 97.778 101.768 1.00 21.86 -ATOM 1945 CA PRO A 340 -10.353 97.111 103.056 1.00 21.25 -ATOM 1946 C PRO A 340 -11.332 97.549 104.146 1.00 21.01 -ATOM 1947 O PRO A 340 -11.393 98.735 104.461 1.00 20.98 -ATOM 1948 CB PRO A 340 -8.926 97.507 103.452 1.00 23.51 -ATOM 1949 CG PRO A 340 -8.252 97.842 102.146 1.00 23.94 -ATOM 1950 CD PRO A 340 -9.343 98.541 101.376 1.00 22.57 -ATOM 1951 N VAL A 341 -12.072 96.601 104.725 1.00 20.32 -ATOM 1952 CA VAL A 341 -13.000 96.891 105.817 1.00 20.07 -ATOM 1953 C VAL A 341 -12.180 96.688 107.108 1.00 20.95 -ATOM 1954 O VAL A 341 -11.934 95.563 107.543 1.00 20.69 -ATOM 1955 CB VAL A 341 -14.208 95.918 105.802 1.00 19.87 -ATOM 1956 CG1 VAL A 341 -15.096 96.201 106.987 1.00 17.95 -ATOM 1957 CG2 VAL A 341 -15.008 96.040 104.503 1.00 18.12 -ATOM 1958 N SER A 342 -11.724 97.791 107.683 1.00 21.46 -ATOM 1959 CA SER A 342 -10.889 97.771 108.879 1.00 23.76 -ATOM 1960 C SER A 342 -11.461 97.173 110.180 1.00 24.99 -ATOM 1961 O SER A 342 -10.680 96.775 111.053 1.00 25.80 -ATOM 1962 CB SER A 342 -10.441 99.186 109.190 1.00 23.66 -ATOM 1963 OG SER A 342 -11.453 99.857 109.914 1.00 24.17 -ATOM 1964 N SER A 344 -12.785 97.144 110.344 1.00 25.31 -ATOM 1965 CA SER A 344 -13.343 96.630 111.580 1.00 26.76 -ATOM 1966 C SER A 344 -13.127 95.165 111.768 1.00 25.62 -ATOM 1967 O SER A 344 -13.709 94.363 111.056 1.00 22.72 -ATOM 1968 CB SER A 344 -14.843 96.958 111.707 1.00 28.25 -ATOM 1969 OG SER A 344 -15.642 96.112 110.895 1.00 34.42 -ATOM 1970 N ASN A 345 -12.272 94.827 112.725 1.00 24.63 -ATOM 1971 CA ASN A 345 -12.010 93.440 113.031 1.00 26.30 -ATOM 1972 C ASN A 345 -11.193 92.610 112.076 1.00 26.07 -ATOM 1973 O ASN A 345 -11.021 91.447 112.356 1.00 26.92 -ATOM 1974 CB ASN A 345 -13.327 92.712 113.280 1.00 27.37 -ATOM 1975 CG ASN A 345 -13.370 92.101 114.639 1.00 29.29 -ATOM 1976 OD1 ASN A 345 -12.356 91.595 115.124 1.00 32.43 -ATOM 1977 ND2 ASN A 345 -14.521 92.155 115.282 1.00 27.75 -ATOM 1978 N GLY A 345A -10.656 93.168 110.996 1.00 26.48 -ATOM 1979 CA GLY A 345A -9.904 92.326 110.091 1.00 27.64 -ATOM 1980 C GLY A 345A -8.426 92.280 110.352 1.00 26.92 -ATOM 1981 O GLY A 345A -7.693 91.841 109.483 1.00 27.05 -ATOM 1982 N ALA A 346 -7.993 92.716 111.533 1.00 27.31 -ATOM 1983 CA ALA A 346 -6.567 92.725 111.879 1.00 26.98 -ATOM 1984 C ALA A 346 -5.889 91.351 111.907 1.00 27.96 -ATOM 1985 O ALA A 346 -4.690 91.255 112.161 1.00 31.45 -ATOM 1986 CB ALA A 346 -6.349 93.415 113.209 1.00 27.80 -ATOM 1987 N TYR A 347 -6.648 90.289 111.666 1.00 25.91 -ATOM 1988 CA TYR A 347 -6.098 88.931 111.628 1.00 22.57 -ATOM 1989 C TYR A 347 -6.851 88.261 110.479 1.00 21.14 -ATOM 1990 O TYR A 347 -7.089 88.897 109.446 1.00 23.08 -ATOM 1991 CB TYR A 347 -6.344 88.232 112.979 1.00 23.55 -ATOM 1992 CG TYR A 347 -5.843 86.797 113.137 1.00 24.55 -ATOM 1993 CD1 TYR A 347 -4.536 86.422 112.781 1.00 24.67 -ATOM 1994 CD2 TYR A 347 -6.668 85.823 113.703 1.00 23.67 -ATOM 1995 CE1 TYR A 347 -4.078 85.103 112.995 1.00 22.45 -ATOM 1996 CE2 TYR A 347 -6.219 84.520 113.918 1.00 22.09 -ATOM 1997 CZ TYR A 347 -4.936 84.167 113.564 1.00 22.91 -ATOM 1998 OH TYR A 347 -4.544 82.866 113.762 1.00 23.36 -ATOM 1999 N GLY A 348 -7.248 87.008 110.641 1.00 18.66 -ATOM 2000 CA GLY A 348 -7.969 86.351 109.570 1.00 16.24 -ATOM 2001 C GLY A 348 -7.743 84.856 109.490 1.00 16.40 -ATOM 2002 O GLY A 348 -7.236 84.213 110.418 1.00 15.85 -ATOM 2003 N VAL A 349 -8.129 84.304 108.354 1.00 15.70 -ATOM 2004 CA VAL A 349 -7.990 82.894 108.107 1.00 15.37 -ATOM 2005 C VAL A 349 -7.968 82.736 106.593 1.00 14.98 -ATOM 2006 O VAL A 349 -8.472 83.587 105.874 1.00 15.16 -ATOM 2007 CB VAL A 349 -9.180 82.133 108.727 1.00 15.48 -ATOM 2008 CG1 VAL A 349 -10.460 82.428 107.973 1.00 13.16 -ATOM 2009 CG2 VAL A 349 -8.886 80.660 108.744 1.00 16.69 -ATOM 2010 N LYS A 350 -7.372 81.660 106.102 1.00 14.87 -ATOM 2011 CA LYS A 350 -7.323 81.457 104.667 1.00 14.99 -ATOM 2012 C LYS A 350 -8.708 81.065 104.170 1.00 15.62 -ATOM 2013 O LYS A 350 -9.403 80.265 104.805 1.00 15.88 -ATOM 2014 CB LYS A 350 -6.310 80.377 104.313 1.00 15.03 -ATOM 2015 CG LYS A 350 -6.288 80.008 102.846 1.00 13.81 -ATOM 2016 CD LYS A 350 -5.276 78.915 102.593 1.00 13.09 -ATOM 2017 CE LYS A 350 -5.420 78.312 101.194 1.00 13.49 -ATOM 2018 NZ LYS A 350 -5.164 79.285 100.097 1.00 10.76 -ATOM 2019 N GLY A 351 -9.104 81.655 103.045 1.00 14.40 -ATOM 2020 CA GLY A 351 -10.404 81.377 102.469 1.00 14.36 -ATOM 2021 C GLY A 351 -10.390 81.474 100.955 1.00 15.18 -ATOM 2022 O GLY A 351 -9.333 81.552 100.337 1.00 14.26 -ATOM 2023 N PHE A 352 -11.571 81.490 100.353 1.00 15.37 -ATOM 2024 CA PHE A 352 -11.672 81.549 98.904 1.00 14.45 -ATOM 2025 C PHE A 352 -13.049 82.045 98.481 1.00 14.92 -ATOM 2026 O PHE A 352 -13.913 82.290 99.322 1.00 14.65 -ATOM 2027 CB PHE A 352 -11.484 80.156 98.322 1.00 13.16 -ATOM 2028 CG PHE A 352 -12.622 79.246 98.622 1.00 13.14 -ATOM 2029 CD1 PHE A 352 -12.709 78.609 99.854 1.00 12.11 -ATOM 2030 CD2 PHE A 352 -13.668 79.106 97.714 1.00 13.32 -ATOM 2031 CE1 PHE A 352 -13.822 77.853 100.185 1.00 12.19 -ATOM 2032 CE2 PHE A 352 -14.789 78.348 98.039 1.00 13.05 -ATOM 2033 CZ PHE A 352 -14.865 77.722 99.279 1.00 12.22 -ATOM 2034 N SER A 353 -13.239 82.160 97.167 1.00 15.55 -ATOM 2035 CA SER A 353 -14.500 82.584 96.574 1.00 16.04 -ATOM 2036 C SER A 353 -14.481 82.390 95.073 1.00 16.73 -ATOM 2037 O SER A 353 -13.426 82.464 94.449 1.00 16.21 -ATOM 2038 CB SER A 353 -14.789 84.052 96.878 1.00 16.73 -ATOM 2039 OG SER A 353 -15.147 84.223 98.235 1.00 19.17 -ATOM 2040 N PHE A 354 -15.657 82.135 94.503 1.00 16.68 -ATOM 2041 CA PHE A 354 -15.799 81.951 93.065 1.00 16.50 -ATOM 2042 C PHE A 354 -16.686 83.039 92.499 1.00 18.00 -ATOM 2043 O PHE A 354 -17.836 83.222 92.924 1.00 19.37 -ATOM 2044 CB PHE A 354 -16.399 80.589 92.742 1.00 16.15 -ATOM 2045 CG PHE A 354 -15.484 79.451 93.048 1.00 15.31 -ATOM 2046 CD1 PHE A 354 -15.750 78.593 94.108 1.00 14.31 -ATOM 2047 CD2 PHE A 354 -14.344 79.245 92.288 1.00 14.79 -ATOM 2048 CE1 PHE A 354 -14.893 77.549 94.404 1.00 14.20 -ATOM 2049 CE2 PHE A 354 -13.475 78.197 92.581 1.00 15.71 -ATOM 2050 CZ PHE A 354 -13.753 77.347 93.642 1.00 14.99 -ATOM 2051 N LYS A 355 -16.141 83.765 91.532 1.00 18.07 -ATOM 2052 CA LYS A 355 -16.856 84.859 90.901 1.00 17.35 -ATOM 2053 C LYS A 355 -17.516 84.415 89.610 1.00 17.36 -ATOM 2054 O LYS A 355 -16.887 83.776 88.768 1.00 17.69 -ATOM 2055 CB LYS A 355 -15.885 86.018 90.631 1.00 16.42 -ATOM 2056 CG LYS A 355 -16.346 87.037 89.595 1.00 15.11 -ATOM 2057 CD LYS A 355 -15.317 88.149 89.452 1.00 14.22 -ATOM 2058 CE LYS A 355 -15.320 88.755 88.049 1.00 16.29 -ATOM 2059 NZ LYS A 355 -16.575 89.460 87.673 1.00 13.77 -ATOM 2060 N TYR A 356 -18.799 84.740 89.484 1.00 17.79 -ATOM 2061 CA TYR A 356 -19.584 84.447 88.287 1.00 17.63 -ATOM 2062 C TYR A 356 -20.235 85.777 87.922 1.00 18.41 -ATOM 2063 O TYR A 356 -21.187 86.209 88.588 1.00 18.74 -ATOM 2064 CB TYR A 356 -20.675 83.400 88.564 1.00 15.88 -ATOM 2065 CG TYR A 356 -20.183 81.976 88.738 1.00 13.91 -ATOM 2066 CD1 TYR A 356 -19.750 81.513 89.978 1.00 10.69 -ATOM 2067 CD2 TYR A 356 -20.183 81.081 87.660 1.00 12.71 -ATOM 2068 CE1 TYR A 356 -19.335 80.198 90.149 1.00 10.82 -ATOM 2069 CE2 TYR A 356 -19.769 79.765 87.820 1.00 12.65 -ATOM 2070 CZ TYR A 356 -19.350 79.327 89.068 1.00 12.90 -ATOM 2071 OH TYR A 356 -18.978 78.014 89.243 1.00 14.03 -ATOM 2072 N GLY A 357 -19.724 86.434 86.882 1.00 19.36 -ATOM 2073 CA GLY A 357 -20.276 87.725 86.509 1.00 20.05 -ATOM 2074 C GLY A 357 -20.053 88.635 87.707 1.00 21.09 -ATOM 2075 O GLY A 357 -18.955 88.659 88.261 1.00 21.46 -ATOM 2076 N ASN A 358 -21.079 89.368 88.124 1.00 20.80 -ATOM 2077 CA ASN A 358 -20.940 90.238 89.278 1.00 22.54 -ATOM 2078 C ASN A 358 -21.378 89.538 90.568 1.00 22.99 -ATOM 2079 O ASN A 358 -21.531 90.171 91.607 1.00 23.58 -ATOM 2080 CB ASN A 358 -21.735 91.536 89.073 1.00 25.01 -ATOM 2081 CG ASN A 358 -21.042 92.498 88.111 1.00 26.82 -ATOM 2082 OD1 ASN A 358 -19.871 92.838 88.297 1.00 28.22 -ATOM 2083 ND2 ASN A 358 -21.761 92.945 87.085 1.00 27.32 -ATOM 2084 N GLY A 359 -21.555 88.225 90.511 1.00 22.06 -ATOM 2085 CA GLY A 359 -21.963 87.505 91.701 1.00 22.30 -ATOM 2086 C GLY A 359 -20.807 86.703 92.266 1.00 23.21 -ATOM 2087 O GLY A 359 -19.774 86.555 91.604 1.00 23.36 -ATOM 2088 N VAL A 360 -20.979 86.173 93.475 1.00 21.86 -ATOM 2089 CA VAL A 360 -19.924 85.405 94.114 1.00 21.99 -ATOM 2090 C VAL A 360 -20.412 84.341 95.073 1.00 20.80 -ATOM 2091 O VAL A 360 -21.414 84.522 95.763 1.00 20.56 -ATOM 2092 CB VAL A 360 -18.971 86.317 94.917 1.00 22.95 -ATOM 2093 CG1 VAL A 360 -18.205 87.205 93.986 1.00 24.78 -ATOM 2094 CG2 VAL A 360 -19.767 87.155 95.908 1.00 22.26 -ATOM 2095 N TRP A 361 -19.684 83.229 95.107 1.00 19.54 -ATOM 2096 CA TRP A 361 -19.991 82.131 96.010 1.00 18.88 -ATOM 2097 C TRP A 361 -18.974 82.279 97.116 1.00 19.04 -ATOM 2098 O TRP A 361 -17.767 82.110 96.896 1.00 18.81 -ATOM 2099 CB TRP A 361 -19.806 80.768 95.337 1.00 18.21 -ATOM 2100 CG TRP A 361 -21.062 80.161 94.794 1.00 17.52 -ATOM 2101 CD1 TRP A 361 -21.414 80.043 93.480 1.00 16.94 -ATOM 2102 CD2 TRP A 361 -22.124 79.560 95.550 1.00 17.62 -ATOM 2103 NE1 TRP A 361 -22.626 79.402 93.368 1.00 18.16 -ATOM 2104 CE2 TRP A 361 -23.085 79.092 94.624 1.00 16.82 -ATOM 2105 CE3 TRP A 361 -22.355 79.366 96.921 1.00 16.66 -ATOM 2106 CZ2 TRP A 361 -24.260 78.446 95.019 1.00 16.40 -ATOM 2107 CZ3 TRP A 361 -23.526 78.723 97.319 1.00 16.40 -ATOM 2108 CH2 TRP A 361 -24.463 78.269 96.367 1.00 17.66 -ATOM 2109 N ILE A 362 -19.465 82.607 98.302 1.00 18.01 -ATOM 2110 CA ILE A 362 -18.609 82.803 99.450 1.00 17.31 -ATOM 2111 C ILE A 362 -18.573 81.591 100.374 1.00 17.78 -ATOM 2112 O ILE A 362 -19.602 80.965 100.652 1.00 17.57 -ATOM 2113 CB ILE A 362 -19.085 84.019 100.273 1.00 18.22 -ATOM 2114 CG1 ILE A 362 -19.014 85.282 99.414 1.00 18.46 -ATOM 2115 CG2 ILE A 362 -18.245 84.166 101.550 1.00 16.51 -ATOM 2116 CD1 ILE A 362 -19.620 86.499 100.085 1.00 18.07 -ATOM 2117 N GLY A 363 -17.370 81.268 100.831 1.00 16.15 -ATOM 2118 CA GLY A 363 -17.188 80.185 101.769 1.00 16.14 -ATOM 2119 C GLY A 363 -16.712 80.914 103.012 1.00 17.41 -ATOM 2120 O GLY A 363 -15.858 81.798 102.912 1.00 16.46 -ATOM 2121 N ARG A 364 -17.259 80.589 104.178 1.00 16.71 -ATOM 2122 CA ARG A 364 -16.833 81.281 105.394 1.00 17.26 -ATOM 2123 C ARG A 364 -17.226 80.521 106.646 1.00 17.00 -ATOM 2124 O ARG A 364 -18.003 79.566 106.586 1.00 18.76 -ATOM 2125 CB ARG A 364 -17.432 82.699 105.450 1.00 16.21 -ATOM 2126 CG ARG A 364 -18.921 82.775 105.849 1.00 16.52 -ATOM 2127 CD ARG A 364 -19.416 84.229 105.928 1.00 15.76 -ATOM 2128 NE ARG A 364 -20.720 84.374 106.579 1.00 14.66 -ATOM 2129 CZ ARG A 364 -21.350 85.535 106.751 1.00 13.48 -ATOM 2130 NH1 ARG A 364 -22.529 85.572 107.350 1.00 14.00 -ATOM 2131 NH2 ARG A 364 -20.810 86.666 106.321 1.00 14.41 -ATOM 2132 N THR A 365 -16.680 80.939 107.779 1.00 16.03 -ATOM 2133 CA THR A 365 -17.007 80.300 109.044 1.00 17.30 -ATOM 2134 C THR A 365 -18.397 80.783 109.470 1.00 18.28 -ATOM 2135 O THR A 365 -18.897 81.776 108.945 1.00 18.88 -ATOM 2136 CB THR A 365 -15.998 80.689 110.143 1.00 17.53 -ATOM 2137 OG1 THR A 365 -16.223 82.049 110.543 1.00 16.36 -ATOM 2138 CG2 THR A 365 -14.575 80.529 109.635 1.00 16.05 -ATOM 2139 N LYS A 366 -19.037 80.091 110.404 1.00 18.58 -ATOM 2140 CA LYS A 366 -20.348 80.550 110.847 1.00 20.02 -ATOM 2141 C LYS A 366 -20.165 81.584 111.965 1.00 20.57 -ATOM 2142 O LYS A 366 -20.937 82.537 112.079 1.00 18.75 -ATOM 2143 CB LYS A 366 -21.194 79.372 111.315 1.00 18.77 -ATOM 2144 CG LYS A 366 -21.414 78.362 110.208 1.00 19.49 -ATOM 2145 CD LYS A 366 -22.274 77.202 110.654 1.00 18.15 -ATOM 2146 CE LYS A 366 -23.719 77.473 110.345 1.00 17.50 -ATOM 2147 NZ LYS A 366 -23.896 77.682 108.893 1.00 16.39 -ATOM 2148 N SER A 367 -19.114 81.397 112.759 1.00 20.98 -ATOM 2149 CA SER A 367 -18.784 82.299 113.860 1.00 22.08 -ATOM 2150 C SER A 367 -17.952 83.507 113.380 1.00 22.63 -ATOM 2151 O SER A 367 -17.135 83.386 112.468 1.00 21.90 -ATOM 2152 CB SER A 367 -18.007 81.530 114.924 1.00 21.15 -ATOM 2153 OG SER A 367 -17.290 82.420 115.755 1.00 21.94 -ATOM 2154 N THR A 368 -18.162 84.665 114.001 1.00 23.94 -ATOM 2155 CA THR A 368 -17.437 85.882 113.630 1.00 25.04 -ATOM 2156 C THR A 368 -16.163 86.104 114.442 1.00 25.04 -ATOM 2157 O THR A 368 -15.361 86.964 114.082 1.00 26.11 -ATOM 2158 CB THR A 368 -18.297 87.131 113.832 1.00 26.77 -ATOM 2159 OG1 THR A 368 -19.474 87.041 113.020 1.00 20.00 -ATOM 2160 CG2 THR A 368 -17.523 88.380 113.440 1.00 20.00 -ATOM 2161 N ASN A 369 -15.977 85.339 115.521 1.00 24.44 -ATOM 2162 CA ASN A 369 -14.793 85.479 116.380 1.00 25.41 -ATOM 2163 C ASN A 369 -13.765 84.360 116.276 1.00 23.88 -ATOM 2164 O ASN A 369 -12.564 84.612 116.291 1.00 23.12 -ATOM 2165 CB ASN A 369 -15.204 85.591 117.843 1.00 29.16 -ATOM 2166 CG ASN A 369 -16.244 86.646 118.063 1.00 34.71 -ATOM 2167 OD1 ASN A 369 -16.052 87.806 117.686 1.00 37.48 -ATOM 2168 ND2 ASN A 369 -17.367 86.259 118.674 1.00 37.22 -ATOM 2169 N SER A 370 -14.234 83.123 116.205 1.00 22.46 -ATOM 2170 CA SER A 370 -13.324 81.999 116.112 1.00 21.00 -ATOM 2171 C SER A 370 -13.631 81.137 114.906 1.00 20.02 -ATOM 2172 O SER A 370 -14.705 81.231 114.318 1.00 18.40 -ATOM 2173 CB SER A 370 -13.389 81.152 117.389 1.00 21.86 -ATOM 2174 OG SER A 370 -14.710 80.701 117.648 1.00 23.12 -ATOM 2175 N ARG A 371 -12.669 80.299 114.547 1.00 19.56 -ATOM 2176 CA ARG A 371 -12.810 79.400 113.413 1.00 20.43 -ATOM 2177 C ARG A 371 -13.759 78.268 113.777 1.00 19.31 -ATOM 2178 O ARG A 371 -13.341 77.144 114.027 1.00 19.12 -ATOM 2179 CB ARG A 371 -11.430 78.863 113.010 1.00 21.01 -ATOM 2180 CG ARG A 371 -10.497 79.989 112.569 1.00 20.86 -ATOM 2181 CD ARG A 371 -9.024 79.597 112.481 1.00 19.50 -ATOM 2182 NE ARG A 371 -8.222 80.763 112.104 1.00 20.75 -ATOM 2183 CZ ARG A 371 -6.934 80.732 111.770 1.00 20.82 -ATOM 2184 NH1 ARG A 371 -6.306 81.856 111.441 1.00 18.53 -ATOM 2185 NH2 ARG A 371 -6.276 79.583 111.764 1.00 20.25 -ATOM 2186 N SER A 372 -15.046 78.595 113.798 1.00 19.77 -ATOM 2187 CA SER A 372 -16.097 77.648 114.139 1.00 19.47 -ATOM 2188 C SER A 372 -17.141 77.622 113.028 1.00 19.51 -ATOM 2189 O SER A 372 -17.637 78.668 112.608 1.00 19.90 -ATOM 2190 CB SER A 372 -16.766 78.057 115.461 1.00 19.23 -ATOM 2191 OG SER A 372 -15.811 78.299 116.481 1.00 17.84 -ATOM 2192 N GLY A 373 -17.470 76.420 112.563 1.00 20.20 -ATOM 2193 CA GLY A 373 -18.451 76.255 111.500 1.00 18.97 -ATOM 2194 C GLY A 373 -18.023 76.754 110.129 1.00 18.45 -ATOM 2195 O GLY A 373 -17.066 77.525 110.001 1.00 17.82 -ATOM 2196 N PHE A 374 -18.735 76.308 109.097 1.00 17.25 -ATOM 2197 CA PHE A 374 -18.453 76.728 107.732 1.00 17.01 -ATOM 2198 C PHE A 374 -19.753 76.709 106.944 1.00 18.23 -ATOM 2199 O PHE A 374 -20.679 75.974 107.289 1.00 19.08 -ATOM 2200 CB PHE A 374 -17.445 75.800 107.060 1.00 14.96 -ATOM 2201 CG PHE A 374 -16.757 76.421 105.873 1.00 13.34 -ATOM 2202 CD1 PHE A 374 -15.686 77.293 106.053 1.00 12.93 -ATOM 2203 CD2 PHE A 374 -17.178 76.145 104.578 1.00 11.41 -ATOM 2204 CE1 PHE A 374 -15.043 77.881 104.961 1.00 10.74 -ATOM 2205 CE2 PHE A 374 -16.540 76.730 103.481 1.00 12.26 -ATOM 2206 CZ PHE A 374 -15.472 77.598 103.675 1.00 11.36 -ATOM 2207 N GLU A 375 -19.818 77.513 105.886 1.00 17.29 -ATOM 2208 CA GLU A 375 -21.020 77.599 105.070 1.00 17.11 -ATOM 2209 C GLU A 375 -20.731 78.258 103.727 1.00 16.87 -ATOM 2210 O GLU A 375 -19.817 79.071 103.607 1.00 16.61 -ATOM 2211 CB GLU A 375 -22.093 78.414 105.810 1.00 18.02 -ATOM 2212 CG GLU A 375 -21.591 79.774 106.307 1.00 20.11 -ATOM 2213 CD GLU A 375 -22.650 80.579 107.071 1.00 23.46 -ATOM 2214 OE1 GLU A 375 -23.403 79.971 107.863 1.00 26.01 -ATOM 2215 OE2 GLU A 375 -22.723 81.822 106.899 1.00 22.82 -ATOM 2216 N MET A 376 -21.512 77.889 102.718 1.00 16.51 -ATOM 2217 CA MET A 376 -21.386 78.466 101.386 1.00 17.27 -ATOM 2218 C MET A 376 -22.552 79.447 101.205 1.00 17.58 -ATOM 2219 O MET A 376 -23.679 79.158 101.610 1.00 16.79 -ATOM 2220 CB MET A 376 -21.448 77.372 100.316 1.00 16.90 -ATOM 2221 CG MET A 376 -20.255 76.424 100.317 1.00 17.16 -ATOM 2222 SD MET A 376 -18.682 77.303 100.204 1.00 19.89 -ATOM 2223 CE MET A 376 -18.813 78.054 98.585 1.00 17.28 -ATOM 2224 N ILE A 377 -22.279 80.607 100.612 1.00 17.28 -ATOM 2225 CA ILE A 377 -23.316 81.611 100.401 1.00 16.99 -ATOM 2226 C ILE A 377 -23.293 82.184 98.986 1.00 18.02 -ATOM 2227 O ILE A 377 -22.231 82.504 98.444 1.00 17.17 -ATOM 2228 CB ILE A 377 -23.165 82.779 101.396 1.00 16.83 -ATOM 2229 CG1 ILE A 377 -23.392 82.287 102.825 1.00 16.16 -ATOM 2230 CG2 ILE A 377 -24.151 83.894 101.050 1.00 18.81 -ATOM 2231 CD1 ILE A 377 -23.141 83.341 103.874 1.00 13.34 -ATOM 2232 N TRP A 378 -24.469 82.305 98.382 1.00 18.45 -ATOM 2233 CA TRP A 378 -24.555 82.861 97.044 1.00 20.48 -ATOM 2234 C TRP A 378 -25.119 84.275 97.104 1.00 21.94 -ATOM 2235 O TRP A 378 -26.285 84.491 97.459 1.00 21.36 -ATOM 2236 CB TRP A 378 -25.430 81.998 96.138 1.00 21.42 -ATOM 2237 CG TRP A 378 -25.725 82.649 94.793 1.00 23.28 -ATOM 2238 CD1 TRP A 378 -26.956 82.961 94.281 1.00 22.77 -ATOM 2239 CD2 TRP A 378 -24.768 83.055 93.802 1.00 23.00 -ATOM 2240 NE1 TRP A 378 -26.823 83.532 93.035 1.00 22.79 -ATOM 2241 CE2 TRP A 378 -25.493 83.601 92.718 1.00 22.54 -ATOM 2242 CE3 TRP A 378 -23.371 83.009 93.726 1.00 22.97 -ATOM 2243 CZ2 TRP A 378 -24.869 84.097 91.572 1.00 23.09 -ATOM 2244 CZ3 TRP A 378 -22.748 83.501 92.586 1.00 24.01 -ATOM 2245 CH2 TRP A 378 -23.499 84.039 91.522 1.00 22.75 -ATOM 2246 N ASP A 379 -24.262 85.234 96.777 1.00 23.03 -ATOM 2247 CA ASP A 379 -24.643 86.634 96.757 1.00 25.10 -ATOM 2248 C ASP A 379 -24.522 87.115 95.315 1.00 25.99 -ATOM 2249 O ASP A 379 -23.435 87.498 94.874 1.00 26.66 -ATOM 2250 CB ASP A 379 -23.717 87.466 97.656 1.00 22.53 -ATOM 2251 CG ASP A 379 -24.152 88.918 97.748 1.00 22.46 -ATOM 2252 OD1 ASP A 379 -24.725 89.432 96.765 1.00 20.39 -ATOM 2253 OD2 ASP A 379 -23.918 89.553 98.799 1.00 22.74 -ATOM 2254 N PRO A 380 -25.625 87.069 94.549 1.00 27.82 -ATOM 2255 CA PRO A 380 -25.507 87.539 93.164 1.00 28.66 -ATOM 2256 C PRO A 380 -25.094 88.994 93.257 1.00 29.52 -ATOM 2257 O PRO A 380 -25.316 89.629 94.284 1.00 30.88 -ATOM 2258 CB PRO A 380 -26.920 87.357 92.614 1.00 28.53 -ATOM 2259 CG PRO A 380 -27.790 87.573 93.827 1.00 27.91 -ATOM 2260 CD PRO A 380 -27.033 86.811 94.907 1.00 28.73 -ATOM 2261 N ASN A 381 -24.471 89.531 92.223 1.00 31.17 -ATOM 2262 CA ASN A 381 -24.070 90.937 92.300 1.00 33.92 -ATOM 2263 C ASN A 381 -23.488 91.277 93.702 1.00 32.09 -ATOM 2264 O ASN A 381 -23.840 92.293 94.299 1.00 32.39 -ATOM 2265 CB ASN A 381 -25.293 91.827 92.005 1.00 37.66 -ATOM 2266 CG ASN A 381 -26.079 91.369 90.755 1.00 41.64 -ATOM 2267 OD1 ASN A 381 -25.584 91.454 89.620 1.00 41.48 -ATOM 2268 ND2 ASN A 381 -27.311 90.879 90.971 1.00 41.73 -ATOM 2269 N GLY A 382 -22.612 90.414 94.219 1.00 30.94 -ATOM 2270 CA GLY A 382 -22.005 90.634 95.529 1.00 27.65 -ATOM 2271 C GLY A 382 -20.504 90.895 95.445 1.00 26.05 -ATOM 2272 O GLY A 382 -19.836 91.230 96.431 1.00 23.55 -ATOM 2273 N TRP A 383 -19.970 90.734 94.244 1.00 24.16 -ATOM 2274 CA TRP A 383 -18.559 90.964 93.997 1.00 23.00 -ATOM 2275 C TRP A 383 -18.319 92.451 93.827 1.00 22.56 -ATOM 2276 O TRP A 383 -17.254 92.963 94.155 1.00 22.09 -ATOM 2277 CB TRP A 383 -18.150 90.231 92.722 1.00 22.40 -ATOM 2278 CG TRP A 383 -16.741 90.455 92.284 1.00 21.43 -ATOM 2279 CD1 TRP A 383 -16.274 91.473 91.506 1.00 20.45 -ATOM 2280 CD2 TRP A 383 -15.618 89.614 92.563 1.00 21.19 -ATOM 2281 NE1 TRP A 383 -14.929 91.314 91.280 1.00 21.67 -ATOM 2282 CE2 TRP A 383 -14.501 90.180 91.920 1.00 20.79 -ATOM 2283 CE3 TRP A 383 -15.447 88.432 93.297 1.00 21.63 -ATOM 2284 CZ2 TRP A 383 -13.231 89.606 91.984 1.00 21.65 -ATOM 2285 CZ3 TRP A 383 -14.182 87.859 93.360 1.00 20.44 -ATOM 2286 CH2 TRP A 383 -13.093 88.448 92.709 1.00 20.69 -ATOM 2287 N THR A 384 -19.333 93.140 93.318 1.00 21.94 -ATOM 2288 CA THR A 384 -19.236 94.565 93.055 1.00 22.23 -ATOM 2289 C THR A 384 -20.159 95.440 93.899 1.00 22.32 -ATOM 2290 O THR A 384 -19.947 96.641 93.991 1.00 22.24 -ATOM 2291 CB THR A 384 -19.558 94.847 91.579 1.00 21.59 -ATOM 2292 OG1 THR A 384 -20.754 94.143 91.231 1.00 20.16 -ATOM 2293 CG2 THR A 384 -18.421 94.402 90.671 1.00 19.60 -ATOM 2294 N GLU A 385 -21.181 94.851 94.506 1.00 23.62 -ATOM 2295 CA GLU A 385 -22.115 95.644 95.292 1.00 25.01 -ATOM 2296 C GLU A 385 -21.858 95.563 96.781 1.00 26.30 -ATOM 2297 O GLU A 385 -21.159 94.672 97.260 1.00 26.55 -ATOM 2298 CB GLU A 385 -23.562 95.232 94.999 1.00 25.35 -ATOM 2299 CG GLU A 385 -24.023 95.463 93.556 1.00 27.40 -ATOM 2300 CD GLU A 385 -23.856 96.914 93.080 1.00 30.80 -ATOM 2301 OE1 GLU A 385 -24.180 97.847 93.853 1.00 29.91 -ATOM 2302 OE2 GLU A 385 -23.413 97.117 91.921 1.00 31.33 -ATOM 2303 N THR A 386 -22.453 96.502 97.508 1.00 27.74 -ATOM 2304 CA THR A 386 -22.289 96.590 98.947 1.00 29.05 -ATOM 2305 C THR A 386 -23.589 96.456 99.735 1.00 30.25 -ATOM 2306 O THR A 386 -24.239 97.451 100.056 1.00 34.71 -ATOM 2307 CB THR A 386 -21.655 97.928 99.322 1.00 29.05 -ATOM 2308 OG1 THR A 386 -20.395 98.062 98.656 1.00 27.18 -ATOM 2309 CG2 THR A 386 -21.457 98.010 100.821 1.00 29.32 -ATOM 2310 N ASP A 387 -23.983 95.230 100.024 1.00 29.28 -ATOM 2311 CA ASP A 387 -25.172 94.985 100.816 1.00 28.96 -ATOM 2312 C ASP A 387 -24.963 93.630 101.430 1.00 28.64 -ATOM 2313 O ASP A 387 -24.129 92.852 100.960 1.00 28.71 -ATOM 2314 CB ASP A 387 -26.468 95.008 99.983 1.00 29.47 -ATOM 2315 CG ASP A 387 -26.395 94.147 98.731 1.00 29.65 -ATOM 2316 OD1 ASP A 387 -25.874 94.642 97.712 1.00 30.59 -ATOM 2317 OD2 ASP A 387 -26.853 92.979 98.760 1.00 30.66 -ATOM 2318 N SER A 388 -25.702 93.360 102.495 1.00 27.98 -ATOM 2319 CA SER A 388 -25.588 92.098 103.195 1.00 27.22 -ATOM 2320 C SER A 388 -26.644 91.074 102.768 1.00 27.02 -ATOM 2321 O SER A 388 -26.740 90.004 103.367 1.00 27.70 -ATOM 2322 CB SER A 388 -25.681 92.352 104.704 1.00 27.92 -ATOM 2323 OG SER A 388 -26.754 93.233 105.015 1.00 27.45 -ATOM 2324 N SER A 389 -27.426 91.382 101.736 1.00 25.64 -ATOM 2325 CA SER A 389 -28.467 90.451 101.307 1.00 25.38 -ATOM 2326 C SER A 389 -27.934 89.419 100.333 1.00 25.36 -ATOM 2327 O SER A 389 -27.038 89.706 99.528 1.00 24.91 -ATOM 2328 CB SER A 389 -29.629 91.194 100.664 1.00 23.52 -ATOM 2329 OG SER A 389 -29.244 91.698 99.408 1.00 24.74 -ATOM 2330 N PHE A 390 -28.508 88.220 100.410 1.00 26.20 -ATOM 2331 CA PHE A 390 -28.098 87.098 99.566 1.00 25.73 -ATOM 2332 C PHE A 390 -29.245 86.106 99.311 1.00 24.88 -ATOM 2333 O PHE A 390 -30.221 86.028 100.071 1.00 23.45 -ATOM 2334 CB PHE A 390 -26.911 86.376 100.217 1.00 24.88 -ATOM 2335 CG PHE A 390 -27.226 85.785 101.564 1.00 23.57 -ATOM 2336 CD1 PHE A 390 -27.718 84.486 101.674 1.00 24.15 -ATOM 2337 CD2 PHE A 390 -27.039 86.529 102.723 1.00 25.15 -ATOM 2338 CE1 PHE A 390 -28.018 83.930 102.924 1.00 24.96 -ATOM 2339 CE2 PHE A 390 -27.334 85.984 103.984 1.00 26.73 -ATOM 2340 CZ PHE A 390 -27.826 84.677 104.081 1.00 24.97 -ATOM 2341 N SER A 391 -29.085 85.326 98.249 1.00 23.74 -ATOM 2342 CA SER A 391 -30.091 84.367 97.822 1.00 23.38 -ATOM 2343 C SER A 391 -30.016 82.958 98.429 1.00 23.12 -ATOM 2344 O SER A 391 -31.024 82.427 98.907 1.00 22.06 -ATOM 2345 CB SER A 391 -30.026 84.268 96.303 1.00 22.43 -ATOM 2346 OG SER A 391 -29.789 85.550 95.754 1.00 21.66 -ATOM 2347 N VAL A 392 -28.830 82.354 98.409 1.00 21.42 -ATOM 2348 CA VAL A 392 -28.683 81.001 98.925 1.00 20.22 -ATOM 2349 C VAL A 392 -27.637 80.794 100.010 1.00 19.40 -ATOM 2350 O VAL A 392 -26.591 81.439 100.018 1.00 19.56 -ATOM 2351 CB VAL A 392 -28.352 80.023 97.781 1.00 21.10 -ATOM 2352 CG1 VAL A 392 -28.441 78.588 98.286 1.00 18.94 -ATOM 2353 CG2 VAL A 392 -29.299 80.253 96.605 1.00 20.21 -ATOM 2354 N LYS A 394 -27.929 79.881 100.927 1.00 18.02 -ATOM 2355 CA LYS A 394 -26.998 79.549 101.999 1.00 17.24 -ATOM 2356 C LYS A 394 -27.033 78.041 102.230 1.00 16.32 -ATOM 2357 O LYS A 394 -28.103 77.467 102.457 1.00 15.40 -ATOM 2358 CB LYS A 394 -27.370 80.253 103.299 1.00 17.19 -ATOM 2359 CG LYS A 394 -26.420 79.937 104.451 1.00 18.22 -ATOM 2360 CD LYS A 394 -27.149 79.953 105.788 1.00 19.98 -ATOM 2361 CE LYS A 394 -26.251 80.424 106.912 1.00 23.00 -ATOM 2362 NZ LYS A 394 -25.883 81.867 106.789 1.00 23.25 -ATOM 2363 N GLN A 395 -25.867 77.406 102.155 1.00 13.81 -ATOM 2364 CA GLN A 395 -25.763 75.974 102.370 1.00 14.24 -ATOM 2365 C GLN A 395 -24.806 75.675 103.526 1.00 16.17 -ATOM 2366 O GLN A 395 -23.635 76.071 103.503 1.00 17.26 -ATOM 2367 CB GLN A 395 -25.280 75.271 101.098 1.00 13.66 -ATOM 2368 CG GLN A 395 -25.152 73.744 101.254 1.00 15.01 -ATOM 2369 CD GLN A 395 -24.640 73.043 99.996 1.00 16.19 -ATOM 2370 OE1 GLN A 395 -24.460 71.823 99.979 1.00 14.84 -ATOM 2371 NE2 GLN A 395 -24.404 73.813 98.942 1.00 16.90 -ATOM 2372 N ASP A 396 -25.310 74.987 104.544 1.00 14.76 -ATOM 2373 CA ASP A 396 -24.484 74.639 105.687 1.00 16.00 -ATOM 2374 C ASP A 396 -23.492 73.511 105.373 1.00 14.21 -ATOM 2375 O ASP A 396 -23.843 72.539 104.709 1.00 12.90 -ATOM 2376 CB ASP A 396 -25.366 74.222 106.875 1.00 16.22 -ATOM 2377 CG ASP A 396 -26.249 75.352 107.377 1.00 19.23 -ATOM 2378 OD1 ASP A 396 -25.751 76.490 107.522 1.00 20.39 -ATOM 2379 OD2 ASP A 396 -27.445 75.103 107.643 1.00 21.70 -ATOM 2380 N ILE A 397 -22.255 73.656 105.851 1.00 13.45 -ATOM 2381 CA ILE A 397 -21.218 72.634 105.672 1.00 13.78 -ATOM 2382 C ILE A 397 -20.717 72.137 107.047 1.00 14.51 -ATOM 2383 O ILE A 397 -20.451 70.943 107.227 1.00 14.47 -ATOM 2384 CB ILE A 397 -20.024 73.150 104.802 1.00 12.58 -ATOM 2385 CG1 ILE A 397 -20.328 72.952 103.312 1.00 15.62 -ATOM 2386 CG2 ILE A 397 -18.764 72.332 105.069 1.00 12.38 -ATOM 2387 CD1 ILE A 397 -21.444 73.776 102.772 1.00 15.01 -ATOM 2388 N VAL A 398 -20.594 73.046 108.016 1.00 14.52 -ATOM 2389 CA VAL A 398 -20.164 72.671 109.370 1.00 14.74 -ATOM 2390 C VAL A 398 -20.878 73.519 110.431 1.00 16.54 -ATOM 2391 O VAL A 398 -20.809 74.750 110.404 1.00 17.28 -ATOM 2392 CB VAL A 398 -18.647 72.827 109.554 1.00 13.20 -ATOM 2393 CG1 VAL A 398 -18.256 72.429 110.957 1.00 12.01 -ATOM 2394 CG2 VAL A 398 -17.908 71.965 108.548 1.00 13.46 -ATOM 2395 N ALA A 399 -21.570 72.850 111.353 1.00 17.31 -ATOM 2396 CA ALA A 399 -22.307 73.517 112.428 1.00 17.17 -ATOM 2397 C ALA A 399 -21.398 74.456 113.212 1.00 17.20 -ATOM 2398 O ALA A 399 -20.196 74.218 113.302 1.00 16.43 -ATOM 2399 CB ALA A 399 -22.925 72.477 113.363 1.00 14.81 -ATOM 2400 N ILE A 400 -21.979 75.523 113.765 1.00 18.91 -ATOM 2401 CA ILE A 400 -21.226 76.518 114.544 1.00 20.97 -ATOM 2402 C ILE A 400 -20.646 75.893 115.804 1.00 19.83 -ATOM 2403 O ILE A 400 -19.727 76.439 116.412 1.00 19.41 -ATOM 2404 CB ILE A 400 -22.115 77.689 115.035 1.00 23.87 -ATOM 2405 CG1 ILE A 400 -23.182 78.022 113.992 1.00 28.82 -ATOM 2406 CG2 ILE A 400 -21.250 78.934 115.288 1.00 23.79 -ATOM 2407 CD1 ILE A 400 -24.363 78.859 114.551 1.00 29.99 -ATOM 2408 N THR A 401 -21.198 74.749 116.190 1.00 18.56 -ATOM 2409 CA THR A 401 -20.767 74.070 117.391 1.00 18.92 -ATOM 2410 C THR A 401 -19.490 73.294 117.193 1.00 17.90 -ATOM 2411 O THR A 401 -18.941 72.747 118.139 1.00 18.07 -ATOM 2412 CB THR A 401 -21.857 73.112 117.883 1.00 20.78 -ATOM 2413 OG1 THR A 401 -22.275 72.277 116.798 1.00 20.47 -ATOM 2414 CG2 THR A 401 -23.053 73.895 118.407 1.00 20.29 -ATOM 2415 N ASP A 402 -19.001 73.256 115.965 1.00 17.82 -ATOM 2416 CA ASP A 402 -17.785 72.513 115.689 1.00 17.45 -ATOM 2417 C ASP A 402 -16.689 73.316 115.023 1.00 16.37 -ATOM 2418 O ASP A 402 -16.954 74.279 114.305 1.00 17.47 -ATOM 2419 CB ASP A 402 -18.139 71.285 114.870 1.00 17.96 -ATOM 2420 CG ASP A 402 -18.921 70.279 115.681 1.00 20.07 -ATOM 2421 OD1 ASP A 402 -18.271 69.460 116.370 1.00 20.54 -ATOM 2422 OD2 ASP A 402 -20.178 70.323 115.653 1.00 19.90 -ATOM 2423 N TRP A 403 -15.453 72.908 115.279 1.00 14.88 -ATOM 2424 CA TRP A 403 -14.293 73.586 114.737 1.00 15.72 -ATOM 2425 C TRP A 403 -14.077 73.386 113.241 1.00 17.76 -ATOM 2426 O TRP A 403 -14.202 72.271 112.706 1.00 18.36 -ATOM 2427 CB TRP A 403 -13.029 73.145 115.478 1.00 16.15 -ATOM 2428 CG TRP A 403 -13.113 73.308 116.964 1.00 18.77 -ATOM 2429 CD1 TRP A 403 -13.287 72.320 117.887 1.00 17.90 -ATOM 2430 CD2 TRP A 403 -13.094 74.543 117.696 1.00 19.96 -ATOM 2431 NE1 TRP A 403 -13.382 72.860 119.150 1.00 20.05 -ATOM 2432 CE2 TRP A 403 -13.267 74.221 119.063 1.00 19.72 -ATOM 2433 CE3 TRP A 403 -12.946 75.890 117.330 1.00 19.41 -ATOM 2434 CZ2 TRP A 403 -13.302 75.197 120.068 1.00 19.59 -ATOM 2435 CZ3 TRP A 403 -12.980 76.863 118.333 1.00 19.84 -ATOM 2436 CH2 TRP A 403 -13.157 76.508 119.685 1.00 18.77 -ATOM 2437 N SER A 404 -13.765 74.488 112.570 1.00 16.29 -ATOM 2438 CA SER A 404 -13.456 74.456 111.149 1.00 15.92 -ATOM 2439 C SER A 404 -12.042 75.030 111.084 1.00 14.65 -ATOM 2440 O SER A 404 -11.235 74.763 111.967 1.00 13.58 -ATOM 2441 CB SER A 404 -14.453 75.295 110.329 1.00 15.61 -ATOM 2442 OG SER A 404 -14.533 76.636 110.779 1.00 17.60 -ATOM 2443 N GLY A 405 -11.738 75.818 110.063 1.00 13.68 -ATOM 2444 CA GLY A 405 -10.402 76.374 109.956 1.00 13.17 -ATOM 2445 C GLY A 405 -10.127 76.855 108.552 1.00 12.57 -ATOM 2446 O GLY A 405 -10.981 77.489 107.940 1.00 13.33 -ATOM 2447 N TYR A 406 -8.941 76.567 108.032 1.00 11.64 -ATOM 2448 CA TYR A 406 -8.609 76.989 106.672 1.00 12.73 -ATOM 2449 C TYR A 406 -9.568 76.375 105.670 1.00 12.91 -ATOM 2450 O TYR A 406 -10.262 75.416 105.969 1.00 15.00 -ATOM 2451 CB TYR A 406 -7.188 76.562 106.297 1.00 10.81 -ATOM 2452 CG TYR A 406 -6.108 77.538 106.686 1.00 10.16 -ATOM 2453 CD1 TYR A 406 -6.315 78.474 107.692 1.00 9.17 -ATOM 2454 CD2 TYR A 406 -4.862 77.493 106.076 1.00 7.79 -ATOM 2455 CE1 TYR A 406 -5.307 79.334 108.080 1.00 10.25 -ATOM 2456 CE2 TYR A 406 -3.859 78.340 106.452 1.00 9.23 -ATOM 2457 CZ TYR A 406 -4.082 79.261 107.458 1.00 11.75 -ATOM 2458 OH TYR A 406 -3.066 80.096 107.856 1.00 12.88 -ATOM 2459 N SER A 407 -9.599 76.940 104.475 1.00 12.45 -ATOM 2460 CA SER A 407 -10.436 76.427 103.404 1.00 10.91 -ATOM 2461 C SER A 407 -9.875 77.017 102.125 1.00 11.11 -ATOM 2462 O SER A 407 -9.354 78.135 102.121 1.00 9.51 -ATOM 2463 CB SER A 407 -11.909 76.832 103.599 1.00 10.81 -ATOM 2464 OG SER A 407 -12.123 78.213 103.400 1.00 9.55 -ATOM 2465 N GLY A 408 -9.955 76.262 101.041 1.00 11.44 -ATOM 2466 CA GLY A 408 -9.430 76.777 99.796 1.00 13.14 -ATOM 2467 C GLY A 408 -10.141 76.191 98.610 1.00 15.28 -ATOM 2468 O GLY A 408 -10.921 75.247 98.743 1.00 17.44 -ATOM 2469 N SER A 409 -9.865 76.748 97.442 1.00 14.70 -ATOM 2470 CA SER A 409 -10.479 76.271 96.216 1.00 15.35 -ATOM 2471 C SER A 409 -9.550 75.332 95.452 1.00 15.64 -ATOM 2472 O SER A 409 -8.335 75.360 95.631 1.00 15.12 -ATOM 2473 CB SER A 409 -10.801 77.456 95.301 1.00 14.56 -ATOM 2474 OG SER A 409 -9.605 77.991 94.744 1.00 10.37 -ATOM 2475 N PHE A 410 -10.147 74.493 94.614 1.00 16.23 -ATOM 2476 CA PHE A 410 -9.408 73.603 93.721 1.00 17.60 -ATOM 2477 C PHE A 410 -10.324 73.282 92.540 1.00 18.25 -ATOM 2478 O PHE A 410 -11.550 73.399 92.639 1.00 17.63 -ATOM 2479 CB PHE A 410 -8.883 72.329 94.419 1.00 16.84 -ATOM 2480 CG PHE A 410 -9.931 71.308 94.751 1.00 17.97 -ATOM 2481 CD1 PHE A 410 -10.762 71.474 95.848 1.00 17.97 -ATOM 2482 CD2 PHE A 410 -10.025 70.131 94.011 1.00 18.42 -ATOM 2483 CE1 PHE A 410 -11.666 70.478 96.214 1.00 19.80 -ATOM 2484 CE2 PHE A 410 -10.931 69.123 94.369 1.00 18.77 -ATOM 2485 CZ PHE A 410 -11.750 69.295 95.471 1.00 17.73 -ATOM 2486 N VAL A 411 -9.741 72.898 91.415 1.00 17.62 -ATOM 2487 CA VAL A 411 -10.556 72.645 90.239 1.00 18.74 -ATOM 2488 C VAL A 411 -10.321 71.311 89.554 1.00 18.53 -ATOM 2489 O VAL A 411 -9.369 70.597 89.846 1.00 19.24 -ATOM 2490 CB VAL A 411 -10.340 73.761 89.183 1.00 19.92 -ATOM 2491 CG1 VAL A 411 -11.263 73.553 88.031 1.00 23.04 -ATOM 2492 CG2 VAL A 411 -10.597 75.113 89.781 1.00 20.72 -ATOM 2493 N GLN A 412 -11.220 70.990 88.636 1.00 18.06 -ATOM 2494 CA GLN A 412 -11.140 69.771 87.857 1.00 17.12 -ATOM 2495 C GLN A 412 -11.349 70.224 86.419 1.00 16.45 -ATOM 2496 O GLN A 412 -12.427 70.692 86.046 1.00 15.56 -ATOM 2497 CB GLN A 412 -12.227 68.781 88.300 1.00 16.77 -ATOM 2498 CG GLN A 412 -12.121 68.392 89.764 1.00 13.79 -ATOM 2499 CD GLN A 412 -12.946 67.171 90.128 1.00 13.89 -ATOM 2500 OE1 GLN A 412 -14.156 67.132 89.921 1.00 14.13 -ATOM 2501 NE2 GLN A 412 -12.287 66.170 90.690 1.00 15.23 -ATOM 2502 N HIS A 412A -10.291 70.113 85.629 1.00 16.40 -ATOM 2503 CA HIS A 412A -10.308 70.521 84.231 1.00 15.99 -ATOM 2504 C HIS A 412A -10.986 69.520 83.325 1.00 16.42 -ATOM 2505 O HIS A 412A -11.158 68.360 83.684 1.00 16.50 -ATOM 2506 CB HIS A 412A -8.883 70.706 83.720 1.00 17.61 -ATOM 2507 CG HIS A 412A -8.197 71.925 84.240 1.00 17.94 -ATOM 2508 ND1 HIS A 412A -8.143 73.104 83.529 1.00 18.22 -ATOM 2509 CD2 HIS A 412A -7.511 72.145 85.385 1.00 18.35 -ATOM 2510 CE1 HIS A 412A -7.451 73.994 84.213 1.00 19.17 -ATOM 2511 NE2 HIS A 412A -7.055 73.437 85.344 1.00 18.08 -ATOM 2512 N PRO A 412B -11.381 69.969 82.123 1.00 17.93 -ATOM 2513 CA PRO A 412B -12.040 69.140 81.110 1.00 17.79 -ATOM 2514 C PRO A 412B -11.238 67.879 80.768 1.00 18.05 -ATOM 2515 O PRO A 412B -11.812 66.823 80.523 1.00 19.06 -ATOM 2516 CB PRO A 412B -12.153 70.090 79.925 1.00 17.54 -ATOM 2517 CG PRO A 412B -12.438 71.395 80.601 1.00 17.41 -ATOM 2518 CD PRO A 412B -11.457 71.399 81.754 1.00 18.17 -ATOM 2519 N GLU A 412C -9.915 67.970 80.753 1.00 18.33 -ATOM 2520 CA GLU A 412C -9.134 66.784 80.424 1.00 19.37 -ATOM 2521 C GLU A 412C -9.243 65.703 81.509 1.00 19.87 -ATOM 2522 O GLU A 412C -8.815 64.566 81.313 1.00 21.87 -ATOM 2523 CB GLU A 412C -7.657 67.137 80.152 1.00 19.14 -ATOM 2524 CG GLU A 412C -7.226 68.570 80.466 1.00 21.55 -ATOM 2525 CD GLU A 412C -7.558 69.574 79.372 1.00 18.96 -ATOM 2526 OE1 GLU A 412C -7.199 69.336 78.209 1.00 20.85 -ATOM 2527 OE2 GLU A 412C -8.161 70.617 79.682 1.00 20.20 -ATOM 2528 N LEU A 412D -9.828 66.048 82.650 1.00 20.69 -ATOM 2529 CA LEU A 412D -9.996 65.083 83.740 1.00 20.41 -ATOM 2530 C LEU A 412D -11.436 64.628 83.815 1.00 21.07 -ATOM 2531 O LEU A 412D -11.724 63.444 83.979 1.00 21.74 -ATOM 2532 CB LEU A 412D -9.637 65.703 85.098 1.00 17.55 -ATOM 2533 CG LEU A 412D -10.171 64.925 86.316 1.00 15.64 -ATOM 2534 CD1 LEU A 412D -9.537 63.540 86.367 1.00 15.65 -ATOM 2535 CD2 LEU A 412D -9.875 65.672 87.597 1.00 13.66 -ATOM 2536 N THR A 413 -12.328 65.599 83.688 1.00 21.89 -ATOM 2537 CA THR A 413 -13.757 65.384 83.790 1.00 22.76 -ATOM 2538 C THR A 413 -14.501 65.005 82.512 1.00 22.32 -ATOM 2539 O THR A 413 -15.520 64.313 82.559 1.00 21.74 -ATOM 2540 CB THR A 413 -14.407 66.633 84.353 1.00 23.48 -ATOM 2541 OG1 THR A 413 -13.732 67.021 85.557 1.00 25.39 -ATOM 2542 CG2 THR A 413 -15.847 66.364 84.661 1.00 26.10 -ATOM 2543 N GLY A 414 -14.000 65.457 81.373 1.00 22.25 -ATOM 2544 CA GLY A 414 -14.676 65.164 80.127 1.00 21.45 -ATOM 2545 C GLY A 414 -15.663 66.276 79.821 1.00 22.37 -ATOM 2546 O GLY A 414 -16.144 66.387 78.697 1.00 24.79 -ATOM 2547 N LEU A 415 -15.977 67.094 80.822 1.00 21.25 -ATOM 2548 CA LEU A 415 -16.892 68.221 80.647 1.00 20.65 -ATOM 2549 C LEU A 415 -16.321 69.234 79.656 1.00 22.40 -ATOM 2550 O LEU A 415 -15.223 69.053 79.118 1.00 22.21 -ATOM 2551 CB LEU A 415 -17.111 68.930 81.984 1.00 19.36 -ATOM 2552 CG LEU A 415 -18.151 68.426 82.987 1.00 18.30 -ATOM 2553 CD1 LEU A 415 -18.392 66.948 82.824 1.00 18.64 -ATOM 2554 CD2 LEU A 415 -17.681 68.765 84.384 1.00 16.92 -ATOM 2555 N ASP A 416 -17.066 70.313 79.429 1.00 23.81 -ATOM 2556 CA ASP A 416 -16.623 71.370 78.518 1.00 24.02 -ATOM 2557 C ASP A 416 -16.451 72.668 79.301 1.00 22.68 -ATOM 2558 O ASP A 416 -16.460 73.752 78.729 1.00 24.29 -ATOM 2559 CB ASP A 416 -17.646 71.579 77.396 1.00 25.56 -ATOM 2560 CG ASP A 416 -18.930 72.215 77.893 1.00 28.28 -ATOM 2561 OD1 ASP A 416 -19.144 72.208 79.129 1.00 30.71 -ATOM 2562 OD2 ASP A 416 -19.728 72.711 77.055 1.00 28.65 -ATOM 2563 N CYS A 417 -16.311 72.552 80.614 1.00 20.80 -ATOM 2564 CA CYS A 417 -16.134 73.718 81.468 1.00 19.85 -ATOM 2565 C CYS A 417 -15.263 73.358 82.662 1.00 17.29 -ATOM 2566 O CYS A 417 -15.181 72.206 83.048 1.00 17.73 -ATOM 2567 CB CYS A 417 -17.495 74.230 81.950 1.00 22.51 -ATOM 2568 SG CYS A 417 -18.496 72.905 82.690 1.00 26.03 -ATOM 2569 N ILE A 418 -14.593 74.347 83.232 1.00 16.47 -ATOM 2570 CA ILE A 418 -13.746 74.125 84.400 1.00 15.50 -ATOM 2571 C ILE A 418 -14.634 74.063 85.641 1.00 15.12 -ATOM 2572 O ILE A 418 -15.294 75.033 85.970 1.00 14.80 -ATOM 2573 CB ILE A 418 -12.693 75.264 84.516 1.00 14.75 -ATOM 2574 CG1 ILE A 418 -11.606 75.032 83.464 1.00 14.84 -ATOM 2575 CG2 ILE A 418 -12.095 75.323 85.900 1.00 11.25 -ATOM 2576 CD1 ILE A 418 -10.604 76.135 83.347 1.00 14.02 -ATOM 2577 N ARG A 419 -14.648 72.909 86.310 1.00 15.24 -ATOM 2578 CA ARG A 419 -15.469 72.690 87.501 1.00 15.80 -ATOM 2579 C ARG A 419 -14.899 73.205 88.829 1.00 16.44 -ATOM 2580 O ARG A 419 -13.746 72.955 89.174 1.00 16.92 -ATOM 2581 CB ARG A 419 -15.795 71.196 87.652 1.00 16.38 -ATOM 2582 CG ARG A 419 -16.128 70.793 89.094 1.00 19.47 -ATOM 2583 CD ARG A 419 -16.603 69.345 89.244 1.00 22.54 -ATOM 2584 NE ARG A 419 -17.921 69.141 88.636 1.00 25.19 -ATOM 2585 CZ ARG A 419 -18.587 67.990 88.652 1.00 24.31 -ATOM 2586 NH1 ARG A 419 -18.068 66.926 89.246 1.00 24.90 -ATOM 2587 NH2 ARG A 419 -19.773 67.905 88.068 1.00 24.21 -ATOM 2588 N PRO A 420 -15.721 73.926 89.601 1.00 16.66 -ATOM 2589 CA PRO A 420 -15.282 74.461 90.892 1.00 16.21 -ATOM 2590 C PRO A 420 -15.587 73.506 92.060 1.00 17.90 -ATOM 2591 O PRO A 420 -16.676 72.925 92.133 1.00 17.25 -ATOM 2592 CB PRO A 420 -16.073 75.757 91.000 1.00 14.07 -ATOM 2593 CG PRO A 420 -17.374 75.368 90.412 1.00 14.66 -ATOM 2594 CD PRO A 420 -16.990 74.550 89.182 1.00 15.42 -ATOM 2595 N CYS A 421 -14.613 73.344 92.954 1.00 17.63 -ATOM 2596 CA CYS A 421 -14.753 72.501 94.142 1.00 18.08 -ATOM 2597 C CYS A 421 -14.037 73.271 95.263 1.00 16.87 -ATOM 2598 O CYS A 421 -13.494 74.345 95.028 1.00 18.19 -ATOM 2599 CB CYS A 421 -14.059 71.138 93.953 1.00 18.63 -ATOM 2600 SG CYS A 421 -14.586 70.039 92.583 1.00 20.28 -ATOM 2601 N PHE A 422 -14.043 72.742 96.477 1.00 14.73 -ATOM 2602 CA PHE A 422 -13.343 73.393 97.572 1.00 14.56 -ATOM 2603 C PHE A 422 -13.139 72.437 98.738 1.00 14.45 -ATOM 2604 O PHE A 422 -13.814 71.407 98.840 1.00 13.45 -ATOM 2605 CB PHE A 422 -14.081 74.670 98.026 1.00 15.41 -ATOM 2606 CG PHE A 422 -15.369 74.423 98.774 1.00 15.57 -ATOM 2607 CD1 PHE A 422 -15.362 74.220 100.153 1.00 15.26 -ATOM 2608 CD2 PHE A 422 -16.593 74.416 98.103 1.00 13.75 -ATOM 2609 CE1 PHE A 422 -16.554 74.017 100.859 1.00 14.67 -ATOM 2610 CE2 PHE A 422 -17.784 74.212 98.797 1.00 14.48 -ATOM 2611 CZ PHE A 422 -17.764 74.013 100.181 1.00 13.51 -ATOM 2612 N TRP A 423 -12.191 72.776 99.606 1.00 13.20 -ATOM 2613 CA TRP A 423 -11.894 71.952 100.767 1.00 12.72 -ATOM 2614 C TRP A 423 -11.930 72.786 102.040 1.00 11.72 -ATOM 2615 O TRP A 423 -11.844 74.015 101.987 1.00 11.28 -ATOM 2616 CB TRP A 423 -10.510 71.317 100.613 1.00 12.78 -ATOM 2617 CG TRP A 423 -9.416 72.312 100.333 1.00 14.32 -ATOM 2618 CD1 TRP A 423 -8.890 72.638 99.112 1.00 15.32 -ATOM 2619 CD2 TRP A 423 -8.742 73.129 101.287 1.00 14.05 -ATOM 2620 NE1 TRP A 423 -7.930 73.606 99.250 1.00 14.84 -ATOM 2621 CE2 TRP A 423 -7.818 73.928 100.574 1.00 14.98 -ATOM 2622 CE3 TRP A 423 -8.829 73.270 102.675 1.00 14.70 -ATOM 2623 CZ2 TRP A 423 -6.985 74.856 101.207 1.00 15.24 -ATOM 2624 CZ3 TRP A 423 -7.998 74.197 103.306 1.00 15.27 -ATOM 2625 CH2 TRP A 423 -7.090 74.976 102.570 1.00 14.80 -ATOM 2626 N VAL A 424 -12.064 72.112 103.180 1.00 10.74 -ATOM 2627 CA VAL A 424 -12.076 72.790 104.471 1.00 9.47 -ATOM 2628 C VAL A 424 -11.211 72.044 105.488 1.00 11.56 -ATOM 2629 O VAL A 424 -11.367 70.836 105.677 1.00 12.87 -ATOM 2630 CB VAL A 424 -13.493 72.898 105.050 1.00 7.55 -ATOM 2631 CG1 VAL A 424 -13.485 73.829 106.247 1.00 5.96 -ATOM 2632 CG2 VAL A 424 -14.457 73.404 104.002 1.00 7.69 -ATOM 2633 N GLU A 425 -10.284 72.765 106.119 1.00 12.35 -ATOM 2634 CA GLU A 425 -9.412 72.198 107.147 1.00 13.23 -ATOM 2635 C GLU A 425 -10.136 72.259 108.495 1.00 13.80 -ATOM 2636 O GLU A 425 -10.606 73.321 108.904 1.00 13.97 -ATOM 2637 CB GLU A 425 -8.109 72.998 107.256 1.00 13.56 -ATOM 2638 CG GLU A 425 -7.363 72.758 108.575 1.00 14.32 -ATOM 2639 CD GLU A 425 -6.112 73.614 108.726 1.00 15.61 -ATOM 2640 OE1 GLU A 425 -6.222 74.859 108.718 1.00 12.81 -ATOM 2641 OE2 GLU A 425 -5.014 73.035 108.858 1.00 14.33 -ATOM 2642 N LEU A 426 -10.239 71.121 109.173 1.00 13.66 -ATOM 2643 CA LEU A 426 -10.894 71.063 110.476 1.00 14.17 -ATOM 2644 C LEU A 426 -9.794 70.959 111.538 1.00 15.04 -ATOM 2645 O LEU A 426 -9.314 69.866 111.848 1.00 13.31 -ATOM 2646 CB LEU A 426 -11.821 69.847 110.528 1.00 13.92 -ATOM 2647 CG LEU A 426 -12.736 69.752 109.301 1.00 13.26 -ATOM 2648 CD1 LEU A 426 -13.362 68.381 109.212 1.00 13.25 -ATOM 2649 CD2 LEU A 426 -13.802 70.824 109.372 1.00 13.54 -ATOM 2650 N ILE A 427 -9.403 72.113 112.079 1.00 15.51 -ATOM 2651 CA ILE A 427 -8.339 72.215 113.081 1.00 16.95 -ATOM 2652 C ILE A 427 -8.735 71.803 114.495 1.00 17.50 -ATOM 2653 O ILE A 427 -9.696 72.325 115.043 1.00 17.68 -ATOM 2654 CB ILE A 427 -7.803 73.665 113.161 1.00 17.16 -ATOM 2655 CG1 ILE A 427 -7.234 74.094 111.808 1.00 18.23 -ATOM 2656 CG2 ILE A 427 -6.733 73.770 114.241 1.00 17.02 -ATOM 2657 CD1 ILE A 427 -6.877 75.568 111.743 1.00 17.04 -ATOM 2658 N ARG A 428 -7.979 70.881 115.087 1.00 18.57 -ATOM 2659 CA ARG A 428 -8.247 70.430 116.451 1.00 19.49 -ATOM 2660 C ARG A 428 -7.029 70.681 117.322 1.00 20.02 -ATOM 2661 O ARG A 428 -5.906 70.719 116.825 1.00 21.59 -ATOM 2662 CB ARG A 428 -8.583 68.933 116.488 1.00 19.83 -ATOM 2663 CG ARG A 428 -9.887 68.556 115.799 1.00 20.88 -ATOM 2664 CD ARG A 428 -11.037 69.420 116.286 1.00 20.54 -ATOM 2665 NE ARG A 428 -11.339 69.250 117.706 1.00 20.84 -ATOM 2666 CZ ARG A 428 -12.009 68.222 118.220 1.00 21.63 -ATOM 2667 NH1 ARG A 428 -12.237 68.165 119.528 1.00 22.16 -ATOM 2668 NH2 ARG A 428 -12.450 67.248 117.432 1.00 21.63 -ATOM 2669 N GLY A 429 -7.257 70.846 118.622 1.00 20.80 -ATOM 2670 CA GLY A 429 -6.165 71.080 119.555 1.00 20.92 -ATOM 2671 C GLY A 429 -5.983 72.535 119.945 1.00 21.46 -ATOM 2672 O GLY A 429 -6.957 73.259 120.173 1.00 20.84 -ATOM 2673 N ARG A 430 -4.724 72.957 120.021 1.00 22.07 -ATOM 2674 CA ARG A 430 -4.363 74.328 120.372 1.00 22.87 -ATOM 2675 C ARG A 430 -4.605 75.320 119.223 1.00 22.55 -ATOM 2676 O ARG A 430 -4.511 74.972 118.044 1.00 22.68 -ATOM 2677 CB ARG A 430 -2.894 74.366 120.813 1.00 23.97 -ATOM 2678 CG ARG A 430 -2.686 73.854 122.244 1.00 29.02 -ATOM 2679 CD ARG A 430 -1.312 73.202 122.415 1.00 33.61 -ATOM 2680 NE ARG A 430 -0.276 74.110 122.919 1.00 36.92 -ATOM 2681 CZ ARG A 430 1.000 74.073 122.533 1.00 37.89 -ATOM 2682 NH1 ARG A 430 1.404 73.176 121.631 1.00 35.82 -ATOM 2683 NH2 ARG A 430 1.875 74.928 123.053 1.00 36.99 -ATOM 2684 N PRO A 431 -4.892 76.585 119.558 1.00 22.86 -ATOM 2685 CA PRO A 431 -4.990 77.105 120.928 1.00 22.23 -ATOM 2686 C PRO A 431 -6.364 76.995 121.610 1.00 22.86 -ATOM 2687 O PRO A 431 -6.480 77.198 122.822 1.00 23.87 -ATOM 2688 CB PRO A 431 -4.552 78.552 120.758 1.00 20.89 -ATOM 2689 CG PRO A 431 -5.182 78.910 119.451 1.00 22.04 -ATOM 2690 CD PRO A 431 -4.946 77.683 118.572 1.00 21.80 -ATOM 2691 N LYS A 432 -7.400 76.669 120.847 1.00 22.95 -ATOM 2692 CA LYS A 432 -8.747 76.575 121.406 1.00 22.38 -ATOM 2693 C LYS A 432 -9.021 75.419 122.367 1.00 21.76 -ATOM 2694 O LYS A 432 -9.938 75.491 123.178 1.00 21.53 -ATOM 2695 CB LYS A 432 -9.778 76.525 120.275 1.00 21.04 -ATOM 2696 CG LYS A 432 -10.033 77.870 119.627 1.00 21.71 -ATOM 2697 CD LYS A 432 -10.394 78.903 120.691 1.00 23.27 -ATOM 2698 CE LYS A 432 -10.628 80.283 120.103 1.00 23.31 -ATOM 2699 NZ LYS A 432 -10.421 81.343 121.157 1.00 25.54 -ATOM 2700 N GLU A 433 -8.235 74.356 122.280 1.00 21.85 -ATOM 2701 CA GLU A 433 -8.454 73.193 123.133 1.00 19.94 -ATOM 2702 C GLU A 433 -7.212 72.832 123.931 1.00 18.82 -ATOM 2703 O GLU A 433 -6.089 72.971 123.449 1.00 15.10 -ATOM 2704 CB GLU A 433 -8.899 72.005 122.270 1.00 19.78 -ATOM 2705 CG GLU A 433 -10.189 72.251 121.482 1.00 20.21 -ATOM 2706 CD GLU A 433 -10.537 71.095 120.567 1.00 21.04 -ATOM 2707 OE1 GLU A 433 -9.912 70.992 119.491 1.00 20.83 -ATOM 2708 OE2 GLU A 433 -11.417 70.280 120.930 1.00 21.39 -ATOM 2709 N SER A 435 -7.435 72.348 125.149 1.00 19.64 -ATOM 2710 CA SER A 435 -6.345 71.994 126.040 1.00 20.89 -ATOM 2711 C SER A 435 -5.700 70.663 125.716 1.00 19.82 -ATOM 2712 O SER A 435 -6.069 69.620 126.255 1.00 19.84 -ATOM 2713 CB SER A 435 -6.820 72.000 127.497 1.00 22.86 -ATOM 2714 OG SER A 435 -7.688 70.913 127.749 1.00 29.23 -ATOM 2715 N THR A 436 -4.714 70.721 124.832 1.00 18.29 -ATOM 2716 CA THR A 436 -3.964 69.548 124.418 1.00 16.92 -ATOM 2717 C THR A 436 -2.548 70.064 124.251 1.00 16.71 -ATOM 2718 O THR A 436 -2.309 71.249 124.453 1.00 16.35 -ATOM 2719 CB THR A 436 -4.489 68.981 123.073 1.00 15.30 -ATOM 2720 OG1 THR A 436 -4.570 70.034 122.110 1.00 16.16 -ATOM 2721 CG2 THR A 436 -5.863 68.375 123.252 1.00 14.06 -ATOM 2722 N ILE A 437 -1.607 69.193 123.909 1.00 16.51 -ATOM 2723 CA ILE A 437 -0.234 69.641 123.724 1.00 16.13 -ATOM 2724 C ILE A 437 0.047 69.752 122.235 1.00 17.06 -ATOM 2725 O ILE A 437 1.160 70.093 121.838 1.00 16.26 -ATOM 2726 CB ILE A 437 0.806 68.641 124.315 1.00 16.53 -ATOM 2727 CG1 ILE A 437 0.811 67.343 123.495 1.00 16.01 -ATOM 2728 CG2 ILE A 437 0.499 68.354 125.774 1.00 14.58 -ATOM 2729 CD1 ILE A 437 1.848 66.329 123.954 1.00 15.11 -ATOM 2730 N TRP A 438 -0.967 69.477 121.416 1.00 16.65 -ATOM 2731 CA TRP A 438 -0.795 69.494 119.964 1.00 17.11 -ATOM 2732 C TRP A 438 -1.835 70.258 119.147 1.00 17.03 -ATOM 2733 O TRP A 438 -2.830 70.761 119.671 1.00 17.40 -ATOM 2734 CB TRP A 438 -0.769 68.053 119.449 1.00 15.54 -ATOM 2735 CG TRP A 438 -1.963 67.267 119.913 1.00 14.22 -ATOM 2736 CD1 TRP A 438 -2.130 66.675 121.131 1.00 12.52 -ATOM 2737 CD2 TRP A 438 -3.191 67.062 119.199 1.00 14.87 -ATOM 2738 NE1 TRP A 438 -3.383 66.119 121.226 1.00 10.82 -ATOM 2739 CE2 TRP A 438 -4.058 66.342 120.056 1.00 12.80 -ATOM 2740 CE3 TRP A 438 -3.647 67.419 117.919 1.00 14.00 -ATOM 2741 CZ2 TRP A 438 -5.351 65.973 119.677 1.00 11.51 -ATOM 2742 CZ3 TRP A 438 -4.944 67.048 117.543 1.00 13.22 -ATOM 2743 CH2 TRP A 438 -5.775 66.335 118.420 1.00 11.52 -ATOM 2744 N THR A 439 -1.577 70.310 117.842 1.00 16.49 -ATOM 2745 CA THR A 439 -2.457 70.945 116.871 1.00 15.92 -ATOM 2746 C THR A 439 -2.370 70.194 115.542 1.00 16.58 -ATOM 2747 O THR A 439 -1.281 70.001 115.009 1.00 16.91 -ATOM 2748 CB THR A 439 -2.061 72.391 116.595 1.00 15.29 -ATOM 2749 OG1 THR A 439 -2.208 73.173 117.780 1.00 14.39 -ATOM 2750 CG2 THR A 439 -2.940 72.957 115.513 1.00 14.97 -ATOM 2751 N SER A 440 -3.512 69.761 115.015 1.00 17.15 -ATOM 2752 CA SER A 440 -3.543 69.068 113.725 1.00 16.55 -ATOM 2753 C SER A 440 -4.903 69.311 113.090 1.00 16.11 -ATOM 2754 O SER A 440 -5.774 69.914 113.714 1.00 16.84 -ATOM 2755 CB SER A 440 -3.303 67.563 113.893 1.00 17.56 -ATOM 2756 OG SER A 440 -3.054 66.951 112.636 1.00 18.05 -ATOM 2757 N GLY A 441 -5.087 68.847 111.857 1.00 15.74 -ATOM 2758 CA GLY A 441 -6.354 69.057 111.189 1.00 14.51 -ATOM 2759 C GLY A 441 -6.837 67.930 110.300 1.00 14.63 -ATOM 2760 O GLY A 441 -6.060 67.101 109.846 1.00 12.90 -ATOM 2761 N SER A 442 -8.147 67.912 110.071 1.00 15.67 -ATOM 2762 CA SER A 442 -8.807 66.928 109.218 1.00 16.36 -ATOM 2763 C SER A 442 -9.310 67.699 108.016 1.00 14.33 -ATOM 2764 O SER A 442 -9.290 68.924 108.033 1.00 14.66 -ATOM 2765 CB SER A 442 -10.009 66.306 109.943 1.00 18.14 -ATOM 2766 OG SER A 442 -9.772 64.940 110.224 1.00 24.18 -ATOM 2767 N SER A 443 -9.776 66.995 106.988 1.00 12.79 -ATOM 2768 CA SER A 443 -10.300 67.666 105.806 1.00 12.42 -ATOM 2769 C SER A 443 -11.604 67.075 105.276 1.00 14.26 -ATOM 2770 O SER A 443 -11.935 65.922 105.538 1.00 14.93 -ATOM 2771 CB SER A 443 -9.254 67.670 104.681 1.00 11.71 -ATOM 2772 OG SER A 443 -9.099 66.396 104.077 1.00 10.69 -ATOM 2773 N ILE A 444 -12.351 67.907 104.552 1.00 15.33 -ATOM 2774 CA ILE A 444 -13.594 67.524 103.891 1.00 13.96 -ATOM 2775 C ILE A 444 -13.604 68.382 102.635 1.00 15.25 -ATOM 2776 O ILE A 444 -12.998 69.455 102.624 1.00 15.91 -ATOM 2777 CB ILE A 444 -14.860 67.834 104.730 1.00 12.56 -ATOM 2778 CG1 ILE A 444 -14.825 69.272 105.239 1.00 12.23 -ATOM 2779 CG2 ILE A 444 -14.995 66.829 105.850 1.00 11.99 -ATOM 2780 CD1 ILE A 444 -16.086 69.684 105.966 1.00 12.55 -ATOM 2781 N SER A 445 -14.254 67.917 101.570 1.00 15.96 -ATOM 2782 CA SER A 445 -14.299 68.700 100.341 1.00 16.51 -ATOM 2783 C SER A 445 -15.623 68.566 99.582 1.00 18.06 -ATOM 2784 O SER A 445 -16.384 67.611 99.783 1.00 17.89 -ATOM 2785 CB SER A 445 -13.147 68.309 99.427 1.00 17.67 -ATOM 2786 OG SER A 445 -13.340 67.007 98.910 1.00 21.51 -ATOM 2787 N PHE A 446 -15.889 69.536 98.706 1.00 18.43 -ATOM 2788 CA PHE A 446 -17.115 69.557 97.926 1.00 18.23 -ATOM 2789 C PHE A 446 -16.860 70.000 96.493 1.00 18.40 -ATOM 2790 O PHE A 446 -15.799 70.534 96.177 1.00 17.43 -ATOM 2791 CB PHE A 446 -18.124 70.508 98.574 1.00 18.88 -ATOM 2792 CG PHE A 446 -18.498 70.133 99.971 1.00 17.68 -ATOM 2793 CD1 PHE A 446 -17.626 70.357 101.027 1.00 17.01 -ATOM 2794 CD2 PHE A 446 -19.712 69.513 100.229 1.00 18.27 -ATOM 2795 CE1 PHE A 446 -17.958 69.963 102.319 1.00 16.33 -ATOM 2796 CE2 PHE A 446 -20.047 69.119 101.521 1.00 16.84 -ATOM 2797 CZ PHE A 446 -19.165 69.345 102.562 1.00 13.17 -ATOM 2798 N CYS A 447 -17.844 69.777 95.629 1.00 19.22 -ATOM 2799 CA CYS A 447 -17.729 70.174 94.233 1.00 20.65 -ATOM 2800 C CYS A 447 -19.001 70.833 93.694 1.00 21.95 -ATOM 2801 O CYS A 447 -20.100 70.558 94.178 1.00 22.24 -ATOM 2802 CB CYS A 447 -17.361 68.970 93.376 1.00 20.85 -ATOM 2803 SG CYS A 447 -15.603 68.492 93.482 1.00 23.69 -ATOM 2804 N GLY A 448 -18.822 71.693 92.689 1.00 22.32 -ATOM 2805 CA GLY A 448 -19.903 72.420 92.050 1.00 22.44 -ATOM 2806 C GLY A 448 -21.251 71.736 91.936 1.00 24.32 -ATOM 2807 O GLY A 448 -22.078 71.855 92.833 1.00 27.25 -ATOM 2808 N VAL A 449 -21.516 71.065 90.825 1.00 23.82 -ATOM 2809 CA VAL A 449 -22.793 70.360 90.669 1.00 23.45 -ATOM 2810 C VAL A 449 -24.037 71.179 90.296 1.00 23.14 -ATOM 2811 O VAL A 449 -24.286 72.247 90.846 1.00 22.19 -ATOM 2812 CB VAL A 449 -23.093 69.522 91.956 1.00 22.32 -ATOM 2813 CG1 VAL A 449 -24.546 69.139 92.041 1.00 21.37 -ATOM 2814 CG2 VAL A 449 -22.236 68.267 91.943 1.00 23.62 -ATOM 2815 N ASN A 450 -24.811 70.642 89.351 1.00 24.63 -ATOM 2816 CA ASN A 450 -26.057 71.250 88.881 1.00 26.27 -ATOM 2817 C ASN A 450 -27.240 70.718 89.649 1.00 25.72 -ATOM 2818 O ASN A 450 -28.127 71.472 90.040 1.00 28.17 -ATOM 2819 CB ASN A 450 -26.310 70.941 87.414 1.00 28.71 -ATOM 2820 CG ASN A 450 -25.764 71.997 86.511 1.00 31.27 -ATOM 2821 OD1 ASN A 450 -25.735 73.180 86.877 1.00 30.52 -ATOM 2822 ND2 ASN A 450 -25.345 71.595 85.308 1.00 32.76 -ATOM 2823 N SER A 451 -27.261 69.404 89.830 1.00 25.34 -ATOM 2824 CA SER A 451 -28.325 68.721 90.555 1.00 24.21 -ATOM 2825 C SER A 451 -28.446 69.326 91.959 1.00 23.33 -ATOM 2826 O SER A 451 -27.673 70.217 92.309 1.00 20.44 -ATOM 2827 CB SER A 451 -27.976 67.241 90.613 1.00 24.75 -ATOM 2828 OG SER A 451 -26.584 67.081 90.398 1.00 22.39 -ATOM 2829 N ASP A 452 -29.385 68.864 92.781 1.00 24.52 -ATOM 2830 CA ASP A 452 -29.457 69.501 94.085 1.00 25.60 -ATOM 2831 C ASP A 452 -28.484 68.974 95.107 1.00 23.71 -ATOM 2832 O ASP A 452 -27.736 68.024 94.879 1.00 21.53 -ATOM 2833 CB ASP A 452 -30.870 69.498 94.674 1.00 29.81 -ATOM 2834 CG ASP A 452 -31.086 70.655 95.694 1.00 34.40 -ATOM 2835 OD1 ASP A 452 -30.427 71.714 95.553 1.00 34.39 -ATOM 2836 OD2 ASP A 452 -31.929 70.518 96.620 1.00 37.38 -ATOM 2837 N THR A 453 -28.507 69.623 96.254 1.00 21.56 -ATOM 2838 CA THR A 453 -27.596 69.293 97.312 1.00 20.12 -ATOM 2839 C THR A 453 -28.351 69.479 98.602 1.00 19.04 -ATOM 2840 O THR A 453 -29.571 69.592 98.591 1.00 18.50 -ATOM 2841 CB THR A 453 -26.409 70.259 97.247 1.00 20.80 -ATOM 2842 OG1 THR A 453 -26.887 71.599 97.420 1.00 21.54 -ATOM 2843 CG2 THR A 453 -25.732 70.170 95.885 1.00 18.62 -ATOM 2844 N VAL A 454 -27.627 69.499 99.710 1.00 18.23 -ATOM 2845 CA VAL A 454 -28.244 69.706 101.004 1.00 18.43 -ATOM 2846 C VAL A 454 -27.229 70.232 101.986 1.00 19.22 -ATOM 2847 O VAL A 454 -26.025 69.986 101.854 1.00 18.55 -ATOM 2848 CB VAL A 454 -28.853 68.411 101.595 1.00 18.44 -ATOM 2849 CG1 VAL A 454 -30.122 68.057 100.848 1.00 21.61 -ATOM 2850 CG2 VAL A 454 -27.839 67.272 101.538 1.00 14.78 -ATOM 2851 N GLY A 455 -27.733 70.972 102.966 1.00 18.91 -ATOM 2852 CA GLY A 455 -26.880 71.518 103.994 1.00 18.96 -ATOM 2853 C GLY A 455 -26.915 70.540 105.148 1.00 19.42 -ATOM 2854 O GLY A 455 -27.929 69.874 105.381 1.00 18.73 -ATOM 2855 N TRP A 456 -25.802 70.449 105.861 1.00 17.78 -ATOM 2856 CA TRP A 456 -25.694 69.556 106.990 1.00 17.54 -ATOM 2857 C TRP A 456 -24.397 69.896 107.718 1.00 18.28 -ATOM 2858 O TRP A 456 -23.840 70.982 107.539 1.00 18.27 -ATOM 2859 CB TRP A 456 -25.686 68.101 106.500 1.00 18.79 -ATOM 2860 CG TRP A 456 -26.125 67.110 107.551 1.00 18.78 -ATOM 2861 CD1 TRP A 456 -27.077 67.308 108.513 1.00 17.66 -ATOM 2862 CD2 TRP A 456 -25.652 65.768 107.728 1.00 18.76 -ATOM 2863 NE1 TRP A 456 -27.225 66.178 109.278 1.00 17.65 -ATOM 2864 CE2 TRP A 456 -26.363 65.216 108.822 1.00 18.65 -ATOM 2865 CE3 TRP A 456 -24.697 64.979 107.075 1.00 18.78 -ATOM 2866 CZ2 TRP A 456 -26.149 63.912 109.276 1.00 16.61 -ATOM 2867 CZ3 TRP A 456 -24.485 63.681 107.526 1.00 19.24 -ATOM 2868 CH2 TRP A 456 -25.210 63.164 108.619 1.00 19.12 -ATOM 2869 N SER A 457 -23.916 68.986 108.552 1.00 16.49 -ATOM 2870 CA SER A 457 -22.674 69.248 109.257 1.00 16.24 -ATOM 2871 C SER A 457 -21.753 68.033 109.248 1.00 15.80 -ATOM 2872 O SER A 457 -22.083 66.994 109.814 1.00 16.67 -ATOM 2873 CB SER A 457 -22.961 69.677 110.695 1.00 14.76 -ATOM 2874 OG SER A 457 -21.768 69.722 111.449 1.00 13.41 -ATOM 2875 N TRP A 458 -20.609 68.176 108.586 1.00 14.23 -ATOM 2876 CA TRP A 458 -19.602 67.124 108.499 1.00 12.86 -ATOM 2877 C TRP A 458 -18.357 67.582 109.248 1.00 13.50 -ATOM 2878 O TRP A 458 -17.375 67.984 108.631 1.00 14.82 -ATOM 2879 CB TRP A 458 -19.217 66.870 107.046 1.00 12.37 -ATOM 2880 CG TRP A 458 -20.275 66.217 106.227 1.00 14.80 -ATOM 2881 CD1 TRP A 458 -20.520 64.877 106.109 1.00 13.56 -ATOM 2882 CD2 TRP A 458 -21.239 66.875 105.399 1.00 14.52 -ATOM 2883 NE1 TRP A 458 -21.572 64.663 105.256 1.00 13.89 -ATOM 2884 CE2 TRP A 458 -22.034 65.873 104.807 1.00 14.44 -ATOM 2885 CE3 TRP A 458 -21.508 68.217 105.099 1.00 13.40 -ATOM 2886 CZ2 TRP A 458 -23.084 66.171 103.932 1.00 15.35 -ATOM 2887 CZ3 TRP A 458 -22.549 68.511 104.229 1.00 12.96 -ATOM 2888 CH2 TRP A 458 -23.321 67.495 103.657 1.00 13.29 -ATOM 2889 N PRO A 459 -18.377 67.526 110.590 1.00 15.50 -ATOM 2890 CA PRO A 459 -17.222 67.951 111.382 1.00 14.90 -ATOM 2891 C PRO A 459 -16.161 66.859 111.571 1.00 17.22 -ATOM 2892 O PRO A 459 -16.344 65.705 111.177 1.00 16.91 -ATOM 2893 CB PRO A 459 -17.861 68.357 112.700 1.00 12.86 -ATOM 2894 CG PRO A 459 -18.880 67.290 112.868 1.00 12.22 -ATOM 2895 CD PRO A 459 -19.486 67.126 111.476 1.00 13.77 -ATOM 2896 N ASP A 460 -15.056 67.248 112.195 1.00 19.12 -ATOM 2897 CA ASP A 460 -13.951 66.344 112.476 1.00 19.62 -ATOM 2898 C ASP A 460 -14.391 65.095 113.256 1.00 19.69 -ATOM 2899 O ASP A 460 -14.047 63.970 112.893 1.00 19.43 -ATOM 2900 CB ASP A 460 -12.894 67.103 113.258 1.00 21.07 -ATOM 2901 CG ASP A 460 -11.822 66.205 113.788 1.00 23.71 -ATOM 2902 OD1 ASP A 460 -11.971 65.738 114.937 1.00 24.86 -ATOM 2903 OD2 ASP A 460 -10.843 65.957 113.046 1.00 25.18 -ATOM 2904 N GLY A 461 -15.142 65.300 114.333 1.00 19.51 -ATOM 2905 CA GLY A 461 -15.628 64.177 115.121 1.00 19.10 -ATOM 2906 C GLY A 461 -14.680 63.532 116.121 1.00 18.15 -ATOM 2907 O GLY A 461 -15.031 62.530 116.742 1.00 17.41 -ATOM 2908 N ALA A 462 -13.479 64.074 116.283 1.00 18.19 -ATOM 2909 CA ALA A 462 -12.541 63.492 117.240 1.00 19.82 -ATOM 2910 C ALA A 462 -12.880 63.991 118.639 1.00 19.93 -ATOM 2911 O ALA A 462 -13.247 65.151 118.802 1.00 19.86 -ATOM 2912 CB ALA A 462 -11.113 63.883 116.887 1.00 18.12 -ATOM 2913 N GLU A 463 -12.786 63.126 119.644 1.00 20.96 -ATOM 2914 CA GLU A 463 -13.067 63.583 120.999 1.00 23.67 -ATOM 2915 C GLU A 463 -11.773 63.826 121.764 1.00 21.83 -ATOM 2916 O GLU A 463 -10.982 62.919 121.977 1.00 20.44 -ATOM 2917 CB GLU A 463 -13.974 62.602 121.769 1.00 27.31 -ATOM 2918 CG GLU A 463 -13.414 61.225 122.048 1.00 32.61 -ATOM 2919 CD GLU A 463 -14.128 60.545 123.224 1.00 36.61 -ATOM 2920 OE1 GLU A 463 -13.908 60.974 124.388 1.00 35.27 -ATOM 2921 OE2 GLU A 463 -14.916 59.590 122.977 1.00 37.46 -ATOM 2922 N LEU A 464 -11.554 65.078 122.147 1.00 22.07 -ATOM 2923 CA LEU A 464 -10.355 65.455 122.890 1.00 21.11 -ATOM 2924 C LEU A 464 -10.642 65.518 124.393 1.00 21.98 -ATOM 2925 O LEU A 464 -11.803 65.628 124.811 1.00 22.06 -ATOM 2926 CB LEU A 464 -9.842 66.808 122.388 1.00 19.05 -ATOM 2927 CG LEU A 464 -9.395 66.819 120.924 1.00 16.37 -ATOM 2928 CD1 LEU A 464 -8.837 68.157 120.522 1.00 13.48 -ATOM 2929 CD2 LEU A 464 -8.347 65.774 120.761 1.00 16.54 -ATOM 2930 N PRO A 465 -9.590 65.427 125.227 1.00 22.07 -ATOM 2931 CA PRO A 465 -8.182 65.280 124.824 1.00 21.69 -ATOM 2932 C PRO A 465 -7.825 63.834 124.495 1.00 21.97 -ATOM 2933 O PRO A 465 -8.625 62.929 124.746 1.00 22.78 -ATOM 2934 CB PRO A 465 -7.428 65.792 126.041 1.00 21.58 -ATOM 2935 CG PRO A 465 -8.308 65.328 127.172 1.00 21.76 -ATOM 2936 CD PRO A 465 -9.697 65.676 126.677 1.00 20.56 -ATOM 2937 N PHE A 466 -6.638 63.625 123.923 1.00 20.78 -ATOM 2938 CA PHE A 466 -6.177 62.277 123.577 1.00 20.66 -ATOM 2939 C PHE A 466 -5.329 61.748 124.717 1.00 20.33 -ATOM 2940 O PHE A 466 -5.068 62.476 125.676 1.00 20.50 -ATOM 2941 CB PHE A 466 -5.341 62.295 122.290 1.00 19.26 -ATOM 2942 CG PHE A 466 -6.156 62.193 121.026 1.00 17.15 -ATOM 2943 CD1 PHE A 466 -7.508 62.532 121.016 1.00 15.68 -ATOM 2944 CD2 PHE A 466 -5.556 61.793 119.829 1.00 15.88 -ATOM 2945 CE1 PHE A 466 -8.253 62.476 119.832 1.00 14.68 -ATOM 2946 CE2 PHE A 466 -6.289 61.733 118.639 1.00 12.39 -ATOM 2947 CZ PHE A 466 -7.638 62.075 118.642 1.00 14.17 -ATOM 2948 N THR A 467 -4.896 60.489 124.611 1.00 21.13 -ATOM 2949 CA THR A 467 -4.057 59.865 125.644 1.00 20.95 -ATOM 2950 C THR A 467 -2.867 60.794 125.895 1.00 22.64 -ATOM 2951 O THR A 467 -2.182 60.696 126.915 1.00 22.22 -ATOM 2952 CB THR A 467 -3.578 58.464 125.201 1.00 19.82 -ATOM 2953 OG1 THR A 467 -4.718 57.641 124.944 1.00 19.26 -ATOM 2954 CG2 THR A 467 -2.751 57.794 126.290 1.00 18.81 -ATOM 2955 N ILE A 468 -2.674 61.710 124.943 1.00 24.65 -ATOM 2956 CA ILE A 468 -1.654 62.756 124.946 1.00 25.17 -ATOM 2957 C ILE A 468 -0.314 62.319 124.383 1.00 27.82 -ATOM 2958 O ILE A 468 0.029 62.799 123.267 1.00 28.32 -ATOM 2959 CB ILE A 468 -1.464 63.356 126.354 1.00 22.13 -ATOM 2960 CG1 ILE A 468 -2.663 64.255 126.711 1.00 21.59 -ATOM 2961 CG2 ILE A 468 -0.182 64.134 126.403 1.00 21.66 -ATOM 2962 CD1 ILE A 468 -2.739 64.663 128.207 1.00 16.55 -TER 2963 ILE A 468 -ATOM 23705 C1 G39 B 500 -3.037 80.824 111.119 1.00 25.76 -ATOM 23706 O1A G39 B 500 -3.596 81.952 111.239 1.00 25.68 -ATOM 23707 O1B G39 B 500 -3.554 79.790 111.655 1.00 25.94 -ATOM 23708 C2 G39 B 500 -1.811 80.746 110.359 1.00 25.07 -ATOM 23709 C3 G39 B 500 -1.010 79.338 110.137 1.00 25.17 -ATOM 23710 C4 G39 B 500 0.112 79.327 109.004 1.00 24.24 -ATOM 23711 C5 G39 B 500 0.945 80.601 109.144 1.00 23.29 -ATOM 23712 N5 G39 B 500 1.987 80.533 108.049 1.00 24.46 -ATOM 23713 C10 G39 B 500 3.297 80.674 108.332 1.00 23.08 -ATOM 23714 O10 G39 B 500 3.766 80.873 109.491 1.00 23.57 -ATOM 23715 C11 G39 B 500 4.243 80.586 107.191 1.00 20.33 -ATOM 23716 C6 G39 B 500 -0.003 81.869 108.959 1.00 24.45 -ATOM 23717 C7 G39 B 500 -1.270 81.929 109.770 1.00 24.63 -ATOM 23718 O7 G39 B 500 0.846 83.091 109.139 1.00 23.32 -ATOM 23719 C8 G39 B 500 1.210 84.046 108.059 1.00 25.45 -ATOM 23720 C9 G39 B 500 0.051 84.703 107.259 1.00 26.89 -ATOM 23721 C81 G39 B 500 2.091 85.080 108.734 1.00 24.61 -ATOM 23722 C82 G39 B 500 3.462 84.549 109.008 1.00 22.43 -ATOM 23723 C91 G39 B 500 -1.010 85.458 108.077 1.00 26.50 -ATOM 23724 N4 G39 B 500 0.933 78.130 109.177 1.00 23.72 -END diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/README.txt b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/README.txt deleted file mode 100644 index 16cdb8975..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/README.txt +++ /dev/null @@ -1,6 +0,0 @@ -################################################################################ -# Information about configuration files present in the same directory # -################################################################################ -"run-prodigy-prot-lig/data/configurations/raw_input.toml": An untouched copy of the raw input file, as provided by the user. -"run-prodigy-prot-lig/data/configurations/cleaned_input.toml": Pre-parsed input file where (eventually) some indexing and modifications were applied to ensure further processing. -"run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.toml": Final input file with detailed default parameters. diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/cleaned_input.toml b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/cleaned_input.toml deleted file mode 100644 index de20674fa..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/cleaned_input.toml +++ /dev/null @@ -1,12 +0,0 @@ -run_dir = "run-prodigy-prot-lig" -molecules = "data/prot-lig.pdb" - -['topoaa.1'] -ligand_param_fname = "data/ligand-prodrg.param" -ligand_top_fname = "data/ligand-prodrg.top" -delenph = false - -['prodigy.1'] -scoring_mode = "ligand" -ligand_resname = "G39" - diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.json b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.json deleted file mode 100644 index c14c6086c..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.json +++ /dev/null @@ -1,56 +0,0 @@ -{ - "cns_exec": "", - "ncores": 4, - "max_cpus": true, - "mode": "local", - "batch_type": "slurm", - "queue": "", - "queue_limit": 100, - "concat": 1, - "self_contained": false, - "clean": true, - "offline": false, - "debug": false, - "preprocess": false, - "postprocess": true, - "run_dir": "run-prodigy-prot-lig", - "molecules": [ - "data/prot-lig.pdb" - ], - "topoaa.1": { - "ligand_param_fname": "data/ligand-prodrg.param", - "ligand_top_fname": "data/ligand-prodrg.top", - "delenph": false, - "molecules": [ - "data/prot-lig.pdb" - ], - "mol1": { - "cyclicpept": false, - "nhisd": 0, - "hisd_1": NaN, - "nhise": 0, - "hise_1": NaN - }, - "autohis": true, - "log_level": "quiet", - "iniseed": 917, - "limit": true, - "set_bfactor": true, - "tolerance": 0, - "cyclicpept_dist": 2.0, - "disulphide_dist": 2.2 - }, - "prodigy.1": { - "scoring_mode": "ligand", - "ligand_resname": "G39", - "chains": [ - "A", - "B" - ], - "ligand_chain": "B", - "distance_cutoff": NaN, - "accessibility_cutoff": 0.05, - "temperature": 25.0, - "to_pkd": true - } -} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.toml b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.toml deleted file mode 100644 index f78f93a02..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/enhanced_haddock_params.toml +++ /dev/null @@ -1,47 +0,0 @@ -cns_exec = "" -ncores = 4 -max_cpus = true -mode = "local" -batch_type = "slurm" -queue = "" -queue_limit = 100 -concat = 1 -self_contained = false -clean = true -offline = false -debug = false -preprocess = false -postprocess = true -run_dir = "run-prodigy-prot-lig" -molecules = [ "data/prot-lig.pdb",] - -["topoaa.1"] -ligand_param_fname = "data/ligand-prodrg.param" -ligand_top_fname = "data/ligand-prodrg.top" -delenph = false -molecules = [ "data/prot-lig.pdb",] -autohis = true -log_level = "quiet" -iniseed = 917 -limit = true -set_bfactor = true -tolerance = 0 -cyclicpept_dist = 2.0 -disulphide_dist = 2.2 - -["prodigy.1"] -scoring_mode = "ligand" -ligand_resname = "G39" -chains = [ "A", "B",] -ligand_chain = "B" -distance_cutoff = nan -accessibility_cutoff = 0.05 -temperature = 25.0 -to_pkd = true - -["topoaa.1".mol1] -cyclicpept = false -nhisd = 0 -hisd_1 = nan -nhise = 0 -hise_1 = nan diff --git a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/raw_input.toml b/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/raw_input.toml deleted file mode 100644 index 8c0d6253b..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-lig/data/configurations/raw_input.toml +++ /dev/null @@ -1,12 +0,0 @@ -run_dir = "run-prodigy-prot-lig" -molecules = "data/prot-lig.pdb" - -[topoaa] -ligand_param_fname = "data/ligand-prodrg.param" -ligand_top_fname = "data/ligand-prodrg.top" -delenph = false - -[prodigy] -scoring_mode = "ligand" -ligand_resname = "G39" - diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.pdb b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.pdb deleted file mode 100644 index e2a1bdffa..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.pdb +++ /dev/null @@ -1,3487 +0,0 @@ -REMARK FILENAME="homotrimer_haddock.pdb" -REMARK Patching histidine 98 to HISD -REMARK Patching histidine 98 to HISD -REMARK Patching histidine 98 to HISD -REMARK DATE:01-Oct-2024 16:32:31 created by user: unknown -REMARK VERSION:1.3U -ATOM 1 N SER A 2 59.765 62.037 75.182 1.00 15.00 A N -ATOM 2 HN SER A 2 60.123 61.199 75.545 1.00 15.00 A H -ATOM 3 CA SER A 2 58.567 61.999 74.352 1.00 15.00 A C -ATOM 4 CB SER A 2 58.695 60.919 73.274 1.00 15.00 A C -ATOM 5 OG SER A 2 58.712 59.622 73.847 1.00 15.00 A O -ATOM 6 HG SER A 2 57.821 59.263 73.850 1.00 15.00 A H -ATOM 7 C SER A 2 57.319 61.757 75.197 1.00 15.00 A C -ATOM 8 O SER A 2 57.404 61.238 76.310 1.00 15.00 A O -ATOM 9 N LYS A 3 56.160 62.139 74.664 1.00 15.00 A N -ATOM 10 HN LYS A 3 56.156 62.550 73.775 1.00 15.00 A H -ATOM 11 CA LYS A 3 54.894 61.962 75.373 1.00 15.00 A C -ATOM 12 CB LYS A 3 54.536 63.226 76.165 1.00 15.00 A C -ATOM 13 CG LYS A 3 54.121 64.410 75.304 1.00 15.00 A C -ATOM 14 CD LYS A 3 53.999 65.688 76.121 1.00 15.00 A C -ATOM 15 CE LYS A 3 55.366 66.241 76.494 1.00 15.00 A C -ATOM 16 NZ LYS A 3 55.282 67.644 76.989 1.00 15.00 A N -ATOM 17 HZ1 LYS A 3 56.225 67.981 77.270 1.00 15.00 A H -ATOM 18 HZ2 LYS A 3 54.648 67.697 77.811 1.00 15.00 A H -ATOM 19 HZ3 LYS A 3 54.914 68.265 76.240 1.00 15.00 A H -ATOM 20 C LYS A 3 53.761 61.588 74.416 1.00 15.00 A C -ATOM 21 O LYS A 3 53.877 61.757 73.203 1.00 15.00 A O -ATOM 22 N THR A 4 52.670 61.076 74.975 1.00 15.00 A N -ATOM 23 HN THR A 4 52.646 60.956 75.947 1.00 15.00 A H -ATOM 24 CA THR A 4 51.506 60.676 74.185 1.00 15.00 A C -ATOM 25 CB THR A 4 50.730 59.539 74.894 1.00 15.00 A C -ATOM 26 OG1 THR A 4 51.499 58.331 74.858 1.00 15.00 A O -ATOM 27 HG1 THR A 4 50.939 57.587 75.099 1.00 15.00 A H -ATOM 28 CG2 THR A 4 49.375 59.291 74.243 1.00 15.00 A C -ATOM 29 C THR A 4 50.559 61.856 73.951 1.00 15.00 A C -ATOM 30 O THR A 4 50.301 62.648 74.859 1.00 15.00 A O -ATOM 31 N ILE A 5 50.054 61.971 72.724 1.00 15.00 A N -ATOM 32 HN ILE A 5 50.321 61.326 72.037 1.00 15.00 A H -ATOM 33 CA ILE A 5 49.113 63.031 72.377 1.00 15.00 A C -ATOM 34 CB ILE A 5 49.372 63.598 70.962 1.00 15.00 A C -ATOM 35 CG1 ILE A 5 50.797 64.150 70.855 1.00 15.00 A C -ATOM 36 CG2 ILE A 5 48.355 64.683 70.630 1.00 15.00 A C -ATOM 37 CD1 ILE A 5 51.146 64.692 69.486 1.00 15.00 A C -ATOM 38 C ILE A 5 47.684 62.497 72.456 1.00 15.00 A C -ATOM 39 O ILE A 5 47.277 61.664 71.645 1.00 15.00 A O -ATOM 40 N ALA A 6 46.934 62.971 73.446 1.00 15.00 A N -ATOM 41 HN ALA A 6 47.314 63.633 74.059 1.00 15.00 A H -ATOM 42 CA ALA A 6 45.556 62.533 73.637 1.00 15.00 A C -ATOM 43 CB ALA A 6 45.420 61.765 74.943 1.00 15.00 A C -ATOM 44 C ALA A 6 44.582 63.706 73.601 1.00 15.00 A C -ATOM 45 O ALA A 6 44.637 64.600 74.446 1.00 15.00 A O -ATOM 46 N THR A 7 43.688 63.689 72.617 1.00 15.00 A N -ATOM 47 HN THR A 7 43.702 62.949 71.974 1.00 15.00 A H -ATOM 48 CA THR A 7 42.692 64.741 72.462 1.00 15.00 A C -ATOM 49 CB THR A 7 43.093 65.768 71.377 1.00 15.00 A C -ATOM 50 OG1 THR A 7 42.064 66.755 71.230 1.00 15.00 A O -ATOM 51 HG1 THR A 7 42.378 67.466 70.667 1.00 15.00 A H -ATOM 52 CG2 THR A 7 43.342 65.089 70.038 1.00 15.00 A C -ATOM 53 C THR A 7 41.310 64.161 72.155 1.00 15.00 A C -ATOM 54 O THR A 7 41.182 63.143 71.473 1.00 15.00 A O -ATOM 55 N GLU A 8 40.281 64.824 72.673 1.00 15.00 A N -ATOM 56 HN GLU A 8 40.457 65.625 73.211 1.00 15.00 A H -ATOM 57 CA GLU A 8 38.896 64.403 72.473 1.00 15.00 A C -ATOM 58 CB GLU A 8 38.014 64.957 73.602 1.00 15.00 A C -ATOM 59 CG GLU A 8 37.682 66.444 73.479 1.00 15.00 A C -ATOM 60 CD GLU A 8 38.722 67.367 74.098 1.00 15.00 A C -ATOM 61 OE1 GLU A 8 39.841 66.900 74.400 1.00 15.00 A O -ATOM 62 OE2 GLU A 8 38.415 68.563 74.277 1.00 15.00 A O -ATOM 63 C GLU A 8 38.368 64.890 71.125 1.00 15.00 A C -ATOM 64 O GLU A 8 37.280 64.506 70.693 1.00 15.00 A O -ATOM 65 N ASN A 9 39.158 65.732 70.467 1.00 15.00 A N -ATOM 66 HN ASN A 9 40.020 65.979 70.862 1.00 15.00 A H -ATOM 67 CA ASN A 9 38.785 66.293 69.175 1.00 15.00 A C -ATOM 68 CB ASN A 9 39.493 67.633 68.963 1.00 15.00 A C -ATOM 69 CG ASN A 9 39.035 68.677 69.964 1.00 15.00 A C -ATOM 70 OD1 ASN A 9 37.852 68.757 70.297 1.00 15.00 A O -ATOM 71 ND2 ASN A 9 39.972 69.476 70.466 1.00 15.00 A N -ATOM 72 HD21 ASN A 9 40.895 69.351 70.166 1.00 15.00 A H -ATOM 73 HD22 ASN A 9 39.698 70.156 71.117 1.00 15.00 A H -ATOM 74 C ASN A 9 39.071 65.320 68.033 1.00 15.00 A C -ATOM 75 O ASN A 9 38.744 65.586 66.878 1.00 15.00 A O -ATOM 76 N ALA A 10 39.688 64.194 68.375 1.00 15.00 A N -ATOM 77 HN ALA A 10 39.943 64.058 69.311 1.00 15.00 A H -ATOM 78 CA ALA A 10 40.001 63.155 67.403 1.00 15.00 A C -ATOM 79 CB ALA A 10 41.507 63.074 67.190 1.00 15.00 A C -ATOM 80 C ALA A 10 39.456 61.818 67.901 1.00 15.00 A C -ATOM 81 O ALA A 10 39.285 61.637 69.108 1.00 15.00 A O -ATOM 82 N PRO A 11 39.151 60.872 66.983 1.00 15.00 A N -ATOM 83 CA PRO A 11 38.631 59.545 67.345 1.00 15.00 A C -ATOM 84 CB PRO A 11 38.715 58.764 66.034 1.00 15.00 A C -ATOM 85 CG PRO A 11 38.599 59.806 64.979 1.00 15.00 A C -ATOM 86 CD PRO A 11 39.277 61.031 65.524 1.00 15.00 A C -ATOM 87 C PRO A 11 39.491 58.876 68.412 1.00 15.00 A C -ATOM 88 O PRO A 11 40.707 58.752 68.252 1.00 15.00 A O -ATOM 89 N ALA A 12 38.846 58.455 69.498 1.00 15.00 A N -ATOM 90 HN ALA A 12 37.874 58.578 69.547 1.00 15.00 A H -ATOM 91 CA ALA A 12 39.532 57.818 70.619 1.00 15.00 A C -ATOM 92 CB ALA A 12 38.536 57.447 71.707 1.00 15.00 A C -ATOM 93 C ALA A 12 40.340 56.595 70.195 1.00 15.00 A C -ATOM 94 O ALA A 12 39.880 55.773 69.400 1.00 15.00 A O -ATOM 95 N ALA A 13 41.553 56.494 70.732 1.00 15.00 A N -ATOM 96 HN ALA A 13 41.861 57.193 71.346 1.00 15.00 A H -ATOM 97 CA ALA A 13 42.439 55.375 70.437 1.00 15.00 A C -ATOM 98 CB ALA A 13 43.881 55.767 70.721 1.00 15.00 A C -ATOM 99 C ALA A 13 42.037 54.151 71.258 1.00 15.00 A C -ATOM 100 O ALA A 13 42.488 53.971 72.389 1.00 15.00 A O -ATOM 101 N ILE A 14 41.177 53.319 70.677 1.00 15.00 A N -ATOM 102 HN ILE A 14 40.867 53.518 69.770 1.00 15.00 A H -ATOM 103 CA ILE A 14 40.680 52.122 71.348 1.00 15.00 A C -ATOM 104 CB ILE A 14 39.292 51.711 70.805 1.00 15.00 A C -ATOM 105 CG1 ILE A 14 38.313 52.886 70.907 1.00 15.00 A C -ATOM 106 CG2 ILE A 14 38.755 50.503 71.560 1.00 15.00 A C -ATOM 107 CD1 ILE A 14 36.987 52.648 70.222 1.00 15.00 A C -ATOM 108 C ILE A 14 41.644 50.944 71.220 1.00 15.00 A C -ATOM 109 O ILE A 14 41.882 50.220 72.188 1.00 15.00 A O -ATOM 110 N GLY A 15 42.198 50.753 70.025 1.00 15.00 A N -ATOM 111 HN GLY A 15 41.982 51.366 69.290 1.00 15.00 A H -ATOM 112 CA GLY A 15 43.122 49.654 69.804 1.00 15.00 A C -ATOM 113 C GLY A 15 44.475 49.887 70.449 1.00 15.00 A C -ATOM 114 O GLY A 15 44.650 50.854 71.194 1.00 15.00 A O -ATOM 115 N PRO A 16 45.456 49.006 70.189 1.00 15.00 A N -ATOM 116 CA PRO A 16 46.799 49.139 70.749 1.00 15.00 A C -ATOM 117 CB PRO A 16 47.410 47.751 70.554 1.00 15.00 A C -ATOM 118 CG PRO A 16 46.670 47.151 69.404 1.00 15.00 A C -ATOM 119 CD PRO A 16 45.316 47.807 69.345 1.00 15.00 A C -ATOM 120 C PRO A 16 47.624 50.206 70.027 1.00 15.00 A C -ATOM 121 O PRO A 16 48.583 49.898 69.318 1.00 15.00 A O -ATOM 122 N TYR A 17 47.237 51.466 70.223 1.00 15.00 A N -ATOM 123 HN TYR A 17 46.465 51.638 70.803 1.00 15.00 A H -ATOM 124 CA TYR A 17 47.918 52.596 69.603 1.00 15.00 A C -ATOM 125 CB TYR A 17 47.613 52.641 68.097 1.00 15.00 A C -ATOM 126 CG TYR A 17 46.170 52.976 67.776 1.00 15.00 A C -ATOM 127 CD1 TYR A 17 45.779 54.285 67.517 1.00 15.00 A C -ATOM 128 CD2 TYR A 17 45.197 51.986 67.738 1.00 15.00 A C -ATOM 129 CE1 TYR A 17 44.461 54.598 67.245 1.00 15.00 A C -ATOM 130 CE2 TYR A 17 43.879 52.289 67.460 1.00 15.00 A C -ATOM 131 CZ TYR A 17 43.516 53.595 67.214 1.00 15.00 A C -ATOM 132 OH TYR A 17 42.202 53.901 66.947 1.00 15.00 A O -ATOM 133 HH TYR A 17 42.162 54.583 66.273 1.00 15.00 A H -ATOM 134 C TYR A 17 47.467 53.908 70.238 1.00 15.00 A C -ATOM 135 O TYR A 17 46.443 53.961 70.917 1.00 15.00 A O -ATOM 136 N VAL A 18 48.251 54.956 70.023 1.00 15.00 A N -ATOM 137 HN VAL A 18 49.082 54.834 69.519 1.00 15.00 A H -ATOM 138 CA VAL A 18 47.915 56.285 70.522 1.00 15.00 A C -ATOM 139 CB VAL A 18 49.036 56.890 71.396 1.00 15.00 A C -ATOM 140 CG1 VAL A 18 49.183 56.107 72.691 1.00 15.00 A C -ATOM 141 CG2 VAL A 18 50.355 56.941 70.637 1.00 15.00 A C -ATOM 142 C VAL A 18 47.642 57.199 69.333 1.00 15.00 A C -ATOM 143 O VAL A 18 48.097 56.918 68.229 1.00 15.00 A O -ATOM 144 N GLN A 19 46.895 58.277 69.551 1.00 15.00 A N -ATOM 145 HN GLN A 19 46.552 58.448 70.453 1.00 15.00 A H -ATOM 146 CA GLN A 19 46.563 59.212 68.472 1.00 15.00 A C -ATOM 147 CB GLN A 19 45.624 60.305 68.973 1.00 15.00 A C -ATOM 148 CG GLN A 19 44.222 59.819 69.300 1.00 15.00 A C -ATOM 149 CD GLN A 19 43.424 60.855 70.061 1.00 15.00 A C -ATOM 150 OE1 GLN A 19 43.987 61.655 70.801 1.00 15.00 A O -ATOM 151 NE2 GLN A 19 42.111 60.848 69.884 1.00 15.00 A N -ATOM 152 HE21 GLN A 19 41.729 60.180 69.276 1.00 15.00 A H -ATOM 153 HE22 GLN A 19 41.575 61.513 70.367 1.00 15.00 A H -ATOM 154 C GLN A 19 47.804 59.832 67.828 1.00 15.00 A C -ATOM 155 O GLN A 19 47.857 60.008 66.612 1.00 15.00 A O -ATOM 156 N GLY A 20 48.797 60.158 68.648 1.00 15.00 A N -ATOM 157 HN GLY A 20 48.700 59.990 69.608 1.00 15.00 A H -ATOM 158 CA GLY A 20 50.021 60.752 68.142 1.00 15.00 A C -ATOM 159 C GLY A 20 51.104 60.808 69.199 1.00 15.00 A C -ATOM 160 O GLY A 20 50.857 60.478 70.358 1.00 15.00 A O -ATOM 161 N VAL A 21 52.306 61.224 68.806 1.00 15.00 A N -ATOM 162 HN VAL A 21 52.446 61.471 67.868 1.00 15.00 A H -ATOM 163 CA VAL A 21 53.421 61.312 69.744 1.00 15.00 A C -ATOM 164 CB VAL A 21 54.423 60.145 69.589 1.00 15.00 A C -ATOM 165 CG1 VAL A 21 53.849 58.860 70.169 1.00 15.00 A C -ATOM 166 CG2 VAL A 21 54.816 59.951 68.130 1.00 15.00 A C -ATOM 167 C VAL A 21 54.171 62.639 69.643 1.00 15.00 A C -ATOM 168 O VAL A 21 54.460 63.130 68.551 1.00 15.00 A O -ATOM 169 N ASP A 22 54.470 63.210 70.803 1.00 15.00 A N -ATOM 170 HN ASP A 22 54.181 62.774 71.631 1.00 15.00 A H -ATOM 171 CA ASP A 22 55.207 64.463 70.892 1.00 15.00 A C -ATOM 172 CB ASP A 22 54.546 65.368 71.941 1.00 15.00 A C -ATOM 173 CG ASP A 22 55.097 66.783 71.980 1.00 15.00 A C -ATOM 174 OD1 ASP A 22 54.507 67.621 72.693 1.00 15.00 A O -ATOM 175 OD2 ASP A 22 56.113 67.057 71.307 1.00 15.00 A O -ATOM 176 C ASP A 22 56.647 64.153 71.292 1.00 15.00 A C -ATOM 177 O ASP A 22 56.934 63.897 72.460 1.00 15.00 A O -ATOM 178 N LEU A 23 57.546 64.170 70.313 1.00 15.00 A N -ATOM 179 HN LEU A 23 57.256 64.398 69.405 1.00 15.00 A H -ATOM 180 CA LEU A 23 58.956 63.864 70.555 1.00 15.00 A C -ATOM 181 CB LEU A 23 59.529 63.075 69.374 1.00 15.00 A C -ATOM 182 CG LEU A 23 58.592 62.059 68.719 1.00 15.00 A C -ATOM 183 CD1 LEU A 23 59.205 61.514 67.441 1.00 15.00 A C -ATOM 184 CD2 LEU A 23 58.266 60.930 69.682 1.00 15.00 A C -ATOM 185 C LEU A 23 59.779 65.131 70.764 1.00 15.00 A C -ATOM 186 O LEU A 23 61.007 65.110 70.656 1.00 15.00 A O -ATOM 187 N GLY A 24 59.102 66.228 71.072 1.00 15.00 A N -ATOM 188 HN GLY A 24 58.127 66.185 71.158 1.00 15.00 A H -ATOM 189 CA GLY A 24 59.789 67.485 71.275 1.00 15.00 A C -ATOM 190 C GLY A 24 59.585 68.410 70.099 1.00 15.00 A C -ATOM 191 O GLY A 24 58.560 69.072 70.002 1.00 15.00 A O -ATOM 192 N ASN A 25 60.552 68.441 69.190 1.00 15.00 A N -ATOM 193 HN ASN A 25 61.347 67.882 69.315 1.00 15.00 A H -ATOM 194 CA ASN A 25 60.455 69.288 68.009 1.00 15.00 A C -ATOM 195 CB ASN A 25 61.847 69.578 67.436 1.00 15.00 A C -ATOM 196 CG ASN A 25 61.801 70.428 66.178 1.00 15.00 A C -ATOM 197 OD1 ASN A 25 61.381 71.583 66.214 1.00 15.00 A O -ATOM 198 ND2 ASN A 25 62.235 69.859 65.060 1.00 15.00 A N -ATOM 199 HD21 ASN A 25 62.558 68.934 65.105 1.00 15.00 A H -ATOM 200 HD22 ASN A 25 62.216 70.386 64.233 1.00 15.00 A H -ATOM 201 C ASN A 25 59.569 68.644 66.948 1.00 15.00 A C -ATOM 202 O ASN A 25 58.831 69.329 66.245 1.00 15.00 A O -ATOM 203 N MET A 26 59.633 67.319 66.853 1.00 15.00 A N -ATOM 204 HN MET A 26 60.220 66.823 67.461 1.00 15.00 A H -ATOM 205 CA MET A 26 58.846 66.589 65.870 1.00 15.00 A C -ATOM 206 CB MET A 26 59.713 65.558 65.143 1.00 15.00 A C -ATOM 207 CG MET A 26 58.960 64.714 64.128 1.00 15.00 A C -ATOM 208 SD MET A 26 60.044 63.655 63.155 1.00 15.00 A S -ATOM 209 CE MET A 26 60.944 64.874 62.204 1.00 15.00 A C -ATOM 210 C MET A 26 57.624 65.913 66.487 1.00 15.00 A C -ATOM 211 O MET A 26 57.700 65.310 67.556 1.00 15.00 A O -ATOM 212 N ILE A 27 56.499 66.034 65.792 1.00 15.00 A N -ATOM 213 HN ILE A 27 56.516 66.547 64.958 1.00 15.00 A H -ATOM 214 CA ILE A 27 55.240 65.434 66.214 1.00 15.00 A C -ATOM 215 CB ILE A 27 54.162 66.519 66.490 1.00 15.00 A C -ATOM 216 CG1 ILE A 27 54.263 67.032 67.930 1.00 15.00 A C -ATOM 217 CG2 ILE A 27 52.753 66.012 66.202 1.00 15.00 A C -ATOM 218 CD1 ILE A 27 55.306 68.109 68.131 1.00 15.00 A C -ATOM 219 C ILE A 27 54.762 64.472 65.126 1.00 15.00 A C -ATOM 220 O ILE A 27 54.687 64.838 63.955 1.00 15.00 A O -ATOM 221 N ILE A 28 54.464 63.237 65.509 1.00 15.00 A N -ATOM 222 HN ILE A 28 54.544 62.994 66.455 1.00 15.00 A H -ATOM 223 CA ILE A 28 54.011 62.238 64.549 1.00 15.00 A C -ATOM 224 CB ILE A 28 55.001 61.058 64.439 1.00 15.00 A C -ATOM 225 CG1 ILE A 28 56.423 61.582 64.202 1.00 15.00 A C -ATOM 226 CG2 ILE A 28 54.587 60.122 63.312 1.00 15.00 A C -ATOM 227 CD1 ILE A 28 57.488 60.509 64.220 1.00 15.00 A C -ATOM 228 C ILE A 28 52.623 61.718 64.902 1.00 15.00 A C -ATOM 229 O ILE A 28 52.389 61.245 66.009 1.00 15.00 A O -ATOM 230 N THR A 29 51.706 61.812 63.945 1.00 15.00 A N -ATOM 231 HN THR A 29 51.961 62.188 63.078 1.00 15.00 A H -ATOM 232 CA THR A 29 50.334 61.364 64.148 1.00 15.00 A C -ATOM 233 CB THR A 29 49.326 62.344 63.506 1.00 15.00 A C -ATOM 234 OG1 THR A 29 49.270 62.120 62.090 1.00 15.00 A O -ATOM 235 HG1 THR A 29 48.729 62.798 61.680 1.00 15.00 A H -ATOM 236 CG2 THR A 29 49.737 63.786 63.765 1.00 15.00 A C -ATOM 237 C THR A 29 50.118 59.981 63.541 1.00 15.00 A C -ATOM 238 O THR A 29 50.876 59.549 62.670 1.00 15.00 A O -ATOM 239 N SER A 30 49.089 59.288 64.012 1.00 15.00 A N -ATOM 240 HN SER A 30 48.538 59.674 64.727 1.00 15.00 A H -ATOM 241 CA SER A 30 48.759 57.966 63.494 1.00 15.00 A C -ATOM 242 CB SER A 30 47.953 57.180 64.528 1.00 15.00 A C -ATOM 243 OG SER A 30 48.725 56.923 65.681 1.00 15.00 A O -ATOM 244 HG SER A 30 48.166 56.985 66.462 1.00 15.00 A H -ATOM 245 C SER A 30 47.935 58.104 62.224 1.00 15.00 A C -ATOM 246 O SER A 30 47.456 59.196 61.911 1.00 15.00 A O -ATOM 247 N GLY A 31 47.785 57.002 61.489 1.00 15.00 A N -ATOM 248 HN GLY A 31 48.227 56.172 61.769 1.00 15.00 A H -ATOM 249 CA GLY A 31 46.985 57.025 60.278 1.00 15.00 A C -ATOM 250 C GLY A 31 45.551 57.386 60.598 1.00 15.00 A C -ATOM 251 O GLY A 31 44.807 56.570 61.143 1.00 15.00 A O -ATOM 252 N GLN A 32 45.167 58.615 60.272 1.00 15.00 A N -ATOM 253 HN GLN A 32 45.800 59.211 59.817 1.00 15.00 A H -ATOM 254 CA GLN A 32 43.827 59.096 60.566 1.00 15.00 A C -ATOM 255 CB GLN A 32 43.817 60.615 60.755 1.00 15.00 A C -ATOM 256 CG GLN A 32 44.532 61.114 62.002 1.00 15.00 A C -ATOM 257 CD GLN A 32 44.168 60.336 63.251 1.00 15.00 A C -ATOM 258 OE1 GLN A 32 43.053 60.443 63.763 1.00 15.00 A O -ATOM 259 NE2 GLN A 32 45.124 59.573 63.768 1.00 15.00 A N -ATOM 260 HE21 GLN A 32 45.995 59.557 63.318 1.00 15.00 A H -ATOM 261 HE22 GLN A 32 44.922 59.062 64.578 1.00 15.00 A H -ATOM 262 C GLN A 32 42.811 58.712 59.504 1.00 15.00 A C -ATOM 263 O GLN A 32 42.968 59.035 58.327 1.00 15.00 A O -ATOM 264 N ILE A 33 41.770 58.016 59.938 1.00 15.00 A N -ATOM 265 HN ILE A 33 41.727 57.763 60.884 1.00 15.00 A H -ATOM 266 CA ILE A 33 40.693 57.618 59.049 1.00 15.00 A C -ATOM 267 CB ILE A 33 40.232 56.164 59.302 1.00 15.00 A C -ATOM 268 CG1 ILE A 33 39.904 55.935 60.780 1.00 15.00 A C -ATOM 269 CG2 ILE A 33 41.299 55.186 58.829 1.00 15.00 A C -ATOM 270 CD1 ILE A 33 39.412 54.536 61.088 1.00 15.00 A C -ATOM 271 C ILE A 33 39.533 58.605 59.207 1.00 15.00 A C -ATOM 272 O ILE A 33 39.474 59.326 60.204 1.00 15.00 A O -ATOM 273 N PRO A 34 38.614 58.670 58.225 1.00 15.00 A N -ATOM 274 CA PRO A 34 37.474 59.605 58.248 1.00 15.00 A C -ATOM 275 CB PRO A 34 36.907 59.495 56.833 1.00 15.00 A C -ATOM 276 CG PRO A 34 37.287 58.127 56.388 1.00 15.00 A C -ATOM 277 CD PRO A 34 38.628 57.855 56.998 1.00 15.00 A C -ATOM 278 C PRO A 34 36.382 59.287 59.277 1.00 15.00 A C -ATOM 279 O PRO A 34 35.200 59.233 58.937 1.00 15.00 A O -ATOM 280 N VAL A 35 36.767 59.106 60.534 1.00 15.00 A N -ATOM 281 HN VAL A 35 37.720 59.158 60.755 1.00 15.00 A H -ATOM 282 CA VAL A 35 35.801 58.826 61.591 1.00 15.00 A C -ATOM 283 CB VAL A 35 36.303 57.724 62.552 1.00 15.00 A C -ATOM 284 CG1 VAL A 35 35.375 57.581 63.752 1.00 15.00 A C -ATOM 285 CG2 VAL A 35 36.420 56.399 61.819 1.00 15.00 A C -ATOM 286 C VAL A 35 35.497 60.097 62.381 1.00 15.00 A C -ATOM 287 O VAL A 35 36.407 60.757 62.883 1.00 15.00 A O -ATOM 288 N ASN A 36 34.215 60.444 62.463 1.00 15.00 A N -ATOM 289 HN ASN A 36 33.542 59.892 62.014 1.00 15.00 A H -ATOM 290 CA ASN A 36 33.786 61.626 63.200 1.00 15.00 A C -ATOM 291 CB ASN A 36 32.310 61.924 62.899 1.00 15.00 A C -ATOM 292 CG ASN A 36 31.863 63.308 63.342 1.00 15.00 A C -ATOM 293 OD1 ASN A 36 32.119 63.731 64.464 1.00 15.00 A O -ATOM 294 ND2 ASN A 36 31.192 64.026 62.450 1.00 15.00 A N -ATOM 295 HD21 ASN A 36 31.025 63.631 61.569 1.00 15.00 A H -ATOM 296 HD22 ASN A 36 30.891 64.922 62.710 1.00 15.00 A H -ATOM 297 C ASN A 36 33.994 61.397 64.697 1.00 15.00 A C -ATOM 298 O ASN A 36 33.482 60.437 65.255 1.00 15.00 A O -ATOM 299 N PRO A 37 34.773 62.264 65.360 1.00 15.00 A N -ATOM 300 CA PRO A 37 35.048 62.138 66.800 1.00 15.00 A C -ATOM 301 CB PRO A 37 36.106 63.219 67.049 1.00 15.00 A C -ATOM 302 CG PRO A 37 35.893 64.213 65.958 1.00 15.00 A C -ATOM 303 CD PRO A 37 35.460 63.423 64.761 1.00 15.00 A C -ATOM 304 C PRO A 37 33.820 62.395 67.680 1.00 15.00 A C -ATOM 305 O PRO A 37 33.795 62.009 68.848 1.00 15.00 A O -ATOM 306 N LYS A 38 32.801 63.032 67.108 1.00 15.00 A N -ATOM 307 HN LYS A 38 32.869 63.287 66.165 1.00 15.00 A H -ATOM 308 CA LYS A 38 31.583 63.362 67.845 1.00 15.00 A C -ATOM 309 CB LYS A 38 31.037 64.712 67.372 1.00 15.00 A C -ATOM 310 CG LYS A 38 29.759 65.158 68.064 1.00 15.00 A C -ATOM 311 CD LYS A 38 29.195 66.415 67.426 1.00 15.00 A C -ATOM 312 CE LYS A 38 30.150 67.591 67.570 1.00 15.00 A C -ATOM 313 NZ LYS A 38 30.411 67.921 68.998 1.00 15.00 A N -ATOM 314 HZ1 LYS A 38 30.811 67.096 69.488 1.00 15.00 A H -ATOM 315 HZ2 LYS A 38 29.524 68.192 69.469 1.00 15.00 A H -ATOM 316 HZ3 LYS A 38 31.083 68.713 69.067 1.00 15.00 A H -ATOM 317 C LYS A 38 30.499 62.285 67.734 1.00 15.00 A C -ATOM 318 O LYS A 38 29.796 62.010 68.707 1.00 15.00 A O -ATOM 319 N THR A 39 30.359 61.678 66.558 1.00 15.00 A N -ATOM 320 HN THR A 39 30.954 61.916 65.817 1.00 15.00 A H -ATOM 321 CA THR A 39 29.332 60.653 66.359 1.00 15.00 A C -ATOM 322 CB THR A 39 28.415 60.975 65.159 1.00 15.00 A C -ATOM 323 OG1 THR A 39 29.189 61.063 63.955 1.00 15.00 A O -ATOM 324 HG1 THR A 39 28.677 60.717 63.220 1.00 15.00 A H -ATOM 325 CG2 THR A 39 27.675 62.286 65.380 1.00 15.00 A C -ATOM 326 C THR A 39 29.927 59.261 66.174 1.00 15.00 A C -ATOM 327 O THR A 39 29.299 58.259 66.511 1.00 15.00 A O -ATOM 328 N GLY A 40 31.139 59.207 65.638 1.00 15.00 A N -ATOM 329 HN GLY A 40 31.597 60.041 65.401 1.00 15.00 A H -ATOM 330 CA GLY A 40 31.793 57.932 65.401 1.00 15.00 A C -ATOM 331 C GLY A 40 31.433 57.366 64.042 1.00 15.00 A C -ATOM 332 O GLY A 40 31.812 56.244 63.706 1.00 15.00 A O -ATOM 333 N GLU A 41 30.703 58.159 63.258 1.00 15.00 A N -ATOM 334 HN GLU A 41 30.452 59.048 63.585 1.00 15.00 A H -ATOM 335 CA GLU A 41 30.264 57.748 61.930 1.00 15.00 A C -ATOM 336 CB GLU A 41 28.882 58.329 61.624 1.00 15.00 A C -ATOM 337 CG GLU A 41 27.799 57.950 62.620 1.00 15.00 A C -ATOM 338 CD GLU A 41 26.459 58.563 62.269 1.00 15.00 A C -ATOM 339 OE1 GLU A 41 26.444 59.708 61.768 1.00 15.00 A O -ATOM 340 OE2 GLU A 41 25.424 57.902 62.495 1.00 15.00 A O -ATOM 341 C GLU A 41 31.242 58.197 60.854 1.00 15.00 A C -ATOM 342 O GLU A 41 32.055 59.095 61.067 1.00 15.00 A O -ATOM 343 N VAL A 42 31.143 57.567 59.689 1.00 15.00 A N -ATOM 344 HN VAL A 42 30.470 56.862 59.586 1.00 15.00 A H -ATOM 345 CA VAL A 42 32.005 57.891 58.559 1.00 15.00 A C -ATOM 346 CB VAL A 42 32.838 56.664 58.120 1.00 15.00 A C -ATOM 347 CG1 VAL A 42 33.705 56.994 56.913 1.00 15.00 A C -ATOM 348 CG2 VAL A 42 33.695 56.155 59.268 1.00 15.00 A C -ATOM 349 C VAL A 42 31.174 58.382 57.375 1.00 15.00 A C -ATOM 350 O VAL A 42 30.258 57.693 56.926 1.00 15.00 A O -ATOM 351 N PRO A 43 31.475 59.593 56.865 1.00 15.00 A N -ATOM 352 CA PRO A 43 30.763 60.171 55.716 1.00 15.00 A C -ATOM 353 CB PRO A 43 31.434 61.538 55.527 1.00 15.00 A C -ATOM 354 CG PRO A 43 32.750 61.421 56.217 1.00 15.00 A C -ATOM 355 CD PRO A 43 32.526 60.491 57.371 1.00 15.00 A C -ATOM 356 C PRO A 43 30.947 59.320 54.460 1.00 15.00 A C -ATOM 357 O PRO A 43 32.009 58.744 54.246 1.00 15.00 A O -ATOM 358 N ALA A 44 29.905 59.234 53.640 1.00 15.00 A N -ATOM 359 HN ALA A 44 29.079 59.710 53.864 1.00 15.00 A H -ATOM 360 CA ALA A 44 29.962 58.445 52.413 1.00 15.00 A C -ATOM 361 CB ALA A 44 28.563 58.160 51.890 1.00 15.00 A C -ATOM 362 C ALA A 44 30.802 59.133 51.343 1.00 15.00 A C -ATOM 363 O ALA A 44 31.618 58.492 50.681 1.00 15.00 A O -ATOM 364 N ASP A 45 30.596 60.441 51.182 1.00 15.00 A N -ATOM 365 HN ASP A 45 29.927 60.888 51.742 1.00 15.00 A H -ATOM 366 CA ASP A 45 31.330 61.225 50.193 1.00 15.00 A C -ATOM 367 CB ASP A 45 30.873 62.686 50.235 1.00 15.00 A C -ATOM 368 CG ASP A 45 31.435 63.511 49.096 1.00 15.00 A C -ATOM 369 OD1 ASP A 45 32.291 64.376 49.362 1.00 15.00 A O -ATOM 370 OD2 ASP A 45 31.020 63.291 47.939 1.00 15.00 A O -ATOM 371 C ASP A 45 32.837 61.129 50.424 1.00 15.00 A C -ATOM 372 O ASP A 45 33.308 61.225 51.558 1.00 15.00 A O -ATOM 373 N VAL A 46 33.585 60.935 49.339 1.00 15.00 A N -ATOM 374 HN VAL A 46 33.149 60.886 48.465 1.00 15.00 A H -ATOM 375 CA VAL A 46 35.038 60.803 49.414 1.00 15.00 A C -ATOM 376 CB VAL A 46 35.633 60.219 48.110 1.00 15.00 A C -ATOM 377 CG1 VAL A 46 35.454 61.172 46.936 1.00 15.00 A C -ATOM 378 CG2 VAL A 46 37.094 59.837 48.293 1.00 15.00 A C -ATOM 379 C VAL A 46 35.719 62.125 49.776 1.00 15.00 A C -ATOM 380 O VAL A 46 36.739 62.134 50.466 1.00 15.00 A O -ATOM 381 N ALA A 47 35.146 63.240 49.320 1.00 15.00 A N -ATOM 382 HN ALA A 47 34.334 63.173 48.775 1.00 15.00 A H -ATOM 383 CA ALA A 47 35.697 64.558 49.619 1.00 15.00 A C -ATOM 384 CB ALA A 47 35.053 65.625 48.747 1.00 15.00 A C -ATOM 385 C ALA A 47 35.493 64.881 51.092 1.00 15.00 A C -ATOM 386 O ALA A 47 36.340 65.512 51.725 1.00 15.00 A O -ATOM 387 N ALA A 48 34.359 64.433 51.629 1.00 15.00 A N -ATOM 388 HN ALA A 48 33.721 63.952 51.060 1.00 15.00 A H -ATOM 389 CA ALA A 48 34.039 64.642 53.034 1.00 15.00 A C -ATOM 390 CB ALA A 48 32.566 64.364 53.292 1.00 15.00 A C -ATOM 391 C ALA A 48 34.916 63.748 53.904 1.00 15.00 A C -ATOM 392 O ALA A 48 35.259 64.104 55.030 1.00 15.00 A O -ATOM 393 N GLN A 49 35.278 62.581 53.363 1.00 15.00 A N -ATOM 394 HN GLN A 49 34.954 62.351 52.466 1.00 15.00 A H -ATOM 395 CA GLN A 49 36.136 61.637 54.068 1.00 15.00 A C -ATOM 396 CB GLN A 49 36.142 60.277 53.365 1.00 15.00 A C -ATOM 397 CG GLN A 49 34.964 59.386 53.717 1.00 15.00 A C -ATOM 398 CD GLN A 49 35.216 57.928 53.385 1.00 15.00 A C -ATOM 399 OE1 GLN A 49 36.358 57.474 53.371 1.00 15.00 A O -ATOM 400 NE2 GLN A 49 34.149 57.183 53.129 1.00 15.00 A N -ATOM 401 HE21 GLN A 49 33.267 57.609 53.167 1.00 15.00 A H -ATOM 402 HE22 GLN A 49 34.286 56.236 52.917 1.00 15.00 A H -ATOM 403 C GLN A 49 37.558 62.175 54.154 1.00 15.00 A C -ATOM 404 O GLN A 49 38.239 61.998 55.164 1.00 15.00 A O -ATOM 405 N ALA A 50 37.996 62.835 53.085 1.00 15.00 A N -ATOM 406 HN ALA A 50 37.403 62.934 52.310 1.00 15.00 A H -ATOM 407 CA ALA A 50 39.332 63.414 53.031 1.00 15.00 A C -ATOM 408 CB ALA A 50 39.654 63.877 51.618 1.00 15.00 A C -ATOM 409 C ALA A 50 39.455 64.573 54.013 1.00 15.00 A C -ATOM 410 O ALA A 50 40.495 64.753 54.644 1.00 15.00 A O -ATOM 411 N ARG A 51 38.377 65.345 54.147 1.00 15.00 A N -ATOM 412 HN ARG A 51 37.576 65.140 53.618 1.00 15.00 A H -ATOM 413 CA ARG A 51 38.356 66.484 55.056 1.00 15.00 A C -ATOM 414 CB ARG A 51 37.197 67.429 54.727 1.00 15.00 A C -ATOM 415 CG ARG A 51 37.128 68.656 55.623 1.00 15.00 A C -ATOM 416 CD ARG A 51 36.183 69.710 55.065 1.00 15.00 A C -ATOM 417 NE ARG A 51 36.720 70.359 53.869 1.00 15.00 A N -ATOM 418 HE ARG A 51 36.423 70.020 53.000 1.00 15.00 A H -ATOM 419 CZ ARG A 51 37.578 71.379 53.899 1.00 15.00 A C -ATOM 420 NH1 ARG A 51 38.002 71.867 55.059 1.00 15.00 A N -ATOM 421 HH11 ARG A 51 37.666 71.454 55.953 1.00 15.00 A H -ATOM 422 HH12 ARG A 51 38.672 72.665 55.075 1.00 15.00 A H -ATOM 423 NH2 ARG A 51 38.013 71.913 52.766 1.00 15.00 A N -ATOM 424 HH21 ARG A 51 37.685 71.537 51.854 1.00 15.00 A H -ATOM 425 HH22 ARG A 51 38.681 72.711 52.789 1.00 15.00 A H -ATOM 426 C ARG A 51 38.285 66.032 56.512 1.00 15.00 A C -ATOM 427 O ARG A 51 38.883 66.653 57.385 1.00 15.00 A O -ATOM 428 N GLN A 52 37.556 64.943 56.766 1.00 15.00 A N -ATOM 429 HN GLN A 52 37.094 64.495 56.028 1.00 15.00 A H -ATOM 430 CA GLN A 52 37.426 64.409 58.118 1.00 15.00 A C -ATOM 431 CB GLN A 52 36.328 63.342 58.183 1.00 15.00 A C -ATOM 432 CG GLN A 52 36.061 62.786 59.577 1.00 15.00 A C -ATOM 433 CD GLN A 52 35.601 63.843 60.565 1.00 15.00 A C -ATOM 434 OE1 GLN A 52 34.409 64.130 60.676 1.00 15.00 A O -ATOM 435 NE2 GLN A 52 36.546 64.419 61.301 1.00 15.00 A N -ATOM 436 HE21 GLN A 52 37.474 64.134 61.167 1.00 15.00 A H -ATOM 437 HE22 GLN A 52 36.275 65.104 61.947 1.00 15.00 A H -ATOM 438 C GLN A 52 38.761 63.849 58.602 1.00 15.00 A C -ATOM 439 O GLN A 52 39.125 64.010 59.765 1.00 15.00 A O -ATOM 440 N SER A 53 39.489 63.192 57.697 1.00 15.00 A N -ATOM 441 HN SER A 53 39.132 63.074 56.792 1.00 15.00 A H -ATOM 442 CA SER A 53 40.799 62.636 58.021 1.00 15.00 A C -ATOM 443 CB SER A 53 41.328 61.782 56.866 1.00 15.00 A C -ATOM 444 OG SER A 53 40.606 60.570 56.748 1.00 15.00 A O -ATOM 445 HG SER A 53 41.012 60.023 56.069 1.00 15.00 A H -ATOM 446 C SER A 53 41.783 63.761 58.314 1.00 15.00 A C -ATOM 447 O SER A 53 42.610 63.656 59.218 1.00 15.00 A O -ATOM 448 N LEU A 54 41.676 64.841 57.539 1.00 15.00 A N -ATOM 449 HN LEU A 54 40.995 64.853 56.835 1.00 15.00 A H -ATOM 450 CA LEU A 54 42.540 66.005 57.706 1.00 15.00 A C -ATOM 451 CB LEU A 54 42.429 66.935 56.496 1.00 15.00 A C -ATOM 452 CG LEU A 54 43.158 66.481 55.229 1.00 15.00 A C -ATOM 453 CD1 LEU A 54 42.731 67.319 54.035 1.00 15.00 A C -ATOM 454 CD2 LEU A 54 44.665 66.556 55.425 1.00 15.00 A C -ATOM 455 C LEU A 54 42.197 66.760 58.986 1.00 15.00 A C -ATOM 456 O LEU A 54 43.077 67.318 59.640 1.00 15.00 A O -ATOM 457 N ASP A 55 40.908 66.772 59.337 1.00 15.00 A N -ATOM 458 HN ASP A 55 40.255 66.320 58.761 1.00 15.00 A H -ATOM 459 CA ASP A 55 40.443 67.440 60.549 1.00 15.00 A C -ATOM 460 CB ASP A 55 38.916 67.558 60.562 1.00 15.00 A C -ATOM 461 CG ASP A 55 38.410 68.804 59.858 1.00 15.00 A C -ATOM 462 OD1 ASP A 55 37.286 68.763 59.314 1.00 15.00 A O -ATOM 463 OD2 ASP A 55 39.136 69.820 59.853 1.00 15.00 A O -ATOM 464 C ASP A 55 40.916 66.689 61.785 1.00 15.00 A C -ATOM 465 O ASP A 55 41.183 67.292 62.824 1.00 15.00 A O -ATOM 466 N ASN A 56 41.019 65.365 61.661 1.00 15.00 A N -ATOM 467 HN ASN A 56 40.773 64.946 60.809 1.00 15.00 A H -ATOM 468 CA ASN A 56 41.484 64.524 62.758 1.00 15.00 A C -ATOM 469 CB ASN A 56 41.165 63.051 62.493 1.00 15.00 A C -ATOM 470 CG ASN A 56 39.688 62.736 62.622 1.00 15.00 A C -ATOM 471 OD1 ASN A 56 38.937 63.468 63.268 1.00 15.00 A O -ATOM 472 ND2 ASN A 56 39.265 61.633 62.019 1.00 15.00 A N -ATOM 473 HD21 ASN A 56 39.920 61.092 61.531 1.00 15.00 A H -ATOM 474 HD22 ASN A 56 38.315 61.400 62.092 1.00 15.00 A H -ATOM 475 C ASN A 56 42.980 64.712 62.963 1.00 15.00 A C -ATOM 476 O ASN A 56 43.471 64.683 64.091 1.00 15.00 A O -ATOM 477 N VAL A 57 43.699 64.904 61.854 1.00 15.00 A N -ATOM 478 HN VAL A 57 43.245 64.888 60.986 1.00 15.00 A H -ATOM 479 CA VAL A 57 45.137 65.137 61.897 1.00 15.00 A C -ATOM 480 CB VAL A 57 45.745 65.136 60.472 1.00 15.00 A C -ATOM 481 CG1 VAL A 57 47.166 65.682 60.479 1.00 15.00 A C -ATOM 482 CG2 VAL A 57 45.723 63.739 59.879 1.00 15.00 A C -ATOM 483 C VAL A 57 45.396 66.489 62.550 1.00 15.00 A C -ATOM 484 O VAL A 57 46.295 66.633 63.376 1.00 15.00 A O -ATOM 485 N LYS A 58 44.570 67.464 62.174 1.00 15.00 A N -ATOM 486 HN LYS A 58 43.873 67.261 61.515 1.00 15.00 A H -ATOM 487 CA LYS A 58 44.657 68.818 62.701 1.00 15.00 A C -ATOM 488 CB LYS A 58 43.632 69.707 61.989 1.00 15.00 A C -ATOM 489 CG LYS A 58 43.357 71.037 62.672 1.00 15.00 A C -ATOM 490 CD LYS A 58 42.196 71.764 62.015 1.00 15.00 A C -ATOM 491 CE LYS A 58 41.869 73.051 62.754 1.00 15.00 A C -ATOM 492 NZ LYS A 58 40.882 73.883 62.015 1.00 15.00 A N -ATOM 493 HZ1 LYS A 58 41.018 74.888 62.248 1.00 15.00 A H -ATOM 494 HZ2 LYS A 58 39.914 73.607 62.273 1.00 15.00 A H -ATOM 495 HZ3 LYS A 58 41.005 73.757 60.989 1.00 15.00 A H -ATOM 496 C LYS A 58 44.412 68.835 64.208 1.00 15.00 A C -ATOM 497 O LYS A 58 45.092 69.544 64.943 1.00 15.00 A O -ATOM 498 N ALA A 59 43.441 68.039 64.656 1.00 15.00 A N -ATOM 499 HN ALA A 59 42.941 67.495 64.013 1.00 15.00 A H -ATOM 500 CA ALA A 59 43.096 67.957 66.073 1.00 15.00 A C -ATOM 501 CB ALA A 59 41.873 67.075 66.266 1.00 15.00 A C -ATOM 502 C ALA A 59 44.263 67.449 66.916 1.00 15.00 A C -ATOM 503 O ALA A 59 44.490 67.930 68.025 1.00 15.00 A O -ATOM 504 N ILE A 60 44.999 66.477 66.382 1.00 15.00 A N -ATOM 505 HN ILE A 60 44.762 66.133 65.496 1.00 15.00 A H -ATOM 506 CA ILE A 60 46.149 65.902 67.081 1.00 15.00 A C -ATOM 507 CB ILE A 60 46.566 64.556 66.450 1.00 15.00 A C -ATOM 508 CG1 ILE A 60 45.418 63.551 66.549 1.00 15.00 A C -ATOM 509 CG2 ILE A 60 47.818 64.001 67.116 1.00 15.00 A C -ATOM 510 CD1 ILE A 60 45.620 62.311 65.712 1.00 15.00 A C -ATOM 511 C ILE A 60 47.337 66.866 67.067 1.00 15.00 A C -ATOM 512 O ILE A 60 48.042 67.012 68.066 1.00 15.00 A O -ATOM 513 N VAL A 61 47.544 67.524 65.929 1.00 15.00 A N -ATOM 514 HN VAL A 61 46.944 67.365 65.170 1.00 15.00 A H -ATOM 515 CA VAL A 61 48.640 68.477 65.775 1.00 15.00 A C -ATOM 516 CB VAL A 61 48.800 68.918 64.301 1.00 15.00 A C -ATOM 517 CG1 VAL A 61 49.812 70.044 64.169 1.00 15.00 A C -ATOM 518 CG2 VAL A 61 49.218 67.738 63.437 1.00 15.00 A C -ATOM 519 C VAL A 61 48.437 69.701 66.673 1.00 15.00 A C -ATOM 520 O VAL A 61 49.381 70.189 67.293 1.00 15.00 A O -ATOM 521 N GLU A 62 47.192 70.175 66.753 1.00 15.00 A N -ATOM 522 HN GLU A 62 46.481 69.734 66.243 1.00 15.00 A H -ATOM 523 CA GLU A 62 46.861 71.334 67.578 1.00 15.00 A C -ATOM 524 CB GLU A 62 45.505 71.920 67.186 1.00 15.00 A C -ATOM 525 CG GLU A 62 45.487 72.576 65.815 1.00 15.00 A C -ATOM 526 CD GLU A 62 44.205 73.340 65.552 1.00 15.00 A C -ATOM 527 OE1 GLU A 62 44.249 74.320 64.779 1.00 15.00 A O -ATOM 528 OE2 GLU A 62 43.157 72.959 66.116 1.00 15.00 A O -ATOM 529 C GLU A 62 46.876 70.992 69.062 1.00 15.00 A C -ATOM 530 O GLU A 62 47.071 71.868 69.905 1.00 15.00 A O -ATOM 531 N ALA A 63 46.666 69.713 69.377 1.00 15.00 A N -ATOM 532 HN ALA A 63 46.507 69.064 68.660 1.00 15.00 A H -ATOM 533 CA ALA A 63 46.677 69.258 70.763 1.00 15.00 A C -ATOM 534 CB ALA A 63 46.067 67.869 70.877 1.00 15.00 A C -ATOM 535 C ALA A 63 48.102 69.260 71.303 1.00 15.00 A C -ATOM 536 O ALA A 63 48.323 69.276 72.513 1.00 15.00 A O -ATOM 537 N ALA A 64 49.064 69.247 70.382 1.00 15.00 A N -ATOM 538 HN ALA A 64 48.813 69.223 69.435 1.00 15.00 A H -ATOM 539 CA ALA A 64 50.474 69.268 70.738 1.00 15.00 A C -ATOM 540 CB ALA A 64 51.279 68.452 69.737 1.00 15.00 A C -ATOM 541 C ALA A 64 50.992 70.704 70.792 1.00 15.00 A C -ATOM 542 O ALA A 64 52.157 70.940 71.103 1.00 15.00 A O -ATOM 543 N GLY A 65 50.115 71.659 70.485 1.00 15.00 A N -ATOM 544 HN GLY A 65 49.197 71.409 70.248 1.00 15.00 A H -ATOM 545 CA GLY A 65 50.499 73.060 70.510 1.00 15.00 A C -ATOM 546 C GLY A 65 51.002 73.568 69.170 1.00 15.00 A C -ATOM 547 O GLY A 65 51.635 74.621 69.101 1.00 15.00 A O -ATOM 548 N LEU A 66 50.725 72.821 68.104 1.00 15.00 A N -ATOM 549 HN LEU A 66 50.218 71.989 68.221 1.00 15.00 A H -ATOM 550 CA LEU A 66 51.156 73.209 66.763 1.00 15.00 A C -ATOM 551 CB LEU A 66 52.008 72.108 66.123 1.00 15.00 A C -ATOM 552 CG LEU A 66 53.387 71.867 66.740 1.00 15.00 A C -ATOM 553 CD1 LEU A 66 54.134 70.795 65.964 1.00 15.00 A C -ATOM 554 CD2 LEU A 66 54.191 73.157 66.778 1.00 15.00 A C -ATOM 555 C LEU A 66 49.965 73.539 65.867 1.00 15.00 A C -ATOM 556 O LEU A 66 48.813 73.366 66.262 1.00 15.00 A O -ATOM 557 N LYS A 67 50.254 74.019 64.661 1.00 15.00 A N -ATOM 558 HN LYS A 67 51.196 74.138 64.408 1.00 15.00 A H -ATOM 559 CA LYS A 67 49.212 74.376 63.702 1.00 15.00 A C -ATOM 560 CB LYS A 67 49.372 75.838 63.268 1.00 15.00 A C -ATOM 561 CG LYS A 67 49.465 76.841 64.405 1.00 15.00 A C -ATOM 562 CD LYS A 67 49.700 78.244 63.868 1.00 15.00 A C -ATOM 563 CE LYS A 67 49.748 79.273 64.986 1.00 15.00 A C -ATOM 564 NZ LYS A 67 49.900 80.657 64.456 1.00 15.00 A N -ATOM 565 HZ1 LYS A 67 50.801 80.746 63.943 1.00 15.00 A H -ATOM 566 HZ2 LYS A 67 49.889 81.343 65.237 1.00 15.00 A H -ATOM 567 HZ3 LYS A 67 49.119 80.878 63.804 1.00 15.00 A H -ATOM 568 C LYS A 67 49.289 73.486 62.465 1.00 15.00 A C -ATOM 569 O LYS A 67 50.195 72.663 62.336 1.00 15.00 A O -ATOM 570 N VAL A 68 48.333 73.663 61.553 1.00 15.00 A N -ATOM 571 HN VAL A 68 47.630 74.323 61.724 1.00 15.00 A H -ATOM 572 CA VAL A 68 48.302 72.899 60.307 1.00 15.00 A C -ATOM 573 CB VAL A 68 46.958 73.098 59.566 1.00 15.00 A C -ATOM 574 CG1 VAL A 68 46.985 72.483 58.174 1.00 15.00 A C -ATOM 575 CG2 VAL A 68 45.821 72.502 60.378 1.00 15.00 A C -ATOM 576 C VAL A 68 49.470 73.321 59.410 1.00 15.00 A C -ATOM 577 O VAL A 68 49.960 72.541 58.590 1.00 15.00 A O -ATOM 578 N GLY A 69 49.927 74.560 59.601 1.00 15.00 A N -ATOM 579 HN GLY A 69 49.499 75.126 60.277 1.00 15.00 A H -ATOM 580 CA GLY A 69 51.040 75.081 58.829 1.00 15.00 A C -ATOM 581 C GLY A 69 52.371 74.505 59.263 1.00 15.00 A C -ATOM 582 O GLY A 69 53.384 74.688 58.587 1.00 15.00 A O -ATOM 583 N ASP A 70 52.367 73.805 60.393 1.00 15.00 A N -ATOM 584 HN ASP A 70 51.526 73.699 60.885 1.00 15.00 A H -ATOM 585 CA ASP A 70 53.579 73.196 60.919 1.00 15.00 A C -ATOM 586 CB ASP A 70 53.564 73.185 62.448 1.00 15.00 A C -ATOM 587 CG ASP A 70 53.655 74.583 63.029 1.00 15.00 A C -ATOM 588 OD1 ASP A 70 52.925 74.874 63.998 1.00 15.00 A O -ATOM 589 OD2 ASP A 70 54.453 75.391 62.508 1.00 15.00 A O -ATOM 590 C ASP A 70 53.790 71.792 60.357 1.00 15.00 A C -ATOM 591 O ASP A 70 54.852 71.198 60.538 1.00 15.00 A O -ATOM 592 N ILE A 71 52.767 71.265 59.676 1.00 15.00 A N -ATOM 593 HN ILE A 71 51.939 71.782 59.587 1.00 15.00 A H -ATOM 594 CA ILE A 71 52.854 69.941 59.063 1.00 15.00 A C -ATOM 595 CB ILE A 71 51.471 69.445 58.589 1.00 15.00 A C -ATOM 596 CG1 ILE A 71 50.486 69.411 59.765 1.00 15.00 A C -ATOM 597 CG2 ILE A 71 51.586 68.067 57.955 1.00 15.00 A C -ATOM 598 CD1 ILE A 71 49.063 69.080 59.370 1.00 15.00 A C -ATOM 599 C ILE A 71 53.823 69.994 57.880 1.00 15.00 A C -ATOM 600 O ILE A 71 53.647 70.793 56.961 1.00 15.00 A O -ATOM 601 N VAL A 72 54.848 69.142 57.913 1.00 15.00 A N -ATOM 602 HN VAL A 72 54.923 68.515 58.661 1.00 15.00 A H -ATOM 603 CA VAL A 72 55.870 69.129 56.866 1.00 15.00 A C -ATOM 604 CB VAL A 72 57.278 69.349 57.454 1.00 15.00 A C -ATOM 605 CG1 VAL A 72 57.409 70.757 58.013 1.00 15.00 A C -ATOM 606 CG2 VAL A 72 57.579 68.314 58.529 1.00 15.00 A C -ATOM 607 C VAL A 72 55.887 67.862 56.003 1.00 15.00 A C -ATOM 608 O VAL A 72 56.522 67.851 54.952 1.00 15.00 A O -ATOM 609 N LYS A 73 55.211 66.798 56.433 1.00 15.00 A N -ATOM 610 HN LYS A 73 54.713 66.850 57.275 1.00 15.00 A H -ATOM 611 CA LYS A 73 55.196 65.552 55.658 1.00 15.00 A C -ATOM 612 CB LYS A 73 56.467 64.727 55.924 1.00 15.00 A C -ATOM 613 CG LYS A 73 56.484 63.344 55.276 1.00 15.00 A C -ATOM 614 CD LYS A 73 56.415 63.430 53.757 1.00 15.00 A C -ATOM 615 CE LYS A 73 56.688 62.082 53.101 1.00 15.00 A C -ATOM 616 NZ LYS A 73 55.676 61.052 53.466 1.00 15.00 A N -ATOM 617 HZ1 LYS A 73 55.684 60.890 54.493 1.00 15.00 A H -ATOM 618 HZ2 LYS A 73 55.893 60.154 52.985 1.00 15.00 A H -ATOM 619 HZ3 LYS A 73 54.726 61.363 53.182 1.00 15.00 A H -ATOM 620 C LYS A 73 53.953 64.715 55.940 1.00 15.00 A C -ATOM 621 O LYS A 73 53.610 64.469 57.090 1.00 15.00 A O -ATOM 622 N THR A 74 53.280 64.279 54.875 1.00 15.00 A N -ATOM 623 HN THR A 74 53.600 64.516 53.979 1.00 15.00 A H -ATOM 624 CA THR A 74 52.077 63.462 55.005 1.00 15.00 A C -ATOM 625 CB THR A 74 50.794 64.285 54.750 1.00 15.00 A C -ATOM 626 OG1 THR A 74 50.721 64.647 53.367 1.00 15.00 A O -ATOM 627 HG1 THR A 74 51.266 65.423 53.210 1.00 15.00 A H -ATOM 628 CG2 THR A 74 50.769 65.549 55.599 1.00 15.00 A C -ATOM 629 C THR A 74 52.094 62.288 54.025 1.00 15.00 A C -ATOM 630 O THR A 74 52.707 62.363 52.960 1.00 15.00 A O -ATOM 631 N THR A 75 51.428 61.202 54.401 1.00 15.00 A N -ATOM 632 HN THR A 75 50.991 61.193 55.277 1.00 15.00 A H -ATOM 633 CA THR A 75 51.326 60.017 53.550 1.00 15.00 A C -ATOM 634 CB THR A 75 52.070 58.807 54.150 1.00 15.00 A C -ATOM 635 OG1 THR A 75 53.433 59.166 54.412 1.00 15.00 A O -ATOM 636 HG1 THR A 75 53.919 58.387 54.703 1.00 15.00 A H -ATOM 637 CG2 THR A 75 52.049 57.634 53.183 1.00 15.00 A C -ATOM 638 C THR A 75 49.850 59.676 53.348 1.00 15.00 A C -ATOM 639 O THR A 75 49.173 59.222 54.273 1.00 15.00 A O -ATOM 640 N VAL A 76 49.358 59.902 52.133 1.00 15.00 A N -ATOM 641 HN VAL A 76 49.959 60.225 51.427 1.00 15.00 A H -ATOM 642 CA VAL A 76 47.953 59.675 51.817 1.00 15.00 A C -ATOM 643 CB VAL A 76 47.397 60.788 50.902 1.00 15.00 A C -ATOM 644 CG1 VAL A 76 45.898 60.633 50.712 1.00 15.00 A C -ATOM 645 CG2 VAL A 76 47.727 62.163 51.464 1.00 15.00 A C -ATOM 646 C VAL A 76 47.677 58.313 51.182 1.00 15.00 A C -ATOM 647 O VAL A 76 48.023 58.065 50.027 1.00 15.00 A O -ATOM 648 N PHE A 77 47.043 57.437 51.957 1.00 15.00 A N -ATOM 649 HN PHE A 77 46.830 57.688 52.881 1.00 15.00 A H -ATOM 650 CA PHE A 77 46.665 56.112 51.483 1.00 15.00 A C -ATOM 651 CB PHE A 77 46.776 55.087 52.615 1.00 15.00 A C -ATOM 652 CG PHE A 77 48.125 55.003 53.267 1.00 15.00 A C -ATOM 653 CD1 PHE A 77 48.343 55.577 54.509 1.00 15.00 A C -ATOM 654 CD2 PHE A 77 49.168 54.335 52.649 1.00 15.00 A C -ATOM 655 CE1 PHE A 77 49.577 55.486 55.123 1.00 15.00 A C -ATOM 656 CE2 PHE A 77 50.406 54.242 53.255 1.00 15.00 A C -ATOM 657 CZ PHE A 77 50.611 54.817 54.495 1.00 15.00 A C -ATOM 658 C PHE A 77 45.216 56.157 51.012 1.00 15.00 A C -ATOM 659 O PHE A 77 44.315 56.441 51.797 1.00 15.00 A O -ATOM 660 N VAL A 78 44.987 55.891 49.734 1.00 15.00 A N -ATOM 661 HN VAL A 78 45.739 55.668 49.144 1.00 15.00 A H -ATOM 662 CA VAL A 78 43.632 55.919 49.193 1.00 15.00 A C -ATOM 663 CB VAL A 78 43.471 56.968 48.071 1.00 15.00 A C -ATOM 664 CG1 VAL A 78 43.661 58.374 48.622 1.00 15.00 A C -ATOM 665 CG2 VAL A 78 44.440 56.699 46.927 1.00 15.00 A C -ATOM 666 C VAL A 78 43.197 54.550 48.682 1.00 15.00 A C -ATOM 667 O VAL A 78 44.027 53.706 48.356 1.00 15.00 A O -ATOM 668 N LYS A 79 41.887 54.336 48.627 1.00 15.00 A N -ATOM 669 HN LYS A 79 41.276 55.046 48.916 1.00 15.00 A H -ATOM 670 CA LYS A 79 41.334 53.075 48.149 1.00 15.00 A C -ATOM 671 CB LYS A 79 39.994 52.788 48.844 1.00 15.00 A C -ATOM 672 CG LYS A 79 39.216 51.608 48.277 1.00 15.00 A C -ATOM 673 CD LYS A 79 39.954 50.295 48.480 1.00 15.00 A C -ATOM 674 CE LYS A 79 39.404 49.211 47.564 1.00 15.00 A C -ATOM 675 NZ LYS A 79 39.696 49.493 46.131 1.00 15.00 A N -ATOM 676 HZ1 LYS A 79 39.304 48.740 45.531 1.00 15.00 A H -ATOM 677 HZ2 LYS A 79 40.724 49.541 45.978 1.00 15.00 A H -ATOM 678 HZ3 LYS A 79 39.273 50.401 45.852 1.00 15.00 A H -ATOM 679 C LYS A 79 41.163 53.112 46.631 1.00 15.00 A C -ATOM 680 O LYS A 79 41.215 52.081 45.958 1.00 15.00 A O -ATOM 681 N ASP A 80 40.971 54.315 46.098 1.00 15.00 A N -ATOM 682 HN ASP A 80 40.947 55.098 46.687 1.00 15.00 A H -ATOM 683 CA ASP A 80 40.801 54.503 44.664 1.00 15.00 A C -ATOM 684 CB ASP A 80 39.313 54.502 44.294 1.00 15.00 A C -ATOM 685 CG ASP A 80 39.061 54.205 42.825 1.00 15.00 A C -ATOM 686 OD1 ASP A 80 37.882 54.033 42.452 1.00 15.00 A O -ATOM 687 OD2 ASP A 80 40.038 54.141 42.049 1.00 15.00 A O -ATOM 688 C ASP A 80 41.455 55.808 44.220 1.00 15.00 A C -ATOM 689 O ASP A 80 41.075 56.889 44.672 1.00 15.00 A O -ATOM 690 N LEU A 81 42.448 55.696 43.336 1.00 15.00 A N -ATOM 691 HN LEU A 81 42.709 54.804 43.025 1.00 15.00 A H -ATOM 692 CA LEU A 81 43.156 56.864 42.822 1.00 15.00 A C -ATOM 693 CB LEU A 81 44.518 56.472 42.247 1.00 15.00 A C -ATOM 694 CG LEU A 81 45.702 56.530 43.211 1.00 15.00 A C -ATOM 695 CD1 LEU A 81 46.946 55.964 42.551 1.00 15.00 A C -ATOM 696 CD2 LEU A 81 45.953 57.958 43.672 1.00 15.00 A C -ATOM 697 C LEU A 81 42.335 57.608 41.776 1.00 15.00 A C -ATOM 698 O LEU A 81 42.713 58.693 41.337 1.00 15.00 A O -ATOM 699 N ASN A 82 41.211 57.014 41.372 1.00 15.00 A N -ATOM 700 HN ASN A 82 40.973 56.139 41.745 1.00 15.00 A H -ATOM 701 CA ASN A 82 40.328 57.638 40.395 1.00 15.00 A C -ATOM 702 CB ASN A 82 39.350 56.613 39.811 1.00 15.00 A C -ATOM 703 CG ASN A 82 39.957 55.788 38.692 1.00 15.00 A C -ATOM 704 OD1 ASN A 82 40.824 56.259 37.954 1.00 15.00 A O -ATOM 705 ND2 ASN A 82 39.501 54.548 38.559 1.00 15.00 A N -ATOM 706 HD21 ASN A 82 38.811 54.240 39.182 1.00 15.00 A H -ATOM 707 HD22 ASN A 82 39.872 53.992 37.841 1.00 15.00 A H -ATOM 708 C ASN A 82 39.563 58.793 41.037 1.00 15.00 A C -ATOM 709 O ASN A 82 39.010 59.649 40.349 1.00 15.00 A O -ATOM 710 N ASP A 83 39.553 58.802 42.370 1.00 15.00 A N -ATOM 711 HN ASP A 83 40.015 58.084 42.851 1.00 15.00 A H -ATOM 712 CA ASP A 83 38.882 59.842 43.141 1.00 15.00 A C -ATOM 713 CB ASP A 83 38.130 59.217 44.325 1.00 15.00 A C -ATOM 714 CG ASP A 83 36.798 58.600 43.953 1.00 15.00 A C -ATOM 715 OD1 ASP A 83 36.407 57.604 44.599 1.00 15.00 A O -ATOM 716 OD2 ASP A 83 36.140 59.117 43.027 1.00 15.00 A O -ATOM 717 C ASP A 83 39.899 60.831 43.700 1.00 15.00 A C -ATOM 718 O ASP A 83 39.566 61.651 44.554 1.00 15.00 A O -ATOM 719 N PHE A 84 41.137 60.765 43.209 1.00 15.00 A N -ATOM 720 HN PHE A 84 41.338 60.124 42.494 1.00 15.00 A H -ATOM 721 CA PHE A 84 42.195 61.637 43.709 1.00 15.00 A C -ATOM 722 CB PHE A 84 43.592 61.105 43.399 1.00 15.00 A C -ATOM 723 CG PHE A 84 44.578 61.403 44.493 1.00 15.00 A C -ATOM 724 CD1 PHE A 84 45.597 62.320 44.300 1.00 15.00 A C -ATOM 725 CD2 PHE A 84 44.475 60.772 45.722 1.00 15.00 A C -ATOM 726 CE1 PHE A 84 46.495 62.602 45.312 1.00 15.00 A C -ATOM 727 CE2 PHE A 84 45.370 61.047 46.737 1.00 15.00 A C -ATOM 728 CZ PHE A 84 46.381 61.964 46.532 1.00 15.00 A C -ATOM 729 C PHE A 84 42.046 63.096 43.295 1.00 15.00 A C -ATOM 730 O PHE A 84 42.566 63.979 43.969 1.00 15.00 A O -ATOM 731 N ALA A 85 41.353 63.355 42.189 1.00 15.00 A N -ATOM 732 HN ALA A 85 40.986 62.614 41.662 1.00 15.00 A H -ATOM 733 CA ALA A 85 41.137 64.730 41.744 1.00 15.00 A C -ATOM 734 CB ALA A 85 40.456 64.753 40.385 1.00 15.00 A C -ATOM 735 C ALA A 85 40.293 65.471 42.779 1.00 15.00 A C -ATOM 736 O ALA A 85 40.514 66.650 43.056 1.00 15.00 A O -ATOM 737 N THR A 86 39.339 64.744 43.357 1.00 15.00 A N -ATOM 738 HN THR A 86 39.225 63.811 43.081 1.00 15.00 A H -ATOM 739 CA THR A 86 38.455 65.284 44.381 1.00 15.00 A C -ATOM 740 CB THR A 86 37.225 64.373 44.566 1.00 15.00 A C -ATOM 741 OG1 THR A 86 36.563 64.203 43.308 1.00 15.00 A O -ATOM 742 HG1 THR A 86 36.737 63.321 42.971 1.00 15.00 A H -ATOM 743 CG2 THR A 86 36.248 64.975 45.560 1.00 15.00 A C -ATOM 744 C THR A 86 39.201 65.410 45.710 1.00 15.00 A C -ATOM 745 O THR A 86 39.034 66.390 46.438 1.00 15.00 A O -ATOM 746 N VAL A 87 40.030 64.409 46.014 1.00 15.00 A N -ATOM 747 HN VAL A 87 40.111 63.654 45.395 1.00 15.00 A H -ATOM 748 CA VAL A 87 40.820 64.403 47.244 1.00 15.00 A C -ATOM 749 CB VAL A 87 41.542 63.049 47.444 1.00 15.00 A C -ATOM 750 CG1 VAL A 87 42.513 63.110 48.615 1.00 15.00 A C -ATOM 751 CG2 VAL A 87 40.531 61.933 47.656 1.00 15.00 A C -ATOM 752 C VAL A 87 41.846 65.536 47.233 1.00 15.00 A C -ATOM 753 O VAL A 87 42.064 66.192 48.248 1.00 15.00 A O -ATOM 754 N ASN A 88 42.460 65.762 46.070 1.00 15.00 A N -ATOM 755 HN ASN A 88 42.236 65.200 45.299 1.00 15.00 A H -ATOM 756 CA ASN A 88 43.457 66.818 45.908 1.00 15.00 A C -ATOM 757 CB ASN A 88 44.103 66.746 44.521 1.00 15.00 A C -ATOM 758 CG ASN A 88 45.497 66.155 44.551 1.00 15.00 A C -ATOM 759 OD1 ASN A 88 46.184 66.213 45.568 1.00 15.00 A O -ATOM 760 ND2 ASN A 88 45.927 65.590 43.429 1.00 15.00 A N -ATOM 761 HD21 ASN A 88 45.327 65.586 42.653 1.00 15.00 A H -ATOM 762 HD22 ASN A 88 46.826 65.201 43.421 1.00 15.00 A H -ATOM 763 C ASN A 88 42.846 68.197 46.115 1.00 15.00 A C -ATOM 764 O ASN A 88 43.472 69.075 46.705 1.00 15.00 A O -ATOM 765 N ALA A 89 41.622 68.381 45.620 1.00 15.00 A N -ATOM 766 HN ALA A 89 41.182 67.640 45.151 1.00 15.00 A H -ATOM 767 CA ALA A 89 40.918 69.654 45.753 1.00 15.00 A C -ATOM 768 CB ALA A 89 39.643 69.648 44.924 1.00 15.00 A C -ATOM 769 C ALA A 89 40.609 69.963 47.216 1.00 15.00 A C -ATOM 770 O ALA A 89 40.766 71.097 47.664 1.00 15.00 A O -ATOM 771 N THR A 90 40.171 68.944 47.953 1.00 15.00 A N -ATOM 772 HN THR A 90 40.059 68.066 47.531 1.00 15.00 A H -ATOM 773 CA THR A 90 39.852 69.095 49.370 1.00 15.00 A C -ATOM 774 CB THR A 90 39.074 67.870 49.898 1.00 15.00 A C -ATOM 775 OG1 THR A 90 37.799 67.797 49.249 1.00 15.00 A O -ATOM 776 HG1 THR A 90 37.825 67.126 48.564 1.00 15.00 A H -ATOM 777 CG2 THR A 90 38.862 67.957 51.403 1.00 15.00 A C -ATOM 778 C THR A 90 41.130 69.283 50.189 1.00 15.00 A C -ATOM 779 O THR A 90 41.169 70.080 51.127 1.00 15.00 A O -ATOM 780 N TYR A 91 42.171 68.547 49.809 1.00 15.00 A N -ATOM 781 HN TYR A 91 42.064 67.937 49.050 1.00 15.00 A H -ATOM 782 CA TYR A 91 43.466 68.611 50.478 1.00 15.00 A C -ATOM 783 CB TYR A 91 44.398 67.560 49.863 1.00 15.00 A C -ATOM 784 CG TYR A 91 45.730 67.391 50.557 1.00 15.00 A C -ATOM 785 CD1 TYR A 91 45.951 66.332 51.427 1.00 15.00 A C -ATOM 786 CD2 TYR A 91 46.769 68.286 50.338 1.00 15.00 A C -ATOM 787 CE1 TYR A 91 47.174 66.162 52.047 1.00 15.00 A C -ATOM 788 CE2 TYR A 91 47.993 68.124 50.952 1.00 15.00 A C -ATOM 789 CZ TYR A 91 48.188 67.067 51.811 1.00 15.00 A C -ATOM 790 OH TYR A 91 49.407 66.904 52.422 1.00 15.00 A O -ATOM 791 HH TYR A 91 49.693 65.991 52.328 1.00 15.00 A H -ATOM 792 C TYR A 91 44.082 70.001 50.330 1.00 15.00 A C -ATOM 793 O TYR A 91 44.586 70.573 51.297 1.00 15.00 A O -ATOM 794 N GLU A 92 44.030 70.533 49.110 1.00 15.00 A N -ATOM 795 HN GLU A 92 43.612 70.021 48.386 1.00 15.00 A H -ATOM 796 CA GLU A 92 44.576 71.852 48.817 1.00 15.00 A C -ATOM 797 CB GLU A 92 44.568 72.109 47.308 1.00 15.00 A C -ATOM 798 CG GLU A 92 45.065 73.487 46.905 1.00 15.00 A C -ATOM 799 CD GLU A 92 45.529 73.543 45.463 1.00 15.00 A C -ATOM 800 OE1 GLU A 92 46.346 74.430 45.141 1.00 15.00 A O -ATOM 801 OE2 GLU A 92 45.081 72.699 44.659 1.00 15.00 A O -ATOM 802 C GLU A 92 43.796 72.941 49.540 1.00 15.00 A C -ATOM 803 O GLU A 92 44.384 73.862 50.104 1.00 15.00 A O -ATOM 804 N ALA A 93 42.470 72.821 49.521 1.00 15.00 A N -ATOM 805 HN ALA A 93 42.066 72.058 49.055 1.00 15.00 A H -ATOM 806 CA ALA A 93 41.603 73.790 50.176 1.00 15.00 A C -ATOM 807 CB ALA A 93 40.142 73.479 49.890 1.00 15.00 A C -ATOM 808 C ALA A 93 41.858 73.822 51.677 1.00 15.00 A C -ATOM 809 O ALA A 93 41.912 74.890 52.275 1.00 15.00 A O -ATOM 810 N PHE A 94 42.032 72.641 52.269 1.00 15.00 A N -ATOM 811 HN PHE A 94 41.989 71.828 51.724 1.00 15.00 A H -ATOM 812 CA PHE A 94 42.282 72.515 53.703 1.00 15.00 A C -ATOM 813 CB PHE A 94 42.432 71.038 54.086 1.00 15.00 A C -ATOM 814 CG PHE A 94 42.574 70.792 55.562 1.00 15.00 A C -ATOM 815 CD1 PHE A 94 41.458 70.761 56.384 1.00 15.00 A C -ATOM 816 CD2 PHE A 94 43.823 70.590 56.128 1.00 15.00 A C -ATOM 817 CE1 PHE A 94 41.585 70.532 57.741 1.00 15.00 A C -ATOM 818 CE2 PHE A 94 43.956 70.362 57.484 1.00 15.00 A C -ATOM 819 CZ PHE A 94 42.836 70.334 58.293 1.00 15.00 A C -ATOM 820 C PHE A 94 43.518 73.302 54.138 1.00 15.00 A C -ATOM 821 O PHE A 94 43.464 74.065 55.099 1.00 15.00 A O -ATOM 822 N PHE A 95 44.626 73.123 53.420 1.00 15.00 A N -ATOM 823 HN PHE A 95 44.606 72.512 52.653 1.00 15.00 A H -ATOM 824 CA PHE A 95 45.870 73.816 53.751 1.00 15.00 A C -ATOM 825 CB PHE A 95 47.079 73.134 53.107 1.00 15.00 A C -ATOM 826 CG PHE A 95 47.495 71.877 53.818 1.00 15.00 A C -ATOM 827 CD1 PHE A 95 46.977 70.649 53.445 1.00 15.00 A C -ATOM 828 CD2 PHE A 95 48.392 71.927 54.872 1.00 15.00 A C -ATOM 829 CE1 PHE A 95 47.348 69.494 54.105 1.00 15.00 A C -ATOM 830 CE2 PHE A 95 48.770 70.776 55.535 1.00 15.00 A C -ATOM 831 CZ PHE A 95 48.244 69.557 55.153 1.00 15.00 A C -ATOM 832 C PHE A 95 45.822 75.309 53.417 1.00 15.00 A C -ATOM 833 O PHE A 95 46.482 76.114 54.072 1.00 15.00 A O -ATOM 834 N THR A 96 45.038 75.674 52.403 1.00 15.00 A N -ATOM 835 HN THR A 96 44.547 74.986 51.905 1.00 15.00 A H -ATOM 836 CA THR A 96 44.895 77.076 52.013 1.00 15.00 A C -ATOM 837 CB THR A 96 44.214 77.213 50.631 1.00 15.00 A C -ATOM 838 OG1 THR A 96 45.035 76.601 49.629 1.00 15.00 A O -ATOM 839 HG1 THR A 96 45.210 75.689 49.872 1.00 15.00 A H -ATOM 840 CG2 THR A 96 43.997 78.677 50.266 1.00 15.00 A C -ATOM 841 C THR A 96 44.082 77.831 53.067 1.00 15.00 A C -ATOM 842 O THR A 96 44.328 79.008 53.337 1.00 15.00 A O -ATOM 843 N GLU A 97 43.126 77.122 53.671 1.00 15.00 A N -ATOM 844 HN GLU A 97 42.995 76.187 53.407 1.00 15.00 A H -ATOM 845 CA GLU A 97 42.265 77.688 54.708 1.00 15.00 A C -ATOM 846 CB GLU A 97 41.173 76.682 55.086 1.00 15.00 A C -ATOM 847 CG GLU A 97 40.062 76.529 54.060 1.00 15.00 A C -ATOM 848 CD GLU A 97 39.393 75.169 54.125 1.00 15.00 A C -ATOM 849 OE1 GLU A 97 39.549 74.475 55.153 1.00 15.00 A O -ATOM 850 OE2 GLU A 97 38.717 74.795 53.145 1.00 15.00 A O -ATOM 851 C GLU A 97 43.061 78.041 55.960 1.00 15.00 A C -ATOM 852 O GLU A 97 42.675 78.924 56.724 1.00 15.00 A O -ATOM 853 N HIS A 98 44.173 77.344 56.165 1.00 15.00 A N -ATOM 854 HN HIS A 98 44.439 76.663 55.512 1.00 15.00 A H -ATOM 855 CA HIS A 98 45.010 77.573 57.334 1.00 15.00 A C -ATOM 856 CB HIS A 98 45.417 76.238 57.963 1.00 15.00 A C -ATOM 857 CG HIS A 98 44.266 75.470 58.536 1.00 15.00 A C -ATOM 858 ND1 HIS A 98 43.531 74.544 57.829 1.00 15.00 A N -ATOM 859 HD1 HIS A 98 43.672 74.287 56.893 1.00 15.00 A H -ATOM 860 CD2 HIS A 98 43.722 75.509 59.776 1.00 15.00 A C -ATOM 861 CE1 HIS A 98 42.584 74.063 58.642 1.00 15.00 A C -ATOM 862 NE2 HIS A 98 42.658 74.616 59.836 1.00 15.00 A N -ATOM 863 C HIS A 98 46.249 78.399 57.004 1.00 15.00 A C -ATOM 864 O HIS A 98 47.137 78.539 57.847 1.00 15.00 A O -ATOM 865 N ASN A 99 46.294 78.953 55.781 1.00 15.00 A N -ATOM 866 HN ASN A 99 45.541 78.815 55.169 1.00 15.00 A H -ATOM 867 CA ASN A 99 47.434 79.763 55.331 1.00 15.00 A C -ATOM 868 CB ASN A 99 47.444 81.108 56.070 1.00 15.00 A C -ATOM 869 CG ASN A 99 48.428 82.107 55.492 1.00 15.00 A C -ATOM 870 OD1 ASN A 99 48.651 82.154 54.282 1.00 15.00 A O -ATOM 871 ND2 ASN A 99 49.030 82.909 56.364 1.00 15.00 A N -ATOM 872 HD21 ASN A 99 48.806 82.811 57.313 1.00 15.00 A H -ATOM 873 HD22 ASN A 99 49.674 83.564 56.023 1.00 15.00 A H -ATOM 874 C ASN A 99 48.736 78.998 55.573 1.00 15.00 A C -ATOM 875 O ASN A 99 49.719 79.539 56.081 1.00 15.00 A O -ATOM 876 N ALA A 100 48.725 77.726 55.195 1.00 15.00 A N -ATOM 877 HN ALA A 100 47.926 77.367 54.757 1.00 15.00 A H -ATOM 878 CA ALA A 100 49.862 76.853 55.410 1.00 15.00 A C -ATOM 879 CB ALA A 100 49.396 75.621 56.165 1.00 15.00 A C -ATOM 880 C ALA A 100 50.531 76.420 54.118 1.00 15.00 A C -ATOM 881 O ALA A 100 49.871 76.193 53.103 1.00 15.00 A O -ATOM 882 N THR A 101 51.854 76.307 54.173 1.00 15.00 A N -ATOM 883 HN THR A 101 52.317 76.538 55.004 1.00 15.00 A H -ATOM 884 CA THR A 101 52.634 75.855 53.035 1.00 15.00 A C -ATOM 885 CB THR A 101 54.139 76.117 53.258 1.00 15.00 A C -ATOM 886 OG1 THR A 101 54.358 77.520 53.442 1.00 15.00 A O -ATOM 887 HG1 THR A 101 53.544 77.996 53.263 1.00 15.00 A H -ATOM 888 CG2 THR A 101 54.963 75.633 52.070 1.00 15.00 A C -ATOM 889 C THR A 101 52.416 74.358 52.874 1.00 15.00 A C -ATOM 890 O THR A 101 52.445 73.616 53.858 1.00 15.00 A O -ATOM 891 N PHE A 102 52.170 73.925 51.645 1.00 15.00 A N -ATOM 892 HN PHE A 102 52.136 74.569 50.907 1.00 15.00 A H -ATOM 893 CA PHE A 102 51.949 72.514 51.367 1.00 15.00 A C -ATOM 894 CB PHE A 102 51.723 72.296 49.873 1.00 15.00 A C -ATOM 895 CG PHE A 102 50.578 73.094 49.319 1.00 15.00 A C -ATOM 896 CD1 PHE A 102 50.741 73.867 48.181 1.00 15.00 A C -ATOM 897 CD2 PHE A 102 49.340 73.075 49.940 1.00 15.00 A C -ATOM 898 CE1 PHE A 102 49.689 74.605 47.672 1.00 15.00 A C -ATOM 899 CE2 PHE A 102 48.284 73.809 49.438 1.00 15.00 A C -ATOM 900 CZ PHE A 102 48.458 74.577 48.301 1.00 15.00 A C -ATOM 901 C PHE A 102 53.123 71.677 51.859 1.00 15.00 A C -ATOM 902 O PHE A 102 54.278 71.999 51.595 1.00 15.00 A O -ATOM 903 N PRO A 103 52.843 70.606 52.607 1.00 15.00 A N -ATOM 904 CA PRO A 103 53.870 69.725 53.146 1.00 15.00 A C -ATOM 905 CB PRO A 103 53.164 69.043 54.333 1.00 15.00 A C -ATOM 906 CG PRO A 103 51.742 69.515 54.319 1.00 15.00 A C -ATOM 907 CD PRO A 103 51.501 70.163 52.989 1.00 15.00 A C -ATOM 908 C PRO A 103 54.278 68.668 52.133 1.00 15.00 A C -ATOM 909 O PRO A 103 53.584 68.458 51.136 1.00 15.00 A O -ATOM 910 N ALA A 104 55.431 68.039 52.361 1.00 15.00 A N -ATOM 911 HN ALA A 104 55.989 68.319 53.119 1.00 15.00 A H -ATOM 912 CA ALA A 104 55.890 66.962 51.490 1.00 15.00 A C -ATOM 913 CB ALA A 104 57.273 66.493 51.916 1.00 15.00 A C -ATOM 914 C ALA A 104 54.885 65.818 51.593 1.00 15.00 A C -ATOM 915 O ALA A 104 54.306 65.607 52.656 1.00 15.00 A O -ATOM 916 N ARG A 105 54.647 65.090 50.513 1.00 15.00 A N -ATOM 917 HN ARG A 105 55.119 65.275 49.670 1.00 15.00 A H -ATOM 918 CA ARG A 105 53.660 64.029 50.585 1.00 15.00 A C -ATOM 919 CB ARG A 105 52.250 64.638 50.459 1.00 15.00 A C -ATOM 920 CG ARG A 105 51.345 63.962 49.452 1.00 15.00 A C -ATOM 921 CD ARG A 105 50.992 64.901 48.317 1.00 15.00 A C -ATOM 922 NE ARG A 105 49.804 65.717 48.579 1.00 15.00 A N -ATOM 923 HE ARG A 105 49.793 66.258 49.403 1.00 15.00 A H -ATOM 924 CZ ARG A 105 48.754 65.767 47.737 1.00 15.00 A C -ATOM 925 NH1 ARG A 105 48.768 65.046 46.630 1.00 15.00 A N -ATOM 926 HH11 ARG A 105 49.585 64.452 46.414 1.00 15.00 A H -ATOM 927 HH12 ARG A 105 47.963 65.070 45.980 1.00 15.00 A H -ATOM 928 NH2 ARG A 105 47.737 66.592 47.956 1.00 15.00 A N -ATOM 929 HH21 ARG A 105 47.749 67.220 48.789 1.00 15.00 A H -ATOM 930 HH22 ARG A 105 46.929 66.620 47.295 1.00 15.00 A H -ATOM 931 C ARG A 105 53.878 62.847 49.618 1.00 15.00 A C -ATOM 932 O ARG A 105 54.413 62.992 48.513 1.00 15.00 A O -ATOM 933 N SER A 106 53.479 61.665 50.095 1.00 15.00 A N -ATOM 934 HN SER A 106 53.128 61.622 51.007 1.00 15.00 A H -ATOM 935 CA SER A 106 53.539 60.435 49.322 1.00 15.00 A C -ATOM 936 CB SER A 106 54.353 59.363 50.047 1.00 15.00 A C -ATOM 937 OG SER A 106 55.723 59.704 50.092 1.00 15.00 A O -ATOM 938 HG SER A 106 55.814 60.623 50.339 1.00 15.00 A H -ATOM 939 C SER A 106 52.103 59.970 49.113 1.00 15.00 A C -ATOM 940 O SER A 106 51.289 60.045 50.036 1.00 15.00 A O -ATOM 941 N CSP A 107 51.779 59.534 47.903 1.00 15.00 A N -ATOM 942 HN CSP A 107 52.463 59.498 47.208 1.00 15.00 A H -ATOM 943 CA CSP A 107 50.414 59.118 47.583 1.00 15.00 A C -ATOM 944 CB CSP A 107 49.760 60.176 46.660 0.67 15.00 A C -ATOM 945 SG CSP A 107 50.439 61.858 46.826 0.67 15.00 A S -ATOM 946 P CSP A 107 51.448 62.012 44.987 0.67 15.00 A P -ATOM 947 O1P CSP A 107 51.589 60.551 45.205 0.67 15.00 A O -ATOM 948 O2P CSP A 107 50.962 62.021 43.586 0.67 15.00 A O -ATOM 949 O3P CSP A 107 50.428 63.236 45.252 0.67 15.00 A O -ATOM 950 C CSP A 107 50.378 57.743 46.912 1.00 15.00 A C -ATOM 951 O CSP A 107 50.976 57.548 45.856 1.00 15.00 A O -ATOM 952 N VAL A 108 49.675 56.792 47.527 1.00 15.00 A N -ATOM 953 HN VAL A 108 49.223 57.004 48.367 1.00 15.00 A H -ATOM 954 CA VAL A 108 49.560 55.435 46.968 1.00 15.00 A C -ATOM 955 CB VAL A 108 50.581 54.439 47.580 1.00 15.00 A C -ATOM 956 CG1 VAL A 108 52.013 54.871 47.333 1.00 15.00 A C -ATOM 957 CG2 VAL A 108 50.321 54.219 49.066 1.00 15.00 A C -ATOM 958 C VAL A 108 48.155 54.858 47.163 1.00 15.00 A C -ATOM 959 O VAL A 108 47.455 55.218 48.108 1.00 15.00 A O -ATOM 960 N GLU A 109 47.748 53.962 46.259 1.00 15.00 A N -ATOM 961 HN GLU A 109 48.341 53.732 45.512 1.00 15.00 A H -ATOM 962 CA GLU A 109 46.441 53.312 46.355 1.00 15.00 A C -ATOM 963 CB GLU A 109 45.778 53.198 44.976 1.00 15.00 A C -ATOM 964 CG GLU A 109 44.352 52.662 45.005 1.00 15.00 A C -ATOM 965 CD GLU A 109 43.857 52.239 43.635 1.00 15.00 A C -ATOM 966 OE1 GLU A 109 43.516 51.049 43.467 1.00 15.00 A O -ATOM 967 OE2 GLU A 109 43.811 53.096 42.729 1.00 15.00 A O -ATOM 968 C GLU A 109 46.623 51.928 46.962 1.00 15.00 A C -ATOM 969 O GLU A 109 47.354 51.105 46.423 1.00 15.00 A O -ATOM 970 N VAL A 110 45.974 51.680 48.090 1.00 15.00 A N -ATOM 971 HN VAL A 110 45.399 52.375 48.476 1.00 15.00 A H -ATOM 972 CA VAL A 110 46.094 50.394 48.768 1.00 15.00 A C -ATOM 973 CB VAL A 110 46.194 50.572 50.297 1.00 15.00 A C -ATOM 974 CG1 VAL A 110 47.467 51.328 50.653 1.00 15.00 A C -ATOM 975 CG2 VAL A 110 44.970 51.302 50.828 1.00 15.00 A C -ATOM 976 C VAL A 110 44.935 49.464 48.434 1.00 15.00 A C -ATOM 977 O VAL A 110 43.969 49.862 47.777 1.00 15.00 A O -ATOM 978 N ALA A 111 45.050 48.219 48.882 1.00 15.00 A N -ATOM 979 HN ALA A 111 45.845 47.964 49.390 1.00 15.00 A H -ATOM 980 CA ALA A 111 44.023 47.229 48.645 1.00 15.00 A C -ATOM 981 CB ALA A 111 44.518 45.830 49.006 1.00 15.00 A C -ATOM 982 C ALA A 111 42.789 47.568 49.450 1.00 15.00 A C -ATOM 983 O ALA A 111 41.672 47.606 48.926 1.00 15.00 A O -ATOM 984 N ARG A 112 42.988 47.787 50.736 1.00 15.00 A N -ATOM 985 HN ARG A 112 43.894 47.705 51.111 1.00 15.00 A H -ATOM 986 CA ARG A 112 41.889 48.116 51.606 1.00 15.00 A C -ATOM 987 CB ARG A 112 41.180 46.833 52.018 1.00 15.00 A C -ATOM 988 CG ARG A 112 39.737 47.059 52.382 1.00 15.00 A C -ATOM 989 CD ARG A 112 39.417 46.382 53.687 1.00 15.00 A C -ATOM 990 NE ARG A 112 39.195 44.963 53.514 1.00 15.00 A N -ATOM 991 HE ARG A 112 39.719 44.493 52.812 1.00 15.00 A H -ATOM 992 CZ ARG A 112 38.355 44.272 54.266 1.00 15.00 A C -ATOM 993 NH1 ARG A 112 37.672 44.887 55.239 1.00 15.00 A N -ATOM 994 HH11 ARG A 112 36.997 44.363 55.837 1.00 15.00 A H -ATOM 995 HH12 ARG A 112 37.790 45.909 55.384 1.00 15.00 A H -ATOM 996 NH2 ARG A 112 38.213 42.979 54.058 1.00 15.00 A N -ATOM 997 HH21 ARG A 112 38.749 42.523 53.297 1.00 15.00 A H -ATOM 998 HH22 ARG A 112 37.549 42.419 54.641 1.00 15.00 A H -ATOM 999 C ARG A 112 42.372 48.890 52.841 1.00 15.00 A C -ATOM 1000 O ARG A 112 43.543 48.802 53.224 1.00 15.00 A O -ATOM 1001 N LEU A 113 41.463 49.645 53.465 1.00 15.00 A N -ATOM 1002 HN LEU A 113 40.549 49.674 53.119 1.00 15.00 A H -ATOM 1003 CA LEU A 113 41.784 50.429 54.652 1.00 15.00 A C -ATOM 1004 CB LEU A 113 41.628 51.921 54.337 1.00 15.00 A C -ATOM 1005 CG LEU A 113 42.663 52.512 53.378 1.00 15.00 A C -ATOM 1006 CD1 LEU A 113 42.197 53.844 52.816 1.00 15.00 A C -ATOM 1007 CD2 LEU A 113 44.003 52.665 54.074 1.00 15.00 A C -ATOM 1008 C LEU A 113 40.870 50.032 55.813 1.00 15.00 A C -ATOM 1009 O LEU A 113 39.812 49.445 55.588 1.00 15.00 A O -ATOM 1010 N PRO A 114 41.278 50.323 57.068 1.00 15.00 A N -ATOM 1011 CA PRO A 114 40.483 49.995 58.260 1.00 15.00 A C -ATOM 1012 CB PRO A 114 41.241 50.690 59.392 1.00 15.00 A C -ATOM 1013 CG PRO A 114 42.644 50.766 58.903 1.00 15.00 A C -ATOM 1014 CD PRO A 114 42.550 50.981 57.423 1.00 15.00 A C -ATOM 1015 C PRO A 114 39.060 50.538 58.167 1.00 15.00 A C -ATOM 1016 O PRO A 114 38.855 51.719 57.871 1.00 15.00 A O -ATOM 1017 N LYS A 115 38.089 49.652 58.406 1.00 15.00 A N -ATOM 1018 HN LYS A 115 38.341 48.731 58.628 1.00 15.00 A H -ATOM 1019 CA LYS A 115 36.664 49.996 58.353 1.00 15.00 A C -ATOM 1020 CB LYS A 115 36.329 51.188 59.257 1.00 15.00 A C -ATOM 1021 CG LYS A 115 36.563 50.936 60.738 1.00 15.00 A C -ATOM 1022 CD LYS A 115 36.184 52.152 61.564 1.00 15.00 A C -ATOM 1023 CE LYS A 115 36.174 51.830 63.048 1.00 15.00 A C -ATOM 1024 NZ LYS A 115 34.883 52.209 63.684 1.00 15.00 A N -ATOM 1025 HZ1 LYS A 115 34.708 53.227 63.558 1.00 15.00 A H -ATOM 1026 HZ2 LYS A 115 34.908 51.996 64.701 1.00 15.00 A H -ATOM 1027 HZ3 LYS A 115 34.102 51.678 63.248 1.00 15.00 A H -ATOM 1028 C LYS A 115 36.177 50.241 56.923 1.00 15.00 A C -ATOM 1029 O LYS A 115 35.110 50.822 56.719 1.00 15.00 A O -ATOM 1030 N ASP A 116 36.967 49.788 55.941 1.00 15.00 A N -ATOM 1031 HN ASP A 116 37.803 49.337 56.180 1.00 15.00 A H -ATOM 1032 CA ASP A 116 36.635 49.944 54.521 1.00 15.00 A C -ATOM 1033 CB ASP A 116 35.341 49.205 54.158 1.00 15.00 A C -ATOM 1034 CG ASP A 116 35.552 47.718 53.959 1.00 15.00 A C -ATOM 1035 OD1 ASP A 116 35.352 46.954 54.926 1.00 15.00 A O -ATOM 1036 OD2 ASP A 116 35.917 47.315 52.833 1.00 15.00 A O -ATOM 1037 C ASP A 116 36.557 51.407 54.091 1.00 15.00 A C -ATOM 1038 O ASP A 116 35.818 51.751 53.166 1.00 15.00 A O -ATOM 1039 N VAL A 117 37.331 52.266 54.753 1.00 15.00 A N -ATOM 1040 HN VAL A 117 37.905 51.937 55.475 1.00 15.00 A H -ATOM 1041 CA VAL A 117 37.337 53.688 54.423 1.00 15.00 A C -ATOM 1042 CB VAL A 117 37.960 54.560 55.534 1.00 15.00 A C -ATOM 1043 CG1 VAL A 117 37.159 54.437 56.821 1.00 15.00 A C -ATOM 1044 CG2 VAL A 117 39.417 54.194 55.769 1.00 15.00 A C -ATOM 1045 C VAL A 117 38.036 53.946 53.091 1.00 15.00 A C -ATOM 1046 O VAL A 117 38.735 53.079 52.565 1.00 15.00 A O -ATOM 1047 N LYS A 118 37.841 55.140 52.551 1.00 15.00 A N -ATOM 1048 HN LYS A 118 37.285 55.795 53.025 1.00 15.00 A H -ATOM 1049 CA LYS A 118 38.430 55.502 51.269 1.00 15.00 A C -ATOM 1050 CB LYS A 118 37.428 56.296 50.427 1.00 15.00 A C -ATOM 1051 CG LYS A 118 36.107 55.586 50.183 1.00 15.00 A C -ATOM 1052 CD LYS A 118 35.102 56.518 49.526 1.00 15.00 A C -ATOM 1053 CE LYS A 118 33.760 55.837 49.316 1.00 15.00 A C -ATOM 1054 NZ LYS A 118 32.764 56.764 48.711 1.00 15.00 A N -ATOM 1055 HZ1 LYS A 118 32.601 57.574 49.344 1.00 15.00 A H -ATOM 1056 HZ2 LYS A 118 31.862 56.272 48.558 1.00 15.00 A H -ATOM 1057 HZ3 LYS A 118 33.114 57.118 47.798 1.00 15.00 A H -ATOM 1058 C LYS A 118 39.731 56.293 51.407 1.00 15.00 A C -ATOM 1059 O LYS A 118 40.380 56.585 50.401 1.00 15.00 A O -ATOM 1060 N ILE A 119 40.124 56.640 52.637 1.00 15.00 A N -ATOM 1061 HN ILE A 119 39.586 56.379 53.413 1.00 15.00 A H -ATOM 1062 CA ILE A 119 41.354 57.408 52.826 1.00 15.00 A C -ATOM 1063 CB ILE A 119 41.177 58.881 52.381 1.00 15.00 A C -ATOM 1064 CG1 ILE A 119 42.527 59.601 52.300 1.00 15.00 A C -ATOM 1065 CG2 ILE A 119 40.216 59.623 53.302 1.00 15.00 A C -ATOM 1066 CD1 ILE A 119 42.452 60.978 51.683 1.00 15.00 A C -ATOM 1067 C ILE A 119 41.909 57.356 54.256 1.00 15.00 A C -ATOM 1068 O ILE A 119 41.164 57.298 55.234 1.00 15.00 A O -ATOM 1069 N GLU A 120 43.238 57.358 54.346 1.00 15.00 A N -ATOM 1070 HN GLU A 120 43.762 57.352 53.517 1.00 15.00 A H -ATOM 1071 CA GLU A 120 43.953 57.358 55.619 1.00 15.00 A C -ATOM 1072 CB GLU A 120 44.427 55.952 55.984 1.00 15.00 A C -ATOM 1073 CG GLU A 120 45.051 55.860 57.368 1.00 15.00 A C -ATOM 1074 CD GLU A 120 45.543 54.468 57.695 1.00 15.00 A C -ATOM 1075 OE1 GLU A 120 46.631 54.348 58.297 1.00 15.00 A O -ATOM 1076 OE2 GLU A 120 44.841 53.498 57.349 1.00 15.00 A O -ATOM 1077 C GLU A 120 45.149 58.297 55.496 1.00 15.00 A C -ATOM 1078 O GLU A 120 45.953 58.159 54.575 1.00 15.00 A O -ATOM 1079 N ILE A 121 45.269 59.254 56.411 1.00 15.00 A N -ATOM 1080 HN ILE A 121 44.620 59.308 57.144 1.00 15.00 A H -ATOM 1081 CA ILE A 121 46.359 60.221 56.334 1.00 15.00 A C -ATOM 1082 CB ILE A 121 45.834 61.626 55.951 1.00 15.00 A C -ATOM 1083 CG1 ILE A 121 44.964 61.559 54.690 1.00 15.00 A C -ATOM 1084 CG2 ILE A 121 46.989 62.598 55.748 1.00 15.00 A C -ATOM 1085 CD1 ILE A 121 44.188 62.827 54.411 1.00 15.00 A C -ATOM 1086 C ILE A 121 47.177 60.338 57.620 1.00 15.00 A C -ATOM 1087 O ILE A 121 46.647 60.663 58.683 1.00 15.00 A O -ATOM 1088 N GLU A 122 48.475 60.062 57.504 1.00 15.00 A N -ATOM 1089 HN GLU A 122 48.817 59.753 56.640 1.00 15.00 A H -ATOM 1090 CA GLU A 122 49.406 60.202 58.621 1.00 15.00 A C -ATOM 1091 CB GLU A 122 50.345 58.993 58.722 1.00 15.00 A C -ATOM 1092 CG GLU A 122 51.197 58.749 57.485 1.00 15.00 A C -ATOM 1093 CD GLU A 122 52.358 57.803 57.738 1.00 15.00 A C -ATOM 1094 OE1 GLU A 122 53.339 57.849 56.968 1.00 15.00 A O -ATOM 1095 OE2 GLU A 122 52.292 57.019 58.706 1.00 15.00 A O -ATOM 1096 C GLU A 122 50.204 61.484 58.389 1.00 15.00 A C -ATOM 1097 O GLU A 122 50.412 61.874 57.240 1.00 15.00 A O -ATOM 1098 N ALA A 123 50.652 62.148 59.450 1.00 15.00 A N -ATOM 1099 HN ALA A 123 50.493 61.796 60.351 1.00 15.00 A H -ATOM 1100 CA ALA A 123 51.384 63.398 59.272 1.00 15.00 A C -ATOM 1101 CB ALA A 123 50.425 64.579 59.276 1.00 15.00 A C -ATOM 1102 C ALA A 123 52.503 63.621 60.282 1.00 15.00 A C -ATOM 1103 O ALA A 123 52.478 63.105 61.400 1.00 15.00 A O -ATOM 1104 N ILE A 124 53.482 64.413 59.853 1.00 15.00 A N -ATOM 1105 HN ILE A 124 53.428 64.767 58.941 1.00 15.00 A H -ATOM 1106 CA ILE A 124 54.633 64.774 60.667 1.00 15.00 A C -ATOM 1107 CB ILE A 124 55.939 64.211 60.055 1.00 15.00 A C -ATOM 1108 CG1 ILE A 124 55.916 62.677 60.054 1.00 15.00 A C -ATOM 1109 CG2 ILE A 124 57.163 64.732 60.798 1.00 15.00 A C -ATOM 1110 CD1 ILE A 124 57.111 62.040 59.380 1.00 15.00 A C -ATOM 1111 C ILE A 124 54.728 66.299 60.742 1.00 15.00 A C -ATOM 1112 O ILE A 124 54.742 66.972 59.715 1.00 15.00 A O -ATOM 1113 N ALA A 125 54.777 66.838 61.956 1.00 15.00 A N -ATOM 1114 HN ALA A 125 54.765 66.250 62.741 1.00 15.00 A H -ATOM 1115 CA ALA A 125 54.855 68.283 62.150 1.00 15.00 A C -ATOM 1116 CB ALA A 125 53.575 68.795 62.794 1.00 15.00 A C -ATOM 1117 C ALA A 125 56.065 68.661 62.999 1.00 15.00 A C -ATOM 1118 O ALA A 125 56.557 67.853 63.778 1.00 15.00 A O -ATOM 1119 N VAL A 126 56.544 69.891 62.841 1.00 15.00 A N -ATOM 1120 HN VAL A 126 56.114 70.496 62.202 1.00 15.00 A H -ATOM 1121 CA VAL A 126 57.700 70.362 63.601 1.00 15.00 A C -ATOM 1122 CB VAL A 126 58.988 70.410 62.747 1.00 15.00 A C -ATOM 1123 CG1 VAL A 126 59.488 69.007 62.442 1.00 15.00 A C -ATOM 1124 CG2 VAL A 126 58.759 71.193 61.463 1.00 15.00 A C -ATOM 1125 C VAL A 126 57.448 71.735 64.216 1.00 15.00 A C -ATOM 1126 O VAL A 126 56.688 72.539 63.677 1.00 15.00 A O -ATOM 1127 N ARG A 127 58.088 71.995 65.353 1.00 15.00 A N -ATOM 1128 HN ARG A 127 58.673 71.309 65.739 1.00 15.00 A H -ATOM 1129 CA ARG A 127 57.942 73.272 66.042 1.00 15.00 A C -ATOM 1130 CB ARG A 127 58.246 73.119 67.535 1.00 15.00 A C -ATOM 1131 CG ARG A 127 57.455 72.012 68.216 1.00 15.00 A C -ATOM 1132 CD ARG A 127 57.520 72.134 69.728 1.00 15.00 A C -ATOM 1133 NE ARG A 127 56.782 71.065 70.403 1.00 15.00 A N -ATOM 1134 HE ARG A 127 57.276 70.249 70.633 1.00 15.00 A H -ATOM 1135 CZ ARG A 127 55.491 71.134 70.709 1.00 15.00 A C -ATOM 1136 NH1 ARG A 127 54.789 72.216 70.403 1.00 15.00 A N -ATOM 1137 HH11 ARG A 127 53.779 72.267 70.644 1.00 15.00 A H -ATOM 1138 HH12 ARG A 127 55.249 73.014 69.917 1.00 15.00 A H -ATOM 1139 NH2 ARG A 127 54.903 70.125 71.335 1.00 15.00 A N -ATOM 1140 HH21 ARG A 127 55.450 69.275 71.586 1.00 15.00 A H -ATOM 1141 HH22 ARG A 127 53.892 70.181 71.575 1.00 15.00 A H -ATOM 1142 C ARG A 127 58.843 74.331 65.412 1.00 15.00 A C -ATOM 1143 O ARG A 127 58.460 75.495 65.290 1.00 15.00 A O -ATOM 1144 N ARG A 128 60.044 73.918 65.017 1.00 15.00 A N -ATOM 1145 HN ARG A 128 60.297 72.982 65.163 1.00 15.00 A H -ATOM 1146 CA ARG A 128 60.996 74.818 64.378 1.00 15.00 A C -ATOM 1147 CB ARG A 128 62.364 74.729 65.054 1.00 15.00 A C -ATOM 1148 CG ARG A 128 62.596 75.776 66.129 1.00 15.00 A C -ATOM 1149 CD ARG A 128 64.026 75.724 66.636 1.00 15.00 A C -ATOM 1150 NE ARG A 128 64.711 77.007 66.487 1.00 15.00 A N -ATOM 1151 HE ARG A 128 64.288 77.686 65.919 1.00 15.00 A H -ATOM 1152 CZ ARG A 128 65.871 77.291 67.072 1.00 15.00 A C -ATOM 1153 NH1 ARG A 128 66.463 76.386 67.839 1.00 15.00 A N -ATOM 1154 HH11 ARG A 128 66.020 75.455 67.979 1.00 15.00 A H -ATOM 1155 HH12 ARG A 128 67.369 76.606 68.299 1.00 15.00 A H -ATOM 1156 NH2 ARG A 128 66.435 78.479 66.897 1.00 15.00 A N -ATOM 1157 HH21 ARG A 128 65.972 79.192 66.299 1.00 15.00 A H -ATOM 1158 HH22 ARG A 128 67.342 78.698 67.359 1.00 15.00 A H -ATOM 1159 C ARG A 128 61.131 74.498 62.895 1.00 15.00 A C -ATOM 1160 O ARG A 128 61.245 73.334 62.510 1.00 15.00 A O -ATOM 1161 N SER B 2 62.025 75.204 59.750 1.00 15.00 B N -ATOM 1162 HN SER B 2 62.201 76.164 59.657 1.00 15.00 B H -ATOM 1163 CA SER B 2 61.977 74.369 58.556 1.00 15.00 B C -ATOM 1164 CB SER B 2 60.889 73.300 58.691 1.00 15.00 B C -ATOM 1165 OG SER B 2 59.605 73.890 58.803 1.00 15.00 B O -ATOM 1166 HG SER B 2 59.622 74.768 58.414 1.00 15.00 B H -ATOM 1167 C SER B 2 61.740 75.209 57.303 1.00 15.00 B C -ATOM 1168 O SER B 2 61.211 76.318 57.381 1.00 15.00 B O -ATOM 1169 N LYS B 3 62.133 74.673 56.148 1.00 15.00 B N -ATOM 1170 HN LYS B 3 62.549 73.786 56.151 1.00 15.00 B H -ATOM 1171 CA LYS B 3 61.962 75.376 54.879 1.00 15.00 B C -ATOM 1172 CB LYS B 3 63.228 76.166 54.521 1.00 15.00 B C -ATOM 1173 CG LYS B 3 64.413 75.303 54.116 1.00 15.00 B C -ATOM 1174 CD LYS B 3 65.692 76.119 53.996 1.00 15.00 B C -ATOM 1175 CE LYS B 3 66.247 76.485 55.364 1.00 15.00 B C -ATOM 1176 NZ LYS B 3 67.647 76.988 55.281 1.00 15.00 B N -ATOM 1177 HZ1 LYS B 3 68.266 76.255 54.878 1.00 15.00 B H -ATOM 1178 HZ2 LYS B 3 67.995 77.235 56.229 1.00 15.00 B H -ATOM 1179 HZ3 LYS B 3 67.689 77.833 54.677 1.00 15.00 B H -ATOM 1180 C LYS B 3 61.590 74.416 53.746 1.00 15.00 B C -ATOM 1181 O LYS B 3 61.767 73.204 53.861 1.00 15.00 B O -ATOM 1182 N THR B 4 61.072 74.974 52.658 1.00 15.00 B N -ATOM 1183 HN THR B 4 60.946 75.945 52.636 1.00 15.00 B H -ATOM 1184 CA THR B 4 60.672 74.185 51.494 1.00 15.00 B C -ATOM 1185 CB THR B 4 59.544 74.903 50.714 1.00 15.00 B C -ATOM 1186 OG1 THR B 4 58.344 74.917 51.496 1.00 15.00 B O -ATOM 1187 HG1 THR B 4 57.636 75.326 50.992 1.00 15.00 B H -ATOM 1188 CG2 THR B 4 59.268 74.229 49.377 1.00 15.00 B C -ATOM 1189 C THR B 4 61.854 73.949 50.550 1.00 15.00 B C -ATOM 1190 O THR B 4 62.646 74.856 50.292 1.00 15.00 B O -ATOM 1191 N ILE B 5 61.970 72.721 50.047 1.00 15.00 B N -ATOM 1192 HN ILE B 5 61.324 72.033 50.315 1.00 15.00 B H -ATOM 1193 CA ILE B 5 63.031 72.373 49.110 1.00 15.00 B C -ATOM 1194 CB ILE B 5 63.599 70.958 49.369 1.00 15.00 B C -ATOM 1195 CG1 ILE B 5 64.150 70.853 50.795 1.00 15.00 B C -ATOM 1196 CG2 ILE B 5 64.685 70.627 48.355 1.00 15.00 B C -ATOM 1197 CD1 ILE B 5 64.693 69.485 51.146 1.00 15.00 B C -ATOM 1198 C ILE B 5 62.499 72.452 47.681 1.00 15.00 B C -ATOM 1199 O ILE B 5 61.668 71.640 47.271 1.00 15.00 B O -ATOM 1200 N ALA B 6 62.971 73.445 46.932 1.00 15.00 B N -ATOM 1201 HN ALA B 6 63.631 74.059 47.315 1.00 15.00 B H -ATOM 1202 CA ALA B 6 62.533 73.637 45.555 1.00 15.00 B C -ATOM 1203 CB ALA B 6 61.766 74.944 45.420 1.00 15.00 B C -ATOM 1204 C ALA B 6 63.707 73.602 44.581 1.00 15.00 B C -ATOM 1205 O ALA B 6 64.601 74.446 44.637 1.00 15.00 B O -ATOM 1206 N THR B 7 63.691 72.617 43.689 1.00 15.00 B N -ATOM 1207 HN THR B 7 62.950 71.974 43.702 1.00 15.00 B H -ATOM 1208 CA THR B 7 64.742 72.462 42.693 1.00 15.00 B C -ATOM 1209 CB THR B 7 65.769 71.377 43.096 1.00 15.00 B C -ATOM 1210 OG1 THR B 7 66.760 71.233 42.069 1.00 15.00 B O -ATOM 1211 HG1 THR B 7 67.300 70.461 42.250 1.00 15.00 B H -ATOM 1212 CG2 THR B 7 65.090 70.036 43.339 1.00 15.00 B C -ATOM 1213 C THR B 7 64.163 72.154 41.311 1.00 15.00 B C -ATOM 1214 O THR B 7 63.147 71.470 41.183 1.00 15.00 B O -ATOM 1215 N GLU B 8 64.825 72.674 40.282 1.00 15.00 B N -ATOM 1216 HN GLU B 8 65.625 73.213 40.458 1.00 15.00 B H -ATOM 1217 CA GLU B 8 64.404 72.472 38.898 1.00 15.00 B C -ATOM 1218 CB GLU B 8 64.957 73.602 38.015 1.00 15.00 B C -ATOM 1219 CG GLU B 8 66.444 73.479 37.682 1.00 15.00 B C -ATOM 1220 CD GLU B 8 67.367 74.098 38.722 1.00 15.00 B C -ATOM 1221 OE1 GLU B 8 66.900 74.401 39.840 1.00 15.00 B O -ATOM 1222 OE2 GLU B 8 68.563 74.277 38.415 1.00 15.00 B O -ATOM 1223 C GLU B 8 64.890 71.125 38.369 1.00 15.00 B C -ATOM 1224 O GLU B 8 64.506 70.692 37.281 1.00 15.00 B O -ATOM 1225 N ASN B 9 65.733 70.467 39.160 1.00 15.00 B N -ATOM 1226 HN ASN B 9 65.980 70.862 40.021 1.00 15.00 B H -ATOM 1227 CA ASN B 9 66.294 69.175 38.786 1.00 15.00 B C -ATOM 1228 CB ASN B 9 67.634 68.963 39.494 1.00 15.00 B C -ATOM 1229 CG ASN B 9 68.678 69.964 39.035 1.00 15.00 B C -ATOM 1230 OD1 ASN B 9 68.758 70.296 37.852 1.00 15.00 B O -ATOM 1231 ND2 ASN B 9 69.476 70.466 39.972 1.00 15.00 B N -ATOM 1232 HD21 ASN B 9 69.351 70.168 40.896 1.00 15.00 B H -ATOM 1233 HD22 ASN B 9 70.156 71.118 39.698 1.00 15.00 B H -ATOM 1234 C ASN B 9 65.321 68.033 39.072 1.00 15.00 B C -ATOM 1235 O ASN B 9 65.587 66.878 38.745 1.00 15.00 B O -ATOM 1236 N ALA B 10 64.194 68.375 39.688 1.00 15.00 B N -ATOM 1237 HN ALA B 10 64.057 69.311 39.943 1.00 15.00 B H -ATOM 1238 CA ALA B 10 63.155 67.403 40.001 1.00 15.00 B C -ATOM 1239 CB ALA B 10 63.074 67.190 41.507 1.00 15.00 B C -ATOM 1240 C ALA B 10 61.818 67.901 39.456 1.00 15.00 B C -ATOM 1241 O ALA B 10 61.637 69.108 39.285 1.00 15.00 B O -ATOM 1242 N PRO B 11 60.872 66.983 39.151 1.00 15.00 B N -ATOM 1243 CA PRO B 11 59.545 67.345 38.631 1.00 15.00 B C -ATOM 1244 CB PRO B 11 58.764 66.034 38.715 1.00 15.00 B C -ATOM 1245 CG PRO B 11 59.806 64.979 38.599 1.00 15.00 B C -ATOM 1246 CD PRO B 11 61.031 65.524 39.277 1.00 15.00 B C -ATOM 1247 C PRO B 11 58.876 68.412 39.491 1.00 15.00 B C -ATOM 1248 O PRO B 11 58.752 68.253 40.707 1.00 15.00 B O -ATOM 1249 N ALA B 12 58.455 69.498 38.846 1.00 15.00 B N -ATOM 1250 HN ALA B 12 58.578 69.547 37.874 1.00 15.00 B H -ATOM 1251 CA ALA B 12 57.818 70.619 39.532 1.00 15.00 B C -ATOM 1252 CB ALA B 12 57.447 71.707 38.536 1.00 15.00 B C -ATOM 1253 C ALA B 12 56.595 70.195 40.340 1.00 15.00 B C -ATOM 1254 O ALA B 12 55.773 69.400 39.880 1.00 15.00 B O -ATOM 1255 N ALA B 13 56.494 70.732 41.553 1.00 15.00 B N -ATOM 1256 HN ALA B 13 57.193 71.346 41.862 1.00 15.00 B H -ATOM 1257 CA ALA B 13 55.375 70.436 42.438 1.00 15.00 B C -ATOM 1258 CB ALA B 13 55.766 70.720 43.881 1.00 15.00 B C -ATOM 1259 C ALA B 13 54.151 71.258 42.037 1.00 15.00 B C -ATOM 1260 O ALA B 13 53.971 72.388 42.489 1.00 15.00 B O -ATOM 1261 N ILE B 14 53.319 70.677 41.177 1.00 15.00 B N -ATOM 1262 HN ILE B 14 53.518 69.770 40.866 1.00 15.00 B H -ATOM 1263 CA ILE B 14 52.122 71.348 40.680 1.00 15.00 B C -ATOM 1264 CB ILE B 14 51.712 70.805 39.292 1.00 15.00 B C -ATOM 1265 CG1 ILE B 14 52.886 70.907 38.313 1.00 15.00 B C -ATOM 1266 CG2 ILE B 14 50.503 71.560 38.755 1.00 15.00 B C -ATOM 1267 CD1 ILE B 14 52.648 70.222 36.986 1.00 15.00 B C -ATOM 1268 C ILE B 14 50.944 71.220 41.644 1.00 15.00 B C -ATOM 1269 O ILE B 14 50.220 72.188 41.881 1.00 15.00 B O -ATOM 1270 N GLY B 15 50.753 70.025 42.198 1.00 15.00 B N -ATOM 1271 HN GLY B 15 51.365 69.290 41.982 1.00 15.00 B H -ATOM 1272 CA GLY B 15 49.654 69.804 43.121 1.00 15.00 B C -ATOM 1273 C GLY B 15 49.887 70.449 44.474 1.00 15.00 B C -ATOM 1274 O GLY B 15 50.854 71.193 44.650 1.00 15.00 B O -ATOM 1275 N PRO B 16 49.006 70.189 45.455 1.00 15.00 B N -ATOM 1276 CA PRO B 16 49.140 70.749 46.799 1.00 15.00 B C -ATOM 1277 CB PRO B 16 47.752 70.553 47.410 1.00 15.00 B C -ATOM 1278 CG PRO B 16 47.150 69.405 46.669 1.00 15.00 B C -ATOM 1279 CD PRO B 16 47.806 69.345 45.316 1.00 15.00 B C -ATOM 1280 C PRO B 16 50.206 70.026 47.623 1.00 15.00 B C -ATOM 1281 O PRO B 16 49.898 69.314 48.581 1.00 15.00 B O -ATOM 1282 N TYR B 17 51.466 70.223 47.237 1.00 15.00 B N -ATOM 1283 HN TYR B 17 51.638 70.805 46.465 1.00 15.00 B H -ATOM 1284 CA TYR B 17 52.597 69.604 47.918 1.00 15.00 B C -ATOM 1285 CB TYR B 17 52.642 68.098 47.614 1.00 15.00 B C -ATOM 1286 CG TYR B 17 52.975 67.775 46.170 1.00 15.00 B C -ATOM 1287 CD1 TYR B 17 54.282 67.510 45.778 1.00 15.00 B C -ATOM 1288 CD2 TYR B 17 51.984 67.741 45.198 1.00 15.00 B C -ATOM 1289 CE1 TYR B 17 54.593 67.236 44.461 1.00 15.00 B C -ATOM 1290 CE2 TYR B 17 52.284 67.461 43.880 1.00 15.00 B C -ATOM 1291 CZ TYR B 17 53.589 67.209 43.516 1.00 15.00 B C -ATOM 1292 OH TYR B 17 53.893 66.940 42.202 1.00 15.00 B O -ATOM 1293 HH TYR B 17 54.543 66.235 42.160 1.00 15.00 B H -ATOM 1294 C TYR B 17 53.908 70.238 47.466 1.00 15.00 B C -ATOM 1295 O TYR B 17 53.962 70.917 46.441 1.00 15.00 B O -ATOM 1296 N VAL B 18 54.957 70.025 48.250 1.00 15.00 B N -ATOM 1297 HN VAL B 18 54.834 69.521 49.082 1.00 15.00 B H -ATOM 1298 CA VAL B 18 56.285 70.523 47.915 1.00 15.00 B C -ATOM 1299 CB VAL B 18 56.889 71.396 49.035 1.00 15.00 B C -ATOM 1300 CG1 VAL B 18 56.104 72.690 49.184 1.00 15.00 B C -ATOM 1301 CG2 VAL B 18 56.942 70.637 50.354 1.00 15.00 B C -ATOM 1302 C VAL B 18 57.199 69.334 47.641 1.00 15.00 B C -ATOM 1303 O VAL B 18 56.916 68.229 48.094 1.00 15.00 B O -ATOM 1304 N GLN B 19 58.277 69.551 46.895 1.00 15.00 B N -ATOM 1305 HN GLN B 19 58.450 70.454 46.553 1.00 15.00 B H -ATOM 1306 CA GLN B 19 59.212 68.472 46.563 1.00 15.00 B C -ATOM 1307 CB GLN B 19 60.306 68.973 45.624 1.00 15.00 B C -ATOM 1308 CG GLN B 19 59.819 69.300 44.222 1.00 15.00 B C -ATOM 1309 CD GLN B 19 60.856 70.060 43.424 1.00 15.00 B C -ATOM 1310 OE1 GLN B 19 61.656 70.800 43.987 1.00 15.00 B O -ATOM 1311 NE2 GLN B 19 60.848 69.884 42.111 1.00 15.00 B N -ATOM 1312 HE21 GLN B 19 60.180 69.277 41.729 1.00 15.00 B H -ATOM 1313 HE22 GLN B 19 61.513 70.367 41.575 1.00 15.00 B H -ATOM 1314 C GLN B 19 59.831 67.828 47.804 1.00 15.00 B C -ATOM 1315 O GLN B 19 60.007 66.612 47.857 1.00 15.00 B O -ATOM 1316 N GLY B 20 60.157 68.648 48.797 1.00 15.00 B N -ATOM 1317 HN GLY B 20 59.990 69.607 48.701 1.00 15.00 B H -ATOM 1318 CA GLY B 20 60.752 68.141 50.021 1.00 15.00 B C -ATOM 1319 C GLY B 20 60.808 69.198 51.104 1.00 15.00 B C -ATOM 1320 O GLY B 20 60.479 70.357 50.857 1.00 15.00 B O -ATOM 1321 N VAL B 21 61.224 68.805 52.306 1.00 15.00 B N -ATOM 1322 HN VAL B 21 61.471 67.867 52.446 1.00 15.00 B H -ATOM 1323 CA VAL B 21 61.313 69.743 53.421 1.00 15.00 B C -ATOM 1324 CB VAL B 21 60.145 69.588 54.423 1.00 15.00 B C -ATOM 1325 CG1 VAL B 21 58.860 70.168 53.849 1.00 15.00 B C -ATOM 1326 CG2 VAL B 21 59.951 68.130 54.817 1.00 15.00 B C -ATOM 1327 C VAL B 21 62.639 69.642 54.171 1.00 15.00 B C -ATOM 1328 O VAL B 21 63.132 68.551 54.458 1.00 15.00 B O -ATOM 1329 N ASP B 22 63.209 70.803 54.471 1.00 15.00 B N -ATOM 1330 HN ASP B 22 62.772 71.631 54.183 1.00 15.00 B H -ATOM 1331 CA ASP B 22 64.462 70.893 55.207 1.00 15.00 B C -ATOM 1332 CB ASP B 22 65.367 71.941 54.546 1.00 15.00 B C -ATOM 1333 CG ASP B 22 66.783 71.981 55.097 1.00 15.00 B C -ATOM 1334 OD1 ASP B 22 67.621 72.693 54.507 1.00 15.00 B O -ATOM 1335 OD2 ASP B 22 67.056 71.309 56.114 1.00 15.00 B O -ATOM 1336 C ASP B 22 64.153 71.293 56.648 1.00 15.00 B C -ATOM 1337 O ASP B 22 63.896 72.461 56.934 1.00 15.00 B O -ATOM 1338 N LEU B 23 64.169 70.314 57.546 1.00 15.00 B N -ATOM 1339 HN LEU B 23 64.397 69.406 57.256 1.00 15.00 B H -ATOM 1340 CA LEU B 23 63.864 70.556 58.957 1.00 15.00 B C -ATOM 1341 CB LEU B 23 63.075 69.374 59.529 1.00 15.00 B C -ATOM 1342 CG LEU B 23 62.059 68.720 58.592 1.00 15.00 B C -ATOM 1343 CD1 LEU B 23 61.515 67.441 59.205 1.00 15.00 B C -ATOM 1344 CD2 LEU B 23 60.930 69.683 58.266 1.00 15.00 B C -ATOM 1345 C LEU B 23 65.131 70.764 59.780 1.00 15.00 B C -ATOM 1346 O LEU B 23 65.110 70.657 61.007 1.00 15.00 B O -ATOM 1347 N GLY B 24 66.228 71.072 59.103 1.00 15.00 B N -ATOM 1348 HN GLY B 24 66.185 71.157 58.127 1.00 15.00 B H -ATOM 1349 CA GLY B 24 67.485 71.274 59.789 1.00 15.00 B C -ATOM 1350 C GLY B 24 68.410 70.098 59.584 1.00 15.00 B C -ATOM 1351 O GLY B 24 69.072 70.001 58.559 1.00 15.00 B O -ATOM 1352 N ASN B 25 68.442 69.189 60.552 1.00 15.00 B N -ATOM 1353 HN ASN B 25 67.884 69.314 61.347 1.00 15.00 B H -ATOM 1354 CA ASN B 25 69.290 68.008 60.454 1.00 15.00 B C -ATOM 1355 CB ASN B 25 69.581 67.435 61.846 1.00 15.00 B C -ATOM 1356 CG ASN B 25 70.429 66.176 61.799 1.00 15.00 B C -ATOM 1357 OD1 ASN B 25 71.584 66.210 61.378 1.00 15.00 B O -ATOM 1358 ND2 ASN B 25 69.859 65.059 62.235 1.00 15.00 B N -ATOM 1359 HD21 ASN B 25 68.935 65.106 62.559 1.00 15.00 B H -ATOM 1360 HD22 ASN B 25 70.384 64.232 62.215 1.00 15.00 B H -ATOM 1361 C ASN B 25 68.644 66.947 59.569 1.00 15.00 B C -ATOM 1362 O ASN B 25 69.329 66.244 58.831 1.00 15.00 B O -ATOM 1363 N MET B 26 67.320 66.853 59.633 1.00 15.00 B N -ATOM 1364 HN MET B 26 66.824 67.462 60.219 1.00 15.00 B H -ATOM 1365 CA MET B 26 66.588 65.871 58.846 1.00 15.00 B C -ATOM 1366 CB MET B 26 65.558 65.143 59.713 1.00 15.00 B C -ATOM 1367 CG MET B 26 64.714 64.128 58.960 1.00 15.00 B C -ATOM 1368 SD MET B 26 63.655 63.155 60.045 1.00 15.00 B S -ATOM 1369 CE MET B 26 64.874 62.204 60.944 1.00 15.00 B C -ATOM 1370 C MET B 26 65.913 66.487 57.624 1.00 15.00 B C -ATOM 1371 O MET B 26 65.309 67.556 57.699 1.00 15.00 B O -ATOM 1372 N ILE B 27 66.034 65.792 56.499 1.00 15.00 B N -ATOM 1373 HN ILE B 27 66.548 64.958 56.516 1.00 15.00 B H -ATOM 1374 CA ILE B 27 65.434 66.212 55.240 1.00 15.00 B C -ATOM 1375 CB ILE B 27 66.518 66.489 54.162 1.00 15.00 B C -ATOM 1376 CG1 ILE B 27 67.031 67.930 54.264 1.00 15.00 B C -ATOM 1377 CG2 ILE B 27 66.012 66.203 52.753 1.00 15.00 B C -ATOM 1378 CD1 ILE B 27 68.109 68.131 55.306 1.00 15.00 B C -ATOM 1379 C ILE B 27 64.474 65.122 54.761 1.00 15.00 B C -ATOM 1380 O ILE B 27 64.842 63.952 54.687 1.00 15.00 B O -ATOM 1381 N ILE B 28 63.239 65.503 54.463 1.00 15.00 B N -ATOM 1382 HN ILE B 28 62.994 66.448 54.542 1.00 15.00 B H -ATOM 1383 CA ILE B 28 62.241 64.541 54.010 1.00 15.00 B C -ATOM 1384 CB ILE B 28 61.061 64.434 54.999 1.00 15.00 B C -ATOM 1385 CG1 ILE B 28 61.582 64.198 56.422 1.00 15.00 B C -ATOM 1386 CG2 ILE B 28 60.123 63.308 54.586 1.00 15.00 B C -ATOM 1387 CD1 ILE B 28 60.508 64.221 57.486 1.00 15.00 B C -ATOM 1388 C ILE B 28 61.722 64.899 52.622 1.00 15.00 B C -ATOM 1389 O ILE B 28 61.245 66.007 52.393 1.00 15.00 B O -ATOM 1390 N THR B 29 61.816 63.948 51.699 1.00 15.00 B N -ATOM 1391 HN THR B 29 62.193 63.078 51.948 1.00 15.00 B H -ATOM 1392 CA THR B 29 61.366 64.160 50.329 1.00 15.00 B C -ATOM 1393 CB THR B 29 62.363 63.567 49.308 1.00 15.00 B C -ATOM 1394 OG1 THR B 29 62.133 62.159 49.162 1.00 15.00 B O -ATOM 1395 HG1 THR B 29 62.309 61.719 49.996 1.00 15.00 B H -ATOM 1396 CG2 THR B 29 63.800 63.793 49.761 1.00 15.00 B C -ATOM 1397 C THR B 29 59.994 63.531 50.101 1.00 15.00 B C -ATOM 1398 O THR B 29 59.583 62.631 50.836 1.00 15.00 B O -ATOM 1399 N SER B 30 59.287 64.016 49.087 1.00 15.00 B N -ATOM 1400 HN SER B 30 59.659 64.748 48.551 1.00 15.00 B H -ATOM 1401 CA SER B 30 57.970 63.488 48.752 1.00 15.00 B C -ATOM 1402 CB SER B 30 57.180 64.518 47.943 1.00 15.00 B C -ATOM 1403 OG SER B 30 56.931 65.678 48.706 1.00 15.00 B O -ATOM 1404 HG SER B 30 56.836 66.434 48.117 1.00 15.00 B H -ATOM 1405 C SER B 30 58.109 62.217 47.931 1.00 15.00 B C -ATOM 1406 O SER B 30 59.203 61.900 47.457 1.00 15.00 B O -ATOM 1407 N GLY B 31 57.006 61.484 47.780 1.00 15.00 B N -ATOM 1408 HN GLY B 31 56.175 61.767 48.219 1.00 15.00 B H -ATOM 1409 CA GLY B 31 57.026 60.272 46.982 1.00 15.00 B C -ATOM 1410 C GLY B 31 57.386 60.593 45.548 1.00 15.00 B C -ATOM 1411 O GLY B 31 56.570 61.137 44.803 1.00 15.00 B O -ATOM 1412 N GLN B 32 58.616 60.270 45.165 1.00 15.00 B N -ATOM 1413 HN GLN B 32 59.212 59.816 45.798 1.00 15.00 B H -ATOM 1414 CA GLN B 32 59.098 60.565 43.825 1.00 15.00 B C -ATOM 1415 CB GLN B 32 60.617 60.755 43.817 1.00 15.00 B C -ATOM 1416 CG GLN B 32 61.115 62.002 44.533 1.00 15.00 B C -ATOM 1417 CD GLN B 32 60.336 63.251 44.168 1.00 15.00 B C -ATOM 1418 OE1 GLN B 32 60.440 63.760 43.052 1.00 15.00 B O -ATOM 1419 NE2 GLN B 32 59.575 63.769 45.124 1.00 15.00 B N -ATOM 1420 HE21 GLN B 32 59.561 63.321 45.997 1.00 15.00 B H -ATOM 1421 HE22 GLN B 32 59.063 64.579 44.922 1.00 15.00 B H -ATOM 1422 C GLN B 32 58.715 59.505 42.809 1.00 15.00 B C -ATOM 1423 O GLN B 32 59.042 58.328 42.962 1.00 15.00 B O -ATOM 1424 N ILE B 33 58.014 59.938 41.771 1.00 15.00 B N -ATOM 1425 HN ILE B 33 57.757 60.883 41.730 1.00 15.00 B H -ATOM 1426 CA ILE B 33 57.617 59.050 40.692 1.00 15.00 B C -ATOM 1427 CB ILE B 33 56.163 59.302 40.231 1.00 15.00 B C -ATOM 1428 CG1 ILE B 33 55.934 60.780 39.904 1.00 15.00 B C -ATOM 1429 CG2 ILE B 33 55.185 58.829 41.299 1.00 15.00 B C -ATOM 1430 CD1 ILE B 33 54.535 61.088 39.412 1.00 15.00 B C -ATOM 1431 C ILE B 33 58.604 59.208 39.533 1.00 15.00 B C -ATOM 1432 O ILE B 33 59.324 60.206 39.474 1.00 15.00 B O -ATOM 1433 N PRO B 34 58.671 58.225 38.615 1.00 15.00 B N -ATOM 1434 CA PRO B 34 59.606 58.249 37.475 1.00 15.00 B C -ATOM 1435 CB PRO B 34 59.496 56.833 36.908 1.00 15.00 B C -ATOM 1436 CG PRO B 34 58.129 56.387 37.289 1.00 15.00 B C -ATOM 1437 CD PRO B 34 57.859 56.996 38.631 1.00 15.00 B C -ATOM 1438 C PRO B 34 59.288 59.277 36.382 1.00 15.00 B C -ATOM 1439 O PRO B 34 59.234 58.937 35.201 1.00 15.00 B O -ATOM 1440 N VAL B 35 59.106 60.534 36.768 1.00 15.00 B N -ATOM 1441 HN VAL B 35 59.158 60.756 37.721 1.00 15.00 B H -ATOM 1442 CA VAL B 35 58.826 61.591 35.802 1.00 15.00 B C -ATOM 1443 CB VAL B 35 57.725 62.552 36.303 1.00 15.00 B C -ATOM 1444 CG1 VAL B 35 57.581 63.752 35.375 1.00 15.00 B C -ATOM 1445 CG2 VAL B 35 56.399 61.820 36.420 1.00 15.00 B C -ATOM 1446 C VAL B 35 60.097 62.380 35.497 1.00 15.00 B C -ATOM 1447 O VAL B 35 60.757 62.883 36.406 1.00 15.00 B O -ATOM 1448 N ASN B 36 60.445 62.461 34.215 1.00 15.00 B N -ATOM 1449 HN ASN B 36 59.892 62.012 33.543 1.00 15.00 B H -ATOM 1450 CA ASN B 36 61.626 63.198 33.785 1.00 15.00 B C -ATOM 1451 CB ASN B 36 61.922 62.896 32.309 1.00 15.00 B C -ATOM 1452 CG ASN B 36 63.304 63.342 31.859 1.00 15.00 B C -ATOM 1453 OD1 ASN B 36 63.723 64.467 32.108 1.00 15.00 B O -ATOM 1454 ND2 ASN B 36 64.025 62.450 31.192 1.00 15.00 B N -ATOM 1455 HD21 ASN B 36 63.634 61.566 31.029 1.00 15.00 B H -ATOM 1456 HD22 ASN B 36 64.920 62.711 30.889 1.00 15.00 B H -ATOM 1457 C ASN B 36 61.398 64.695 33.992 1.00 15.00 B C -ATOM 1458 O ASN B 36 60.440 65.254 33.476 1.00 15.00 B O -ATOM 1459 N PRO B 37 62.264 65.358 34.773 1.00 15.00 B N -ATOM 1460 CA PRO B 37 62.138 66.799 35.048 1.00 15.00 B C -ATOM 1461 CB PRO B 37 63.219 67.047 36.105 1.00 15.00 B C -ATOM 1462 CG PRO B 37 64.212 65.956 35.895 1.00 15.00 B C -ATOM 1463 CD PRO B 37 63.421 64.759 35.463 1.00 15.00 B C -ATOM 1464 C PRO B 37 62.395 67.679 33.820 1.00 15.00 B C -ATOM 1465 O PRO B 37 62.005 68.846 33.794 1.00 15.00 B O -ATOM 1466 N LYS B 38 63.035 67.109 32.802 1.00 15.00 B N -ATOM 1467 HN LYS B 38 63.293 66.166 32.871 1.00 15.00 B H -ATOM 1468 CA LYS B 38 63.364 67.846 31.585 1.00 15.00 B C -ATOM 1469 CB LYS B 38 64.714 67.372 31.037 1.00 15.00 B C -ATOM 1470 CG LYS B 38 65.159 68.062 29.758 1.00 15.00 B C -ATOM 1471 CD LYS B 38 66.418 67.425 29.196 1.00 15.00 B C -ATOM 1472 CE LYS B 38 67.592 67.570 30.153 1.00 15.00 B C -ATOM 1473 NZ LYS B 38 67.923 68.999 30.411 1.00 15.00 B N -ATOM 1474 HZ1 LYS B 38 68.695 69.069 31.106 1.00 15.00 B H -ATOM 1475 HZ2 LYS B 38 67.089 69.496 30.784 1.00 15.00 B H -ATOM 1476 HZ3 LYS B 38 68.221 69.461 29.529 1.00 15.00 B H -ATOM 1477 C LYS B 38 62.287 67.738 30.501 1.00 15.00 B C -ATOM 1478 O LYS B 38 62.014 68.711 29.797 1.00 15.00 B O -ATOM 1479 N THR B 39 61.677 66.564 30.362 1.00 15.00 B N -ATOM 1480 HN THR B 39 61.913 65.824 30.959 1.00 15.00 B H -ATOM 1481 CA THR B 39 60.653 66.365 29.334 1.00 15.00 B C -ATOM 1482 CB THR B 39 60.977 65.166 28.417 1.00 15.00 B C -ATOM 1483 OG1 THR B 39 61.076 63.964 29.194 1.00 15.00 B O -ATOM 1484 HG1 THR B 39 61.262 64.188 30.107 1.00 15.00 B H -ATOM 1485 CG2 THR B 39 62.284 65.394 27.672 1.00 15.00 B C -ATOM 1486 C THR B 39 59.260 66.176 29.927 1.00 15.00 B C -ATOM 1487 O THR B 39 58.258 66.512 29.298 1.00 15.00 B O -ATOM 1488 N GLY B 40 59.206 65.641 31.139 1.00 15.00 B N -ATOM 1489 HN GLY B 40 60.039 65.408 31.599 1.00 15.00 B H -ATOM 1490 CA GLY B 40 57.931 65.401 31.791 1.00 15.00 B C -ATOM 1491 C GLY B 40 57.367 64.040 31.432 1.00 15.00 B C -ATOM 1492 O GLY B 40 56.248 63.701 31.817 1.00 15.00 B O -ATOM 1493 N GLU B 41 58.158 63.259 30.698 1.00 15.00 B N -ATOM 1494 HN GLU B 41 59.045 63.588 30.441 1.00 15.00 B H -ATOM 1495 CA GLU B 41 57.748 61.929 30.260 1.00 15.00 B C -ATOM 1496 CB GLU B 41 58.329 61.622 28.878 1.00 15.00 B C -ATOM 1497 CG GLU B 41 57.953 62.621 27.796 1.00 15.00 B C -ATOM 1498 CD GLU B 41 58.556 62.262 26.452 1.00 15.00 B C -ATOM 1499 OE1 GLU B 41 59.694 61.745 26.431 1.00 15.00 B O -ATOM 1500 OE2 GLU B 41 57.894 62.499 25.420 1.00 15.00 B O -ATOM 1501 C GLU B 41 58.197 60.854 31.239 1.00 15.00 B C -ATOM 1502 O GLU B 41 59.095 61.069 32.053 1.00 15.00 B O -ATOM 1503 N VAL B 42 57.567 59.689 31.141 1.00 15.00 B N -ATOM 1504 HN VAL B 42 56.862 59.585 30.468 1.00 15.00 B H -ATOM 1505 CA VAL B 42 57.891 58.560 32.004 1.00 15.00 B C -ATOM 1506 CB VAL B 42 56.664 58.120 32.838 1.00 15.00 B C -ATOM 1507 CG1 VAL B 42 56.994 56.914 33.704 1.00 15.00 B C -ATOM 1508 CG2 VAL B 42 56.156 59.270 33.695 1.00 15.00 B C -ATOM 1509 C VAL B 42 58.383 57.375 31.174 1.00 15.00 B C -ATOM 1510 O VAL B 42 57.692 56.924 30.259 1.00 15.00 B O -ATOM 1511 N PRO B 43 59.593 56.865 31.475 1.00 15.00 B N -ATOM 1512 CA PRO B 43 60.171 55.715 30.763 1.00 15.00 B C -ATOM 1513 CB PRO B 43 61.538 55.527 31.434 1.00 15.00 B C -ATOM 1514 CG PRO B 43 61.421 56.217 32.750 1.00 15.00 B C -ATOM 1515 CD PRO B 43 60.492 57.371 32.525 1.00 15.00 B C -ATOM 1516 C PRO B 43 59.320 54.460 30.947 1.00 15.00 B C -ATOM 1517 O PRO B 43 58.744 54.245 32.009 1.00 15.00 B O -ATOM 1518 N ALA B 44 59.234 53.640 29.905 1.00 15.00 B N -ATOM 1519 HN ALA B 44 59.710 53.864 29.079 1.00 15.00 B H -ATOM 1520 CA ALA B 44 58.445 52.413 29.962 1.00 15.00 B C -ATOM 1521 CB ALA B 44 58.160 51.891 28.563 1.00 15.00 B C -ATOM 1522 C ALA B 44 59.133 51.343 30.802 1.00 15.00 B C -ATOM 1523 O ALA B 44 58.491 50.681 31.617 1.00 15.00 B O -ATOM 1524 N ASP B 45 60.441 51.183 30.596 1.00 15.00 B N -ATOM 1525 HN ASP B 45 60.888 51.743 29.927 1.00 15.00 B H -ATOM 1526 CA ASP B 45 61.225 50.194 31.330 1.00 15.00 B C -ATOM 1527 CB ASP B 45 62.686 50.236 30.874 1.00 15.00 B C -ATOM 1528 CG ASP B 45 63.512 49.096 31.434 1.00 15.00 B C -ATOM 1529 OD1 ASP B 45 64.377 49.361 32.289 1.00 15.00 B O -ATOM 1530 OD2 ASP B 45 63.290 47.940 31.018 1.00 15.00 B O -ATOM 1531 C ASP B 45 61.128 50.424 32.837 1.00 15.00 B C -ATOM 1532 O ASP B 45 61.224 51.558 33.308 1.00 15.00 B O -ATOM 1533 N VAL B 46 60.935 49.339 33.585 1.00 15.00 B N -ATOM 1534 HN VAL B 46 60.887 48.465 33.148 1.00 15.00 B H -ATOM 1535 CA VAL B 46 60.803 49.414 35.038 1.00 15.00 B C -ATOM 1536 CB VAL B 46 60.219 48.110 35.632 1.00 15.00 B C -ATOM 1537 CG1 VAL B 46 61.173 46.936 35.455 1.00 15.00 B C -ATOM 1538 CG2 VAL B 46 59.837 48.293 37.094 1.00 15.00 B C -ATOM 1539 C VAL B 46 62.125 49.777 35.719 1.00 15.00 B C -ATOM 1540 O VAL B 46 62.134 50.467 36.738 1.00 15.00 B O -ATOM 1541 N ALA B 47 63.240 49.320 35.147 1.00 15.00 B N -ATOM 1542 HN ALA B 47 63.173 48.774 34.335 1.00 15.00 B H -ATOM 1543 CA ALA B 47 64.558 49.619 35.697 1.00 15.00 B C -ATOM 1544 CB ALA B 47 65.625 48.747 35.053 1.00 15.00 B C -ATOM 1545 C ALA B 47 64.881 51.092 35.493 1.00 15.00 B C -ATOM 1546 O ALA B 47 65.512 51.725 36.339 1.00 15.00 B O -ATOM 1547 N ALA B 48 64.433 51.629 34.359 1.00 15.00 B N -ATOM 1548 HN ALA B 48 63.952 51.060 33.721 1.00 15.00 B H -ATOM 1549 CA ALA B 48 64.642 53.033 34.038 1.00 15.00 B C -ATOM 1550 CB ALA B 48 64.364 53.291 32.565 1.00 15.00 B C -ATOM 1551 C ALA B 48 63.748 53.904 34.915 1.00 15.00 B C -ATOM 1552 O ALA B 48 64.104 55.031 35.256 1.00 15.00 B O -ATOM 1553 N GLN B 49 62.581 53.363 35.278 1.00 15.00 B N -ATOM 1554 HN GLN B 49 62.352 52.466 34.955 1.00 15.00 B H -ATOM 1555 CA GLN B 49 61.637 54.068 36.136 1.00 15.00 B C -ATOM 1556 CB GLN B 49 60.278 53.365 36.142 1.00 15.00 B C -ATOM 1557 CG GLN B 49 59.387 53.717 34.965 1.00 15.00 B C -ATOM 1558 CD GLN B 49 57.928 53.385 35.216 1.00 15.00 B C -ATOM 1559 OE1 GLN B 49 57.474 53.371 36.358 1.00 15.00 B O -ATOM 1560 NE2 GLN B 49 57.183 53.129 34.149 1.00 15.00 B N -ATOM 1561 HE21 GLN B 49 57.610 53.167 33.267 1.00 15.00 B H -ATOM 1562 HE22 GLN B 49 56.237 52.917 34.285 1.00 15.00 B H -ATOM 1563 C GLN B 49 62.176 54.155 37.558 1.00 15.00 B C -ATOM 1564 O GLN B 49 62.001 55.166 38.237 1.00 15.00 B O -ATOM 1565 N ALA B 50 62.835 53.085 37.997 1.00 15.00 B N -ATOM 1566 HN ALA B 50 62.932 52.310 37.404 1.00 15.00 B H -ATOM 1567 CA ALA B 50 63.414 53.032 39.332 1.00 15.00 B C -ATOM 1568 CB ALA B 50 63.876 51.618 39.655 1.00 15.00 B C -ATOM 1569 C ALA B 50 64.573 54.013 39.454 1.00 15.00 B C -ATOM 1570 O ALA B 50 64.754 54.644 40.494 1.00 15.00 B O -ATOM 1571 N ARG B 51 65.344 54.147 38.376 1.00 15.00 B N -ATOM 1572 HN ARG B 51 65.140 53.619 37.575 1.00 15.00 B H -ATOM 1573 CA ARG B 51 66.484 55.056 38.355 1.00 15.00 B C -ATOM 1574 CB ARG B 51 67.429 54.727 37.196 1.00 15.00 B C -ATOM 1575 CG ARG B 51 68.657 55.623 37.128 1.00 15.00 B C -ATOM 1576 CD ARG B 51 69.711 55.066 36.181 1.00 15.00 B C -ATOM 1577 NE ARG B 51 70.358 53.869 36.722 1.00 15.00 B N -ATOM 1578 HE ARG B 51 70.020 53.000 36.422 1.00 15.00 B H -ATOM 1579 CZ ARG B 51 71.381 53.899 37.576 1.00 15.00 B C -ATOM 1580 NH1 ARG B 51 71.866 55.059 38.003 1.00 15.00 B N -ATOM 1581 HH11 ARG B 51 72.665 55.075 38.672 1.00 15.00 B H -ATOM 1582 HH12 ARG B 51 71.454 55.953 37.666 1.00 15.00 B H -ATOM 1583 NH2 ARG B 51 71.913 52.766 38.013 1.00 15.00 B N -ATOM 1584 HH21 ARG B 51 72.711 52.789 38.682 1.00 15.00 B H -ATOM 1585 HH22 ARG B 51 71.537 51.854 37.684 1.00 15.00 B H -ATOM 1586 C ARG B 51 66.032 56.513 38.284 1.00 15.00 B C -ATOM 1587 O ARG B 51 66.654 57.385 38.882 1.00 15.00 B O -ATOM 1588 N GLN B 52 64.945 56.768 37.553 1.00 15.00 B N -ATOM 1589 HN GLN B 52 64.496 56.030 37.091 1.00 15.00 B H -ATOM 1590 CA GLN B 52 64.412 58.120 37.424 1.00 15.00 B C -ATOM 1591 CB GLN B 52 63.343 58.184 36.327 1.00 15.00 B C -ATOM 1592 CG GLN B 52 62.786 59.578 36.060 1.00 15.00 B C -ATOM 1593 CD GLN B 52 63.843 60.567 35.600 1.00 15.00 B C -ATOM 1594 OE1 GLN B 52 64.129 60.678 34.409 1.00 15.00 B O -ATOM 1595 NE2 GLN B 52 64.419 61.302 36.546 1.00 15.00 B N -ATOM 1596 HE21 GLN B 52 64.134 61.167 37.474 1.00 15.00 B H -ATOM 1597 HE22 GLN B 52 65.104 61.948 36.276 1.00 15.00 B H -ATOM 1598 C GLN B 52 63.851 58.601 38.760 1.00 15.00 B C -ATOM 1599 O GLN B 52 64.009 59.764 39.125 1.00 15.00 B O -ATOM 1600 N SER B 53 63.197 57.693 39.484 1.00 15.00 B N -ATOM 1601 HN SER B 53 63.082 56.789 39.124 1.00 15.00 B H -ATOM 1602 CA SER B 53 62.641 58.011 40.795 1.00 15.00 B C -ATOM 1603 CB SER B 53 61.793 56.850 41.318 1.00 15.00 B C -ATOM 1604 OG SER B 53 60.492 56.875 40.765 1.00 15.00 B O -ATOM 1605 HG SER B 53 59.903 57.352 41.356 1.00 15.00 B H -ATOM 1606 C SER B 53 63.763 58.308 41.780 1.00 15.00 B C -ATOM 1607 O SER B 53 63.655 59.213 42.605 1.00 15.00 B O -ATOM 1608 N LEU B 54 64.845 57.535 41.676 1.00 15.00 B N -ATOM 1609 HN LEU B 54 64.859 56.830 40.996 1.00 15.00 B H -ATOM 1610 CA LEU B 54 66.007 57.706 42.540 1.00 15.00 B C -ATOM 1611 CB LEU B 54 66.938 56.496 42.432 1.00 15.00 B C -ATOM 1612 CG LEU B 54 66.482 55.230 43.159 1.00 15.00 B C -ATOM 1613 CD1 LEU B 54 67.319 54.035 42.731 1.00 15.00 B C -ATOM 1614 CD2 LEU B 54 66.556 55.424 44.666 1.00 15.00 B C -ATOM 1615 C LEU B 54 66.761 58.986 42.196 1.00 15.00 B C -ATOM 1616 O LEU B 54 67.318 59.641 43.076 1.00 15.00 B O -ATOM 1617 N ASP B 55 66.772 59.336 40.907 1.00 15.00 B N -ATOM 1618 HN ASP B 55 66.321 58.760 40.254 1.00 15.00 B H -ATOM 1619 CA ASP B 55 67.439 60.549 40.442 1.00 15.00 B C -ATOM 1620 CB ASP B 55 67.558 60.562 38.915 1.00 15.00 B C -ATOM 1621 CG ASP B 55 68.804 59.858 38.410 1.00 15.00 B C -ATOM 1622 OD1 ASP B 55 68.764 59.314 37.286 1.00 15.00 B O -ATOM 1623 OD2 ASP B 55 69.820 59.854 39.136 1.00 15.00 B O -ATOM 1624 C ASP B 55 66.689 61.785 40.916 1.00 15.00 B C -ATOM 1625 O ASP B 55 67.292 62.824 41.183 1.00 15.00 B O -ATOM 1626 N ASN B 56 65.365 61.661 41.018 1.00 15.00 B N -ATOM 1627 HN ASN B 56 64.946 60.809 40.772 1.00 15.00 B H -ATOM 1628 CA ASN B 56 64.524 62.758 41.483 1.00 15.00 B C -ATOM 1629 CB ASN B 56 63.052 62.494 41.165 1.00 15.00 B C -ATOM 1630 CG ASN B 56 62.736 62.622 39.687 1.00 15.00 B C -ATOM 1631 OD1 ASN B 56 63.469 63.267 38.936 1.00 15.00 B O -ATOM 1632 ND2 ASN B 56 61.633 62.020 39.265 1.00 15.00 B N -ATOM 1633 HD21 ASN B 56 61.091 61.533 39.920 1.00 15.00 B H -ATOM 1634 HD22 ASN B 56 61.400 62.092 38.315 1.00 15.00 B H -ATOM 1635 C ASN B 56 64.713 62.962 42.980 1.00 15.00 B C -ATOM 1636 O ASN B 56 64.685 64.090 43.471 1.00 15.00 B O -ATOM 1637 N VAL B 57 64.905 61.854 43.697 1.00 15.00 B N -ATOM 1638 HN VAL B 57 64.889 60.985 43.243 1.00 15.00 B H -ATOM 1639 CA VAL B 57 65.138 61.896 45.136 1.00 15.00 B C -ATOM 1640 CB VAL B 57 65.137 60.471 45.744 1.00 15.00 B C -ATOM 1641 CG1 VAL B 57 65.682 60.478 47.165 1.00 15.00 B C -ATOM 1642 CG2 VAL B 57 63.739 59.878 45.721 1.00 15.00 B C -ATOM 1643 C VAL B 57 66.489 62.549 45.397 1.00 15.00 B C -ATOM 1644 O VAL B 57 66.631 63.376 46.295 1.00 15.00 B O -ATOM 1645 N LYS B 58 67.467 62.175 44.573 1.00 15.00 B N -ATOM 1646 HN LYS B 58 67.268 61.516 43.875 1.00 15.00 B H -ATOM 1647 CA LYS B 58 68.819 62.706 44.667 1.00 15.00 B C -ATOM 1648 CB LYS B 58 69.722 61.985 43.659 1.00 15.00 B C -ATOM 1649 CG LYS B 58 71.034 62.690 43.355 1.00 15.00 B C -ATOM 1650 CD LYS B 58 71.821 61.949 42.288 1.00 15.00 B C -ATOM 1651 CE LYS B 58 72.963 62.799 41.755 1.00 15.00 B C -ATOM 1652 NZ LYS B 58 73.866 62.019 40.866 1.00 15.00 B N -ATOM 1653 HZ1 LYS B 58 74.179 62.608 40.068 1.00 15.00 B H -ATOM 1654 HZ2 LYS B 58 73.371 61.183 40.495 1.00 15.00 B H -ATOM 1655 HZ3 LYS B 58 74.703 61.703 41.398 1.00 15.00 B H -ATOM 1656 C LYS B 58 68.837 64.211 44.414 1.00 15.00 B C -ATOM 1657 O LYS B 58 69.546 64.949 45.091 1.00 15.00 B O -ATOM 1658 N ALA B 59 68.039 64.656 43.443 1.00 15.00 B N -ATOM 1659 HN ALA B 59 67.495 64.011 42.944 1.00 15.00 B H -ATOM 1660 CA ALA B 59 67.957 66.073 43.095 1.00 15.00 B C -ATOM 1661 CB ALA B 59 67.074 66.264 41.872 1.00 15.00 B C -ATOM 1662 C ALA B 59 67.449 66.916 44.262 1.00 15.00 B C -ATOM 1663 O ALA B 59 67.929 68.026 44.487 1.00 15.00 B O -ATOM 1664 N ILE B 60 66.477 66.382 44.999 1.00 15.00 B N -ATOM 1665 HN ILE B 60 66.134 65.496 44.762 1.00 15.00 B H -ATOM 1666 CA ILE B 60 65.903 67.081 46.149 1.00 15.00 B C -ATOM 1667 CB ILE B 60 64.556 66.451 46.566 1.00 15.00 B C -ATOM 1668 CG1 ILE B 60 63.551 66.549 45.417 1.00 15.00 B C -ATOM 1669 CG2 ILE B 60 64.001 67.116 47.817 1.00 15.00 B C -ATOM 1670 CD1 ILE B 60 62.311 65.712 45.620 1.00 15.00 B C -ATOM 1671 C ILE B 60 66.866 67.067 47.337 1.00 15.00 B C -ATOM 1672 O ILE B 60 67.013 68.066 48.042 1.00 15.00 B O -ATOM 1673 N VAL B 61 67.524 65.929 47.544 1.00 15.00 B N -ATOM 1674 HN VAL B 61 67.364 65.169 46.944 1.00 15.00 B H -ATOM 1675 CA VAL B 61 68.477 65.775 48.640 1.00 15.00 B C -ATOM 1676 CB VAL B 61 68.918 64.301 48.800 1.00 15.00 B C -ATOM 1677 CG1 VAL B 61 70.044 64.169 49.812 1.00 15.00 B C -ATOM 1678 CG2 VAL B 61 67.738 63.437 49.218 1.00 15.00 B C -ATOM 1679 C VAL B 61 69.701 66.673 48.436 1.00 15.00 B C -ATOM 1680 O VAL B 61 70.190 67.293 49.381 1.00 15.00 B O -ATOM 1681 N GLU B 62 70.175 66.752 47.192 1.00 15.00 B N -ATOM 1682 HN GLU B 62 69.734 66.243 46.481 1.00 15.00 B H -ATOM 1683 CA GLU B 62 71.334 67.577 46.860 1.00 15.00 B C -ATOM 1684 CB GLU B 62 71.921 67.185 45.505 1.00 15.00 B C -ATOM 1685 CG GLU B 62 72.578 65.815 45.487 1.00 15.00 B C -ATOM 1686 CD GLU B 62 73.338 65.550 44.203 1.00 15.00 B C -ATOM 1687 OE1 GLU B 62 74.315 64.773 44.244 1.00 15.00 B O -ATOM 1688 OE2 GLU B 62 72.958 66.117 43.157 1.00 15.00 B O -ATOM 1689 C GLU B 62 70.993 69.062 46.876 1.00 15.00 B C -ATOM 1690 O GLU B 62 71.868 69.904 47.071 1.00 15.00 B O -ATOM 1691 N ALA B 63 69.713 69.376 46.666 1.00 15.00 B N -ATOM 1692 HN ALA B 63 69.065 68.660 46.507 1.00 15.00 B H -ATOM 1693 CA ALA B 63 69.258 70.763 46.677 1.00 15.00 B C -ATOM 1694 CB ALA B 63 67.870 70.877 46.067 1.00 15.00 B C -ATOM 1695 C ALA B 63 69.260 71.303 48.102 1.00 15.00 B C -ATOM 1696 O ALA B 63 69.276 72.513 48.323 1.00 15.00 B O -ATOM 1697 N ALA B 64 69.247 70.382 49.064 1.00 15.00 B N -ATOM 1698 HN ALA B 64 69.223 69.435 48.813 1.00 15.00 B H -ATOM 1699 CA ALA B 64 69.268 70.738 50.474 1.00 15.00 B C -ATOM 1700 CB ALA B 64 68.452 69.737 51.279 1.00 15.00 B C -ATOM 1701 C ALA B 64 70.704 70.791 50.992 1.00 15.00 B C -ATOM 1702 O ALA B 64 70.940 71.102 52.157 1.00 15.00 B O -ATOM 1703 N GLY B 65 71.659 70.485 50.115 1.00 15.00 B N -ATOM 1704 HN GLY B 65 71.409 70.248 49.197 1.00 15.00 B H -ATOM 1705 CA GLY B 65 73.060 70.510 50.499 1.00 15.00 B C -ATOM 1706 C GLY B 65 73.568 69.170 51.002 1.00 15.00 B C -ATOM 1707 O GLY B 65 74.621 69.101 51.635 1.00 15.00 B O -ATOM 1708 N LEU B 66 72.821 68.104 50.725 1.00 15.00 B N -ATOM 1709 HN LEU B 66 71.989 68.221 50.218 1.00 15.00 B H -ATOM 1710 CA LEU B 66 73.209 66.763 51.157 1.00 15.00 B C -ATOM 1711 CB LEU B 66 72.108 66.123 52.008 1.00 15.00 B C -ATOM 1712 CG LEU B 66 71.867 66.741 53.388 1.00 15.00 B C -ATOM 1713 CD1 LEU B 66 70.795 65.964 54.134 1.00 15.00 B C -ATOM 1714 CD2 LEU B 66 73.157 66.779 54.192 1.00 15.00 B C -ATOM 1715 C LEU B 66 73.539 65.867 49.966 1.00 15.00 B C -ATOM 1716 O LEU B 66 73.367 66.261 48.813 1.00 15.00 B O -ATOM 1717 N LYS B 67 74.019 64.661 50.255 1.00 15.00 B N -ATOM 1718 HN LYS B 67 74.138 64.408 51.196 1.00 15.00 B H -ATOM 1719 CA LYS B 67 74.376 63.702 49.213 1.00 15.00 B C -ATOM 1720 CB LYS B 67 75.838 63.267 49.373 1.00 15.00 B C -ATOM 1721 CG LYS B 67 76.841 64.405 49.464 1.00 15.00 B C -ATOM 1722 CD LYS B 67 78.244 63.869 49.706 1.00 15.00 B C -ATOM 1723 CE LYS B 67 79.274 64.986 49.742 1.00 15.00 B C -ATOM 1724 NZ LYS B 67 80.657 64.455 49.899 1.00 15.00 B N -ATOM 1725 HZ1 LYS B 67 80.873 63.787 49.132 1.00 15.00 B H -ATOM 1726 HZ2 LYS B 67 80.750 63.961 50.809 1.00 15.00 B H -ATOM 1727 HZ3 LYS B 67 81.344 65.235 49.869 1.00 15.00 B H -ATOM 1728 C LYS B 67 73.486 62.464 49.290 1.00 15.00 B C -ATOM 1729 O LYS B 67 72.663 62.335 50.196 1.00 15.00 B O -ATOM 1730 N VAL B 68 73.663 61.553 48.334 1.00 15.00 B N -ATOM 1731 HN VAL B 68 74.323 61.724 47.630 1.00 15.00 B H -ATOM 1732 CA VAL B 68 72.900 60.306 48.303 1.00 15.00 B C -ATOM 1733 CB VAL B 68 73.098 59.566 46.959 1.00 15.00 B C -ATOM 1734 CG1 VAL B 68 72.483 58.173 46.986 1.00 15.00 B C -ATOM 1735 CG2 VAL B 68 72.502 60.378 45.822 1.00 15.00 B C -ATOM 1736 C VAL B 68 73.321 59.410 49.470 1.00 15.00 B C -ATOM 1737 O VAL B 68 72.541 58.589 49.961 1.00 15.00 B O -ATOM 1738 N GLY B 69 74.560 59.601 49.928 1.00 15.00 B N -ATOM 1739 HN GLY B 69 75.126 60.276 49.500 1.00 15.00 B H -ATOM 1740 CA GLY B 69 75.081 58.829 51.041 1.00 15.00 B C -ATOM 1741 C GLY B 69 74.505 59.263 52.372 1.00 15.00 B C -ATOM 1742 O GLY B 69 74.688 58.587 53.385 1.00 15.00 B O -ATOM 1743 N ASP B 70 73.805 60.393 52.368 1.00 15.00 B N -ATOM 1744 HN ASP B 70 73.698 60.884 51.526 1.00 15.00 B H -ATOM 1745 CA ASP B 70 73.195 60.918 53.579 1.00 15.00 B C -ATOM 1746 CB ASP B 70 73.184 62.448 53.564 1.00 15.00 B C -ATOM 1747 CG ASP B 70 74.582 63.028 53.658 1.00 15.00 B C -ATOM 1748 OD1 ASP B 70 74.876 63.995 52.927 1.00 15.00 B O -ATOM 1749 OD2 ASP B 70 75.387 62.509 54.461 1.00 15.00 B O -ATOM 1750 C ASP B 70 71.792 60.356 53.790 1.00 15.00 B C -ATOM 1751 O ASP B 70 71.198 60.536 54.853 1.00 15.00 B O -ATOM 1752 N ILE B 71 71.264 59.676 52.768 1.00 15.00 B N -ATOM 1753 HN ILE B 71 71.780 59.587 51.939 1.00 15.00 B H -ATOM 1754 CA ILE B 71 69.940 59.062 52.854 1.00 15.00 B C -ATOM 1755 CB ILE B 71 69.444 58.588 51.471 1.00 15.00 B C -ATOM 1756 CG1 ILE B 71 69.409 59.764 50.486 1.00 15.00 B C -ATOM 1757 CG2 ILE B 71 68.066 57.953 51.585 1.00 15.00 B C -ATOM 1758 CD1 ILE B 71 69.080 59.369 49.063 1.00 15.00 B C -ATOM 1759 C ILE B 71 69.992 57.879 53.824 1.00 15.00 B C -ATOM 1760 O ILE B 71 70.793 56.961 53.648 1.00 15.00 B O -ATOM 1761 N VAL B 72 69.140 57.912 54.848 1.00 15.00 B N -ATOM 1762 HN VAL B 72 68.512 58.659 54.921 1.00 15.00 B H -ATOM 1763 CA VAL B 72 69.126 56.865 55.870 1.00 15.00 B C -ATOM 1764 CB VAL B 72 69.348 57.453 57.278 1.00 15.00 B C -ATOM 1765 CG1 VAL B 72 70.756 58.011 57.407 1.00 15.00 B C -ATOM 1766 CG2 VAL B 72 68.314 58.529 57.579 1.00 15.00 B C -ATOM 1767 C VAL B 72 67.857 56.004 55.888 1.00 15.00 B C -ATOM 1768 O VAL B 72 67.846 54.952 56.522 1.00 15.00 B O -ATOM 1769 N LYS B 73 66.793 56.437 55.215 1.00 15.00 B N -ATOM 1770 HN LYS B 73 66.846 57.280 54.719 1.00 15.00 B H -ATOM 1771 CA LYS B 73 65.545 55.664 55.201 1.00 15.00 B C -ATOM 1772 CB LYS B 73 64.718 55.936 56.468 1.00 15.00 B C -ATOM 1773 CG LYS B 73 63.336 55.282 56.488 1.00 15.00 B C -ATOM 1774 CD LYS B 73 63.429 53.763 56.423 1.00 15.00 B C -ATOM 1775 CE LYS B 73 62.082 53.102 56.697 1.00 15.00 B C -ATOM 1776 NZ LYS B 73 61.052 53.465 55.683 1.00 15.00 B N -ATOM 1777 HZ1 LYS B 73 60.157 52.974 55.895 1.00 15.00 B H -ATOM 1778 HZ2 LYS B 73 61.368 53.188 54.733 1.00 15.00 B H -ATOM 1779 HZ3 LYS B 73 60.882 54.491 55.695 1.00 15.00 B H -ATOM 1780 C LYS B 73 64.712 55.941 53.954 1.00 15.00 B C -ATOM 1781 O LYS B 73 64.476 57.089 53.599 1.00 15.00 B O -ATOM 1782 N THR B 74 64.269 54.872 53.293 1.00 15.00 B N -ATOM 1783 HN THR B 74 64.498 53.978 53.623 1.00 15.00 B H -ATOM 1784 CA THR B 74 63.459 54.995 52.086 1.00 15.00 B C -ATOM 1785 CB THR B 74 64.288 54.706 50.815 1.00 15.00 B C -ATOM 1786 OG1 THR B 74 64.694 53.335 50.811 1.00 15.00 B O -ATOM 1787 HG1 THR B 74 65.279 53.175 50.065 1.00 15.00 B H -ATOM 1788 CG2 THR B 74 65.524 55.592 50.748 1.00 15.00 B C -ATOM 1789 C THR B 74 62.277 54.026 52.107 1.00 15.00 B C -ATOM 1790 O THR B 74 62.335 52.971 52.739 1.00 15.00 B O -ATOM 1791 N THR B 75 61.202 54.400 51.421 1.00 15.00 B N -ATOM 1792 HN THR B 75 61.205 55.270 50.973 1.00 15.00 B H -ATOM 1793 CA THR B 75 60.013 53.557 51.317 1.00 15.00 B C -ATOM 1794 CB THR B 75 58.810 54.162 52.062 1.00 15.00 B C -ATOM 1795 OG1 THR B 75 59.182 54.420 53.420 1.00 15.00 B O -ATOM 1796 HG1 THR B 75 59.993 53.949 53.622 1.00 15.00 B H -ATOM 1797 CG2 THR B 75 57.631 53.201 52.054 1.00 15.00 B C -ATOM 1798 C THR B 75 59.673 53.353 49.842 1.00 15.00 B C -ATOM 1799 O THR B 75 59.220 54.276 49.162 1.00 15.00 B O -ATOM 1800 N VAL B 76 59.899 52.136 49.356 1.00 15.00 B N -ATOM 1801 HN VAL B 76 60.219 51.431 49.960 1.00 15.00 B H -ATOM 1802 CA VAL B 76 59.674 51.816 47.951 1.00 15.00 B C -ATOM 1803 CB VAL B 76 60.789 50.899 47.400 1.00 15.00 B C -ATOM 1804 CG1 VAL B 76 60.638 50.705 45.901 1.00 15.00 B C -ATOM 1805 CG2 VAL B 76 62.163 51.464 47.731 1.00 15.00 B C -ATOM 1806 C VAL B 76 58.313 51.181 47.675 1.00 15.00 B C -ATOM 1807 O VAL B 76 58.065 50.024 48.019 1.00 15.00 B O -ATOM 1808 N PHE B 77 57.436 51.957 47.043 1.00 15.00 B N -ATOM 1809 HN PHE B 77 57.687 52.880 46.832 1.00 15.00 B H -ATOM 1810 CA PHE B 77 56.112 51.483 46.664 1.00 15.00 B C -ATOM 1811 CB PHE B 77 55.088 52.616 46.775 1.00 15.00 B C -ATOM 1812 CG PHE B 77 55.004 53.267 48.124 1.00 15.00 B C -ATOM 1813 CD1 PHE B 77 55.577 54.509 48.343 1.00 15.00 B C -ATOM 1814 CD2 PHE B 77 54.335 52.648 49.167 1.00 15.00 B C -ATOM 1815 CE1 PHE B 77 55.486 55.123 49.577 1.00 15.00 B C -ATOM 1816 CE2 PHE B 77 54.241 53.255 50.405 1.00 15.00 B C -ATOM 1817 CZ PHE B 77 54.817 54.495 50.610 1.00 15.00 B C -ATOM 1818 C PHE B 77 56.157 51.012 45.215 1.00 15.00 B C -ATOM 1819 O PHE B 77 56.441 51.798 44.314 1.00 15.00 B O -ATOM 1820 N VAL B 78 55.891 49.734 44.987 1.00 15.00 B N -ATOM 1821 HN VAL B 78 55.669 49.144 45.738 1.00 15.00 B H -ATOM 1822 CA VAL B 78 55.919 49.193 43.631 1.00 15.00 B C -ATOM 1823 CB VAL B 78 56.968 48.071 43.470 1.00 15.00 B C -ATOM 1824 CG1 VAL B 78 58.374 48.621 43.660 1.00 15.00 B C -ATOM 1825 CG2 VAL B 78 56.699 46.927 44.439 1.00 15.00 B C -ATOM 1826 C VAL B 78 54.550 48.682 43.197 1.00 15.00 B C -ATOM 1827 O VAL B 78 53.706 48.356 44.027 1.00 15.00 B O -ATOM 1828 N LYS B 79 54.336 48.627 41.887 1.00 15.00 B N -ATOM 1829 HN LYS B 79 55.045 48.916 41.276 1.00 15.00 B H -ATOM 1830 CA LYS B 79 53.074 48.149 41.333 1.00 15.00 B C -ATOM 1831 CB LYS B 79 52.788 48.843 39.994 1.00 15.00 B C -ATOM 1832 CG LYS B 79 51.607 48.277 39.215 1.00 15.00 B C -ATOM 1833 CD LYS B 79 50.294 48.480 39.954 1.00 15.00 B C -ATOM 1834 CE LYS B 79 49.211 47.565 39.405 1.00 15.00 B C -ATOM 1835 NZ LYS B 79 49.493 46.132 39.696 1.00 15.00 B N -ATOM 1836 HZ1 LYS B 79 50.392 45.849 39.256 1.00 15.00 B H -ATOM 1837 HZ2 LYS B 79 48.732 45.533 39.320 1.00 15.00 B H -ATOM 1838 HZ3 LYS B 79 49.561 45.981 40.724 1.00 15.00 B H -ATOM 1839 C LYS B 79 53.112 46.631 41.163 1.00 15.00 B C -ATOM 1840 O LYS B 79 52.081 45.958 41.215 1.00 15.00 B O -ATOM 1841 N ASP B 80 54.315 46.098 40.971 1.00 15.00 B N -ATOM 1842 HN ASP B 80 55.098 46.687 40.947 1.00 15.00 B H -ATOM 1843 CA ASP B 80 54.503 44.664 40.802 1.00 15.00 B C -ATOM 1844 CB ASP B 80 54.502 44.294 39.313 1.00 15.00 B C -ATOM 1845 CG ASP B 80 54.205 42.825 39.061 1.00 15.00 B C -ATOM 1846 OD1 ASP B 80 54.032 42.451 37.882 1.00 15.00 B O -ATOM 1847 OD2 ASP B 80 54.141 42.048 40.038 1.00 15.00 B O -ATOM 1848 C ASP B 80 55.807 44.220 41.455 1.00 15.00 B C -ATOM 1849 O ASP B 80 56.888 44.673 41.076 1.00 15.00 B O -ATOM 1850 N LEU B 81 55.695 43.336 42.448 1.00 15.00 B N -ATOM 1851 HN LEU B 81 54.803 43.025 42.709 1.00 15.00 B H -ATOM 1852 CA LEU B 81 56.863 42.822 43.156 1.00 15.00 B C -ATOM 1853 CB LEU B 81 56.472 42.247 44.518 1.00 15.00 B C -ATOM 1854 CG LEU B 81 56.530 43.211 45.702 1.00 15.00 B C -ATOM 1855 CD1 LEU B 81 55.964 42.551 46.946 1.00 15.00 B C -ATOM 1856 CD2 LEU B 81 57.958 43.672 45.953 1.00 15.00 B C -ATOM 1857 C LEU B 81 57.608 41.776 42.335 1.00 15.00 B C -ATOM 1858 O LEU B 81 58.692 41.336 42.713 1.00 15.00 B O -ATOM 1859 N ASN B 82 57.014 41.373 41.211 1.00 15.00 B N -ATOM 1860 HN ASN B 82 56.139 41.746 40.973 1.00 15.00 B H -ATOM 1861 CA ASN B 82 57.639 40.396 40.327 1.00 15.00 B C -ATOM 1862 CB ASN B 82 56.613 39.811 39.350 1.00 15.00 B C -ATOM 1863 CG ASN B 82 55.788 38.693 39.957 1.00 15.00 B C -ATOM 1864 OD1 ASN B 82 56.259 37.954 40.824 1.00 15.00 B O -ATOM 1865 ND2 ASN B 82 54.548 38.559 39.501 1.00 15.00 B N -ATOM 1866 HD21 ASN B 82 54.240 39.182 38.811 1.00 15.00 B H -ATOM 1867 HD22 ASN B 82 53.992 37.841 39.872 1.00 15.00 B H -ATOM 1868 C ASN B 82 58.794 41.038 39.563 1.00 15.00 B C -ATOM 1869 O ASN B 82 59.650 40.349 39.011 1.00 15.00 B O -ATOM 1870 N ASP B 83 58.803 42.371 39.552 1.00 15.00 B N -ATOM 1871 HN ASP B 83 58.084 42.851 40.013 1.00 15.00 B H -ATOM 1872 CA ASP B 83 59.843 43.141 38.881 1.00 15.00 B C -ATOM 1873 CB ASP B 83 59.219 44.325 38.128 1.00 15.00 B C -ATOM 1874 CG ASP B 83 58.595 43.952 36.799 1.00 15.00 B C -ATOM 1875 OD1 ASP B 83 57.599 44.601 36.412 1.00 15.00 B O -ATOM 1876 OD2 ASP B 83 59.105 43.023 36.141 1.00 15.00 B O -ATOM 1877 C ASP B 83 60.831 43.701 39.899 1.00 15.00 B C -ATOM 1878 O ASP B 83 61.650 44.556 39.567 1.00 15.00 B O -ATOM 1879 N PHE B 84 60.766 43.208 41.137 1.00 15.00 B N -ATOM 1880 HN PHE B 84 60.126 42.493 41.337 1.00 15.00 B H -ATOM 1881 CA PHE B 84 61.637 43.709 42.194 1.00 15.00 B C -ATOM 1882 CB PHE B 84 61.104 43.400 43.591 1.00 15.00 B C -ATOM 1883 CG PHE B 84 61.402 44.493 44.578 1.00 15.00 B C -ATOM 1884 CD1 PHE B 84 62.320 44.300 45.596 1.00 15.00 B C -ATOM 1885 CD2 PHE B 84 60.772 45.722 44.475 1.00 15.00 B C -ATOM 1886 CE1 PHE B 84 62.601 45.312 46.495 1.00 15.00 B C -ATOM 1887 CE2 PHE B 84 61.047 46.737 45.371 1.00 15.00 B C -ATOM 1888 CZ PHE B 84 61.964 46.532 46.382 1.00 15.00 B C -ATOM 1889 C PHE B 84 63.097 43.295 42.047 1.00 15.00 B C -ATOM 1890 O PHE B 84 63.979 43.968 42.569 1.00 15.00 B O -ATOM 1891 N ALA B 85 63.356 42.189 41.353 1.00 15.00 B N -ATOM 1892 HN ALA B 85 62.615 41.663 40.986 1.00 15.00 B H -ATOM 1893 CA ALA B 85 64.731 41.744 41.139 1.00 15.00 B C -ATOM 1894 CB ALA B 85 64.755 40.384 40.459 1.00 15.00 B C -ATOM 1895 C ALA B 85 65.473 42.779 40.296 1.00 15.00 B C -ATOM 1896 O ALA B 85 66.654 43.052 40.515 1.00 15.00 B O -ATOM 1897 N THR B 86 64.748 43.361 39.343 1.00 15.00 B N -ATOM 1898 HN THR B 86 63.814 43.088 39.228 1.00 15.00 B H -ATOM 1899 CA THR B 86 65.291 44.385 38.463 1.00 15.00 B C -ATOM 1900 CB THR B 86 64.381 44.577 37.232 1.00 15.00 B C -ATOM 1901 OG1 THR B 86 64.184 43.315 36.585 1.00 15.00 B O -ATOM 1902 HG1 THR B 86 64.887 42.714 36.842 1.00 15.00 B H -ATOM 1903 CG2 THR B 86 65.003 45.550 36.243 1.00 15.00 B C -ATOM 1904 C THR B 86 65.417 45.713 39.211 1.00 15.00 B C -ATOM 1905 O THR B 86 66.400 46.438 39.049 1.00 15.00 B O -ATOM 1906 N VAL B 87 64.411 46.019 40.034 1.00 15.00 B N -ATOM 1907 HN VAL B 87 63.654 45.402 40.109 1.00 15.00 B H -ATOM 1908 CA VAL B 87 64.403 47.248 40.824 1.00 15.00 B C -ATOM 1909 CB VAL B 87 63.049 47.446 41.546 1.00 15.00 B C -ATOM 1910 CG1 VAL B 87 63.108 48.618 42.517 1.00 15.00 B C -ATOM 1911 CG2 VAL B 87 61.933 47.656 40.534 1.00 15.00 B C -ATOM 1912 C VAL B 87 65.535 47.236 41.850 1.00 15.00 B C -ATOM 1913 O VAL B 87 66.190 48.251 42.073 1.00 15.00 B O -ATOM 1914 N ASN B 88 65.763 46.072 42.462 1.00 15.00 B N -ATOM 1915 HN ASN B 88 65.202 45.301 42.236 1.00 15.00 B H -ATOM 1916 CA ASN B 88 66.818 45.909 43.459 1.00 15.00 B C -ATOM 1917 CB ASN B 88 66.746 44.521 44.104 1.00 15.00 B C -ATOM 1918 CG ASN B 88 66.155 44.551 45.498 1.00 15.00 B C -ATOM 1919 OD1 ASN B 88 66.214 45.567 46.185 1.00 15.00 B O -ATOM 1920 ND2 ASN B 88 65.590 43.428 45.926 1.00 15.00 B N -ATOM 1921 HD21 ASN B 88 65.586 42.654 45.326 1.00 15.00 B H -ATOM 1922 HD22 ASN B 88 65.201 43.420 46.826 1.00 15.00 B H -ATOM 1923 C ASN B 88 68.197 46.116 42.847 1.00 15.00 B C -ATOM 1924 O ASN B 88 69.075 46.707 43.472 1.00 15.00 B O -ATOM 1925 N ALA B 89 68.380 45.621 41.623 1.00 15.00 B N -ATOM 1926 HN ALA B 89 67.639 45.151 41.184 1.00 15.00 B H -ATOM 1927 CA ALA B 89 69.652 45.754 40.918 1.00 15.00 B C -ATOM 1928 CB ALA B 89 69.648 44.923 39.645 1.00 15.00 B C -ATOM 1929 C ALA B 89 69.958 47.217 40.607 1.00 15.00 B C -ATOM 1930 O ALA B 89 71.093 47.666 40.760 1.00 15.00 B O -ATOM 1931 N THR B 90 68.937 47.954 40.172 1.00 15.00 B N -ATOM 1932 HN THR B 90 68.059 47.531 40.062 1.00 15.00 B H -ATOM 1933 CA THR B 90 69.087 49.371 39.854 1.00 15.00 B C -ATOM 1934 CB THR B 90 67.856 49.903 39.087 1.00 15.00 B C -ATOM 1935 OG1 THR B 90 67.750 49.234 37.825 1.00 15.00 B O -ATOM 1936 HG1 THR B 90 67.944 48.300 37.940 1.00 15.00 B H -ATOM 1937 CG2 THR B 90 67.962 51.404 38.849 1.00 15.00 B C -ATOM 1938 C THR B 90 69.282 50.188 41.132 1.00 15.00 B C -ATOM 1939 O THR B 90 70.084 51.122 41.171 1.00 15.00 B O -ATOM 1940 N TYR B 91 68.545 49.810 42.174 1.00 15.00 B N -ATOM 1941 HN TYR B 91 67.931 49.053 42.065 1.00 15.00 B H -ATOM 1942 CA TYR B 91 68.611 50.477 43.470 1.00 15.00 B C -ATOM 1943 CB TYR B 91 67.562 49.862 44.404 1.00 15.00 B C -ATOM 1944 CG TYR B 91 67.393 50.562 45.733 1.00 15.00 B C -ATOM 1945 CD1 TYR B 91 66.341 51.442 45.945 1.00 15.00 B C -ATOM 1946 CD2 TYR B 91 68.280 50.338 46.777 1.00 15.00 B C -ATOM 1947 CE1 TYR B 91 66.170 52.069 47.164 1.00 15.00 B C -ATOM 1948 CE2 TYR B 91 68.118 50.959 47.997 1.00 15.00 B C -ATOM 1949 CZ TYR B 91 67.068 51.828 48.183 1.00 15.00 B C -ATOM 1950 OH TYR B 91 66.905 52.446 49.398 1.00 15.00 B O -ATOM 1951 HH TYR B 91 67.764 52.688 49.750 1.00 15.00 B H -ATOM 1952 C TYR B 91 70.002 50.329 44.083 1.00 15.00 B C -ATOM 1953 O TYR B 91 70.575 51.295 44.587 1.00 15.00 B O -ATOM 1954 N GLU B 92 70.534 49.109 44.031 1.00 15.00 B N -ATOM 1955 HN GLU B 92 70.022 48.385 43.613 1.00 15.00 B H -ATOM 1956 CA GLU B 92 71.854 48.817 44.576 1.00 15.00 B C -ATOM 1957 CB GLU B 92 72.112 47.308 44.565 1.00 15.00 B C -ATOM 1958 CG GLU B 92 73.489 46.905 45.066 1.00 15.00 B C -ATOM 1959 CD GLU B 92 73.544 45.463 45.529 1.00 15.00 B C -ATOM 1960 OE1 GLU B 92 74.430 45.140 46.347 1.00 15.00 B O -ATOM 1961 OE2 GLU B 92 72.699 44.659 45.081 1.00 15.00 B O -ATOM 1962 C GLU B 92 72.941 49.541 43.797 1.00 15.00 B C -ATOM 1963 O GLU B 92 73.859 50.111 44.386 1.00 15.00 B O -ATOM 1964 N ALA B 93 72.823 49.521 42.471 1.00 15.00 B N -ATOM 1965 HN ALA B 93 72.062 49.051 42.067 1.00 15.00 B H -ATOM 1966 CA ALA B 93 73.791 50.177 41.604 1.00 15.00 B C -ATOM 1967 CB ALA B 93 73.481 49.890 40.143 1.00 15.00 B C -ATOM 1968 C ALA B 93 73.822 51.678 41.858 1.00 15.00 B C -ATOM 1969 O ALA B 93 74.890 52.276 41.913 1.00 15.00 B O -ATOM 1970 N PHE B 94 72.642 52.270 42.032 1.00 15.00 B N -ATOM 1971 HN PHE B 94 71.828 51.724 41.991 1.00 15.00 B H -ATOM 1972 CA PHE B 94 72.515 53.703 42.281 1.00 15.00 B C -ATOM 1973 CB PHE B 94 71.038 54.086 42.431 1.00 15.00 B C -ATOM 1974 CG PHE B 94 70.791 55.562 42.573 1.00 15.00 B C -ATOM 1975 CD1 PHE B 94 70.761 56.384 41.458 1.00 15.00 B C -ATOM 1976 CD2 PHE B 94 70.590 56.128 43.823 1.00 15.00 B C -ATOM 1977 CE1 PHE B 94 70.532 57.741 41.585 1.00 15.00 B C -ATOM 1978 CE2 PHE B 94 70.361 57.484 43.956 1.00 15.00 B C -ATOM 1979 CZ PHE B 94 70.333 58.293 42.836 1.00 15.00 B C -ATOM 1980 C PHE B 94 73.302 54.139 43.517 1.00 15.00 B C -ATOM 1981 O PHE B 94 74.064 55.100 43.464 1.00 15.00 B O -ATOM 1982 N PHE B 95 73.123 53.421 44.625 1.00 15.00 B N -ATOM 1983 HN PHE B 95 72.512 52.654 44.606 1.00 15.00 B H -ATOM 1984 CA PHE B 95 73.816 53.752 45.869 1.00 15.00 B C -ATOM 1985 CB PHE B 95 73.134 53.109 47.079 1.00 15.00 B C -ATOM 1986 CG PHE B 95 71.876 53.820 47.495 1.00 15.00 B C -ATOM 1987 CD1 PHE B 95 70.649 53.447 46.977 1.00 15.00 B C -ATOM 1988 CD2 PHE B 95 71.926 54.873 48.393 1.00 15.00 B C -ATOM 1989 CE1 PHE B 95 69.493 54.106 47.349 1.00 15.00 B C -ATOM 1990 CE2 PHE B 95 70.774 55.536 48.771 1.00 15.00 B C -ATOM 1991 CZ PHE B 95 69.556 55.154 48.245 1.00 15.00 B C -ATOM 1992 C PHE B 95 75.309 53.417 45.821 1.00 15.00 B C -ATOM 1993 O PHE B 95 76.115 54.073 46.479 1.00 15.00 B O -ATOM 1994 N THR B 96 75.674 52.401 45.038 1.00 15.00 B N -ATOM 1995 HN THR B 96 74.987 51.902 44.548 1.00 15.00 B H -ATOM 1996 CA THR B 96 77.077 52.012 44.896 1.00 15.00 B C -ATOM 1997 CB THR B 96 77.218 50.631 44.213 1.00 15.00 B C -ATOM 1998 OG1 THR B 96 76.601 49.627 45.027 1.00 15.00 B O -ATOM 1999 HG1 THR B 96 75.902 50.025 45.550 1.00 15.00 B H -ATOM 2000 CG2 THR B 96 78.683 50.266 44.004 1.00 15.00 B C -ATOM 2001 C THR B 96 77.831 53.068 44.083 1.00 15.00 B C -ATOM 2002 O THR B 96 79.007 53.339 44.329 1.00 15.00 B O -ATOM 2003 N GLU B 97 77.122 53.671 43.127 1.00 15.00 B N -ATOM 2004 HN GLU B 97 76.187 53.407 42.997 1.00 15.00 B H -ATOM 2005 CA GLU B 97 77.687 54.709 42.266 1.00 15.00 B C -ATOM 2006 CB GLU B 97 76.681 55.086 41.174 1.00 15.00 B C -ATOM 2007 CG GLU B 97 76.529 54.060 40.063 1.00 15.00 B C -ATOM 2008 CD GLU B 97 75.169 54.125 39.393 1.00 15.00 B C -ATOM 2009 OE1 GLU B 97 74.475 55.153 39.549 1.00 15.00 B O -ATOM 2010 OE2 GLU B 97 74.795 53.146 38.716 1.00 15.00 B O -ATOM 2011 C GLU B 97 78.040 55.961 43.061 1.00 15.00 B C -ATOM 2012 O GLU B 97 78.922 56.726 42.673 1.00 15.00 B O -ATOM 2013 N HIS B 98 77.345 56.166 44.173 1.00 15.00 B N -ATOM 2014 HN HIS B 98 76.665 55.512 44.441 1.00 15.00 B H -ATOM 2015 CA HIS B 98 77.574 57.335 45.009 1.00 15.00 B C -ATOM 2016 CB HIS B 98 76.238 57.965 45.416 1.00 15.00 B C -ATOM 2017 CG HIS B 98 75.472 58.540 44.265 1.00 15.00 B C -ATOM 2018 ND1 HIS B 98 74.546 57.834 43.528 1.00 15.00 B N -ATOM 2019 HD1 HIS B 98 74.287 56.899 43.668 1.00 15.00 B H -ATOM 2020 CD2 HIS B 98 75.512 59.780 43.721 1.00 15.00 B C -ATOM 2021 CE1 HIS B 98 74.066 58.649 42.582 1.00 15.00 B C -ATOM 2022 NE2 HIS B 98 74.620 59.842 42.656 1.00 15.00 B N -ATOM 2023 C HIS B 98 78.399 57.006 46.248 1.00 15.00 B C -ATOM 2024 O HIS B 98 78.540 57.849 47.136 1.00 15.00 B O -ATOM 2025 N ASN B 99 78.953 55.782 46.293 1.00 15.00 B N -ATOM 2026 HN ASN B 99 78.814 55.170 45.540 1.00 15.00 B H -ATOM 2027 CA ASN B 99 79.763 55.332 47.433 1.00 15.00 B C -ATOM 2028 CB ASN B 99 81.108 56.071 47.443 1.00 15.00 B C -ATOM 2029 CG ASN B 99 82.107 55.492 48.427 1.00 15.00 B C -ATOM 2030 OD1 ASN B 99 82.155 54.282 48.648 1.00 15.00 B O -ATOM 2031 ND2 ASN B 99 82.909 56.364 49.030 1.00 15.00 B N -ATOM 2032 HD21 ASN B 99 82.810 57.313 48.807 1.00 15.00 B H -ATOM 2033 HD22 ASN B 99 83.563 56.023 49.674 1.00 15.00 B H -ATOM 2034 C ASN B 99 78.997 55.574 48.735 1.00 15.00 B C -ATOM 2035 O ASN B 99 79.538 56.085 49.717 1.00 15.00 B O -ATOM 2036 N ALA B 100 77.727 55.194 48.723 1.00 15.00 B N -ATOM 2037 HN ALA B 100 77.369 54.754 47.925 1.00 15.00 B H -ATOM 2038 CA ALA B 100 76.853 55.410 49.859 1.00 15.00 B C -ATOM 2039 CB ALA B 100 75.623 56.167 49.393 1.00 15.00 B C -ATOM 2040 C ALA B 100 76.418 54.118 50.527 1.00 15.00 B C -ATOM 2041 O ALA B 100 76.186 53.104 49.866 1.00 15.00 B O -ATOM 2042 N THR B 101 76.309 54.172 51.851 1.00 15.00 B N -ATOM 2043 HN THR B 101 76.542 55.002 52.314 1.00 15.00 B H -ATOM 2044 CA THR B 101 75.859 53.034 52.631 1.00 15.00 B C -ATOM 2045 CB THR B 101 76.125 53.256 54.136 1.00 15.00 B C -ATOM 2046 OG1 THR B 101 77.528 53.433 54.356 1.00 15.00 B O -ATOM 2047 HG1 THR B 101 77.663 53.991 55.126 1.00 15.00 B H -ATOM 2048 CG2 THR B 101 75.635 52.074 54.960 1.00 15.00 B C -ATOM 2049 C THR B 101 74.361 52.874 52.418 1.00 15.00 B C -ATOM 2050 O THR B 101 73.618 53.857 52.454 1.00 15.00 B O -ATOM 2051 N PHE B 102 73.927 51.645 52.169 1.00 15.00 B N -ATOM 2052 HN PHE B 102 74.571 50.909 52.129 1.00 15.00 B H -ATOM 2053 CA PHE B 102 72.515 51.367 51.951 1.00 15.00 B C -ATOM 2054 CB PHE B 102 72.299 49.872 51.728 1.00 15.00 B C -ATOM 2055 CG PHE B 102 73.095 49.319 50.582 1.00 15.00 B C -ATOM 2056 CD1 PHE B 102 73.868 48.182 50.742 1.00 15.00 B C -ATOM 2057 CD2 PHE B 102 73.075 49.942 49.344 1.00 15.00 B C -ATOM 2058 CE1 PHE B 102 74.605 47.674 49.689 1.00 15.00 B C -ATOM 2059 CE2 PHE B 102 73.808 49.440 48.287 1.00 15.00 B C -ATOM 2060 CZ PHE B 102 74.575 48.304 48.459 1.00 15.00 B C -ATOM 2061 C PHE B 102 71.679 51.859 53.126 1.00 15.00 B C -ATOM 2062 O PHE B 102 72.003 51.597 54.281 1.00 15.00 B O -ATOM 2063 N PRO B 103 70.608 52.608 52.846 1.00 15.00 B N -ATOM 2064 CA PRO B 103 69.728 53.147 53.872 1.00 15.00 B C -ATOM 2065 CB PRO B 103 69.046 54.334 53.166 1.00 15.00 B C -ATOM 2066 CG PRO B 103 69.516 54.318 51.744 1.00 15.00 B C -ATOM 2067 CD PRO B 103 70.164 52.987 51.504 1.00 15.00 B C -ATOM 2068 C PRO B 103 68.670 52.133 54.280 1.00 15.00 B C -ATOM 2069 O PRO B 103 68.461 51.137 53.585 1.00 15.00 B O -ATOM 2070 N ALA B 104 68.040 52.361 55.433 1.00 15.00 B N -ATOM 2071 HN ALA B 104 68.319 53.119 55.991 1.00 15.00 B H -ATOM 2072 CA ALA B 104 66.963 51.489 55.890 1.00 15.00 B C -ATOM 2073 CB ALA B 104 66.495 51.907 57.274 1.00 15.00 B C -ATOM 2074 C ALA B 104 65.819 51.597 54.886 1.00 15.00 B C -ATOM 2075 O ALA B 104 65.609 52.661 54.307 1.00 15.00 B O -ATOM 2076 N ARG B 105 65.089 50.517 54.646 1.00 15.00 B N -ATOM 2077 HN ARG B 105 65.274 49.675 55.119 1.00 15.00 B H -ATOM 2078 CA ARG B 105 64.028 50.589 53.659 1.00 15.00 B C -ATOM 2079 CB ARG B 105 64.638 50.455 52.251 1.00 15.00 B C -ATOM 2080 CG ARG B 105 63.955 49.450 51.351 1.00 15.00 B C -ATOM 2081 CD ARG B 105 64.896 48.315 50.990 1.00 15.00 B C -ATOM 2082 NE ARG B 105 65.710 48.580 49.799 1.00 15.00 B N -ATOM 2083 HE ARG B 105 66.241 49.407 49.786 1.00 15.00 B H -ATOM 2084 CZ ARG B 105 65.765 47.738 48.752 1.00 15.00 B C -ATOM 2085 NH1 ARG B 105 65.049 46.625 48.769 1.00 15.00 B N -ATOM 2086 HH11 ARG B 105 64.451 46.407 49.583 1.00 15.00 B H -ATOM 2087 HH12 ARG B 105 65.073 45.977 47.963 1.00 15.00 B H -ATOM 2088 NH2 ARG B 105 66.591 47.959 47.739 1.00 15.00 B N -ATOM 2089 HH21 ARG B 105 66.620 47.296 46.929 1.00 15.00 B H -ATOM 2090 HH22 ARG B 105 67.225 48.783 47.754 1.00 15.00 B H -ATOM 2091 C ARG B 105 62.847 49.622 53.880 1.00 15.00 B C -ATOM 2092 O ARG B 105 62.992 48.519 54.424 1.00 15.00 B O -ATOM 2093 N SER B 106 61.665 50.094 53.476 1.00 15.00 B N -ATOM 2094 HN SER B 106 61.621 51.005 53.124 1.00 15.00 B H -ATOM 2095 CA SER B 106 60.438 49.318 53.536 1.00 15.00 B C -ATOM 2096 CB SER B 106 59.365 50.039 54.355 1.00 15.00 B C -ATOM 2097 OG SER B 106 59.732 50.120 55.716 1.00 15.00 B O -ATOM 2098 HG SER B 106 60.684 50.092 55.784 1.00 15.00 B H -ATOM 2099 C SER B 106 59.971 49.112 52.101 1.00 15.00 B C -ATOM 2100 O SER B 106 60.042 50.037 51.289 1.00 15.00 B O -ATOM 2101 N CSP B 107 59.535 47.902 51.778 1.00 15.00 B N -ATOM 2102 HN CSP B 107 59.501 47.208 52.461 1.00 15.00 B H -ATOM 2103 CA CSP B 107 59.119 47.584 50.414 1.00 15.00 B C -ATOM 2104 CB CSP B 107 60.175 46.661 49.759 0.67 15.00 B C -ATOM 2105 SG CSP B 107 61.858 46.827 50.434 0.67 15.00 B S -ATOM 2106 P CSP B 107 62.011 44.991 51.448 0.67 15.00 B P -ATOM 2107 O1P CSP B 107 60.551 45.210 51.591 0.67 15.00 B O -ATOM 2108 O2P CSP B 107 62.020 43.588 50.965 0.67 15.00 B O -ATOM 2109 O3P CSP B 107 63.235 45.252 50.429 0.67 15.00 B O -ATOM 2110 C CSP B 107 57.743 46.913 50.379 1.00 15.00 B C -ATOM 2111 O CSP B 107 57.547 45.856 50.977 1.00 15.00 B O -ATOM 2112 N VAL B 108 56.792 47.528 49.674 1.00 15.00 B N -ATOM 2113 HN VAL B 108 57.004 48.367 49.223 1.00 15.00 B H -ATOM 2114 CA VAL B 108 55.435 46.968 49.560 1.00 15.00 B C -ATOM 2115 CB VAL B 108 54.439 47.580 50.582 1.00 15.00 B C -ATOM 2116 CG1 VAL B 108 54.872 47.332 52.012 1.00 15.00 B C -ATOM 2117 CG2 VAL B 108 54.219 49.065 50.321 1.00 15.00 B C -ATOM 2118 C VAL B 108 54.858 47.163 48.155 1.00 15.00 B C -ATOM 2119 O VAL B 108 55.219 48.108 47.455 1.00 15.00 B O -ATOM 2120 N GLU B 109 53.962 46.259 47.748 1.00 15.00 B N -ATOM 2121 HN GLU B 109 53.732 45.512 48.342 1.00 15.00 B H -ATOM 2122 CA GLU B 109 53.313 46.355 46.441 1.00 15.00 B C -ATOM 2123 CB GLU B 109 53.198 44.976 45.779 1.00 15.00 B C -ATOM 2124 CG GLU B 109 52.662 45.005 44.353 1.00 15.00 B C -ATOM 2125 CD GLU B 109 52.239 43.635 43.857 1.00 15.00 B C -ATOM 2126 OE1 GLU B 109 51.049 43.467 43.516 1.00 15.00 B O -ATOM 2127 OE2 GLU B 109 53.096 42.729 43.811 1.00 15.00 B O -ATOM 2128 C GLU B 109 51.928 46.962 46.624 1.00 15.00 B C -ATOM 2129 O GLU B 109 51.105 46.423 47.355 1.00 15.00 B O -ATOM 2130 N VAL B 110 51.680 48.090 45.974 1.00 15.00 B N -ATOM 2131 HN VAL B 110 52.375 48.475 45.400 1.00 15.00 B H -ATOM 2132 CA VAL B 110 50.395 48.769 46.093 1.00 15.00 B C -ATOM 2133 CB VAL B 110 50.572 50.297 46.194 1.00 15.00 B C -ATOM 2134 CG1 VAL B 110 51.328 50.653 47.467 1.00 15.00 B C -ATOM 2135 CG2 VAL B 110 51.302 50.827 44.969 1.00 15.00 B C -ATOM 2136 C VAL B 110 49.464 48.435 44.935 1.00 15.00 B C -ATOM 2137 O VAL B 110 49.862 47.776 43.969 1.00 15.00 B O -ATOM 2138 N ALA B 111 48.219 48.882 45.050 1.00 15.00 B N -ATOM 2139 HN ALA B 111 47.964 49.389 45.847 1.00 15.00 B H -ATOM 2140 CA ALA B 111 47.228 48.644 44.022 1.00 15.00 B C -ATOM 2141 CB ALA B 111 45.831 49.006 44.518 1.00 15.00 B C -ATOM 2142 C ALA B 111 47.566 49.450 42.788 1.00 15.00 B C -ATOM 2143 O ALA B 111 47.606 48.926 41.672 1.00 15.00 B O -ATOM 2144 N ARG B 112 47.789 50.736 42.989 1.00 15.00 B N -ATOM 2145 HN ARG B 112 47.704 51.112 43.892 1.00 15.00 B H -ATOM 2146 CA ARG B 112 48.118 51.604 41.892 1.00 15.00 B C -ATOM 2147 CB ARG B 112 46.832 52.014 41.182 1.00 15.00 B C -ATOM 2148 CG ARG B 112 47.063 52.379 39.738 1.00 15.00 B C -ATOM 2149 CD ARG B 112 46.384 53.678 39.401 1.00 15.00 B C -ATOM 2150 NE ARG B 112 44.960 53.505 39.191 1.00 15.00 B N -ATOM 2151 HE ARG B 112 44.495 52.788 39.701 1.00 15.00 B H -ATOM 2152 CZ ARG B 112 44.269 54.270 38.355 1.00 15.00 B C -ATOM 2153 NH1 ARG B 112 44.889 55.248 37.679 1.00 15.00 B N -ATOM 2154 HH11 ARG B 112 45.909 55.395 37.811 1.00 15.00 B H -ATOM 2155 HH12 ARG B 112 44.364 55.855 37.020 1.00 15.00 B H -ATOM 2156 NH2 ARG B 112 42.982 54.062 38.205 1.00 15.00 B N -ATOM 2157 HH21 ARG B 112 42.522 53.296 38.743 1.00 15.00 B H -ATOM 2158 HH22 ARG B 112 42.426 54.653 37.556 1.00 15.00 B H -ATOM 2159 C ARG B 112 48.891 52.838 42.372 1.00 15.00 B C -ATOM 2160 O ARG B 112 48.798 53.225 43.541 1.00 15.00 B O -ATOM 2161 N LEU B 113 49.644 53.463 41.461 1.00 15.00 B N -ATOM 2162 HN LEU B 113 49.674 53.118 40.547 1.00 15.00 B H -ATOM 2163 CA LEU B 113 50.428 54.651 41.784 1.00 15.00 B C -ATOM 2164 CB LEU B 113 51.919 54.337 41.627 1.00 15.00 B C -ATOM 2165 CG LEU B 113 52.511 53.379 42.663 1.00 15.00 B C -ATOM 2166 CD1 LEU B 113 53.843 52.817 42.196 1.00 15.00 B C -ATOM 2167 CD2 LEU B 113 52.664 54.074 44.002 1.00 15.00 B C -ATOM 2168 C LEU B 113 50.030 55.812 40.870 1.00 15.00 B C -ATOM 2169 O LEU B 113 49.444 55.588 39.811 1.00 15.00 B O -ATOM 2170 N PRO B 114 50.323 57.067 41.278 1.00 15.00 B N -ATOM 2171 CA PRO B 114 49.995 58.259 40.483 1.00 15.00 B C -ATOM 2172 CB PRO B 114 50.690 59.392 41.241 1.00 15.00 B C -ATOM 2173 CG PRO B 114 50.765 58.903 42.644 1.00 15.00 B C -ATOM 2174 CD PRO B 114 50.981 57.422 42.550 1.00 15.00 B C -ATOM 2175 C PRO B 114 50.538 58.167 39.060 1.00 15.00 B C -ATOM 2176 O PRO B 114 51.719 57.872 38.855 1.00 15.00 B O -ATOM 2177 N LYS B 115 49.651 58.406 38.088 1.00 15.00 B N -ATOM 2178 HN LYS B 115 48.730 58.628 38.340 1.00 15.00 B H -ATOM 2179 CA LYS B 115 49.996 58.353 36.664 1.00 15.00 B C -ATOM 2180 CB LYS B 115 51.188 59.257 36.328 1.00 15.00 B C -ATOM 2181 CG LYS B 115 50.937 60.738 36.563 1.00 15.00 B C -ATOM 2182 CD LYS B 115 52.153 61.564 36.184 1.00 15.00 B C -ATOM 2183 CE LYS B 115 51.831 63.048 36.175 1.00 15.00 B C -ATOM 2184 NZ LYS B 115 52.209 63.684 34.883 1.00 15.00 B N -ATOM 2185 HZ1 LYS B 115 52.002 64.703 34.911 1.00 15.00 B H -ATOM 2186 HZ2 LYS B 115 51.673 63.254 34.103 1.00 15.00 B H -ATOM 2187 HZ3 LYS B 115 53.225 63.551 34.703 1.00 15.00 B H -ATOM 2188 C LYS B 115 50.241 56.923 36.176 1.00 15.00 B C -ATOM 2189 O LYS B 115 50.822 56.719 35.110 1.00 15.00 B O -ATOM 2190 N ASP B 116 49.788 55.941 36.967 1.00 15.00 B N -ATOM 2191 HN ASP B 116 49.337 56.180 37.803 1.00 15.00 B H -ATOM 2192 CA ASP B 116 49.944 54.521 36.635 1.00 15.00 B C -ATOM 2193 CB ASP B 116 49.205 54.159 35.341 1.00 15.00 B C -ATOM 2194 CG ASP B 116 47.718 53.958 35.551 1.00 15.00 B C -ATOM 2195 OD1 ASP B 116 46.954 54.926 35.354 1.00 15.00 B O -ATOM 2196 OD2 ASP B 116 47.316 52.832 35.911 1.00 15.00 B O -ATOM 2197 C ASP B 116 51.407 54.092 36.557 1.00 15.00 B C -ATOM 2198 O ASP B 116 51.751 53.167 35.819 1.00 15.00 B O -ATOM 2199 N VAL B 117 52.266 54.754 37.331 1.00 15.00 B N -ATOM 2200 HN VAL B 117 51.937 55.475 37.906 1.00 15.00 B H -ATOM 2201 CA VAL B 117 53.688 54.423 37.337 1.00 15.00 B C -ATOM 2202 CB VAL B 117 54.560 55.533 37.961 1.00 15.00 B C -ATOM 2203 CG1 VAL B 117 54.438 56.821 37.159 1.00 15.00 B C -ATOM 2204 CG2 VAL B 117 54.193 55.769 39.418 1.00 15.00 B C -ATOM 2205 C VAL B 117 53.945 53.091 38.035 1.00 15.00 B C -ATOM 2206 O VAL B 117 53.078 52.565 38.734 1.00 15.00 B O -ATOM 2207 N LYS B 118 55.140 52.552 37.841 1.00 15.00 B N -ATOM 2208 HN LYS B 118 55.795 53.025 37.286 1.00 15.00 B H -ATOM 2209 CA LYS B 118 55.502 51.269 38.430 1.00 15.00 B C -ATOM 2210 CB LYS B 118 56.297 50.428 37.427 1.00 15.00 B C -ATOM 2211 CG LYS B 118 55.586 50.182 36.107 1.00 15.00 B C -ATOM 2212 CD LYS B 118 56.520 49.532 35.100 1.00 15.00 B C -ATOM 2213 CE LYS B 118 55.835 49.308 33.762 1.00 15.00 B C -ATOM 2214 NZ LYS B 118 56.764 48.710 32.765 1.00 15.00 B N -ATOM 2215 HZ1 LYS B 118 57.145 47.812 33.125 1.00 15.00 B H -ATOM 2216 HZ2 LYS B 118 57.556 49.359 32.580 1.00 15.00 B H -ATOM 2217 HZ3 LYS B 118 56.263 48.529 31.872 1.00 15.00 B H -ATOM 2218 C LYS B 118 56.292 51.407 39.731 1.00 15.00 B C -ATOM 2219 O LYS B 118 56.583 50.401 40.380 1.00 15.00 B O -ATOM 2220 N ILE B 119 56.640 52.636 40.123 1.00 15.00 B N -ATOM 2221 HN ILE B 119 56.380 53.413 39.585 1.00 15.00 B H -ATOM 2222 CA ILE B 119 57.407 52.826 41.354 1.00 15.00 B C -ATOM 2223 CB ILE B 119 58.881 52.382 41.177 1.00 15.00 B C -ATOM 2224 CG1 ILE B 119 59.600 52.301 42.527 1.00 15.00 B C -ATOM 2225 CG2 ILE B 119 59.622 53.306 40.218 1.00 15.00 B C -ATOM 2226 CD1 ILE B 119 60.977 51.684 42.452 1.00 15.00 B C -ATOM 2227 C ILE B 119 57.353 54.256 41.908 1.00 15.00 B C -ATOM 2228 O ILE B 119 57.290 55.234 41.164 1.00 15.00 B O -ATOM 2229 N GLU B 120 57.358 54.345 43.238 1.00 15.00 B N -ATOM 2230 HN GLU B 120 57.355 53.517 43.761 1.00 15.00 B H -ATOM 2231 CA GLU B 120 57.358 55.618 43.953 1.00 15.00 B C -ATOM 2232 CB GLU B 120 55.952 55.984 44.427 1.00 15.00 B C -ATOM 2233 CG GLU B 120 55.861 57.367 45.050 1.00 15.00 B C -ATOM 2234 CD GLU B 120 54.468 57.697 45.541 1.00 15.00 B C -ATOM 2235 OE1 GLU B 120 54.349 58.302 46.627 1.00 15.00 B O -ATOM 2236 OE2 GLU B 120 53.499 57.348 44.841 1.00 15.00 B O -ATOM 2237 C GLU B 120 58.296 55.494 45.148 1.00 15.00 B C -ATOM 2238 O GLU B 120 58.157 54.574 45.953 1.00 15.00 B O -ATOM 2239 N ILE B 121 59.254 56.408 45.268 1.00 15.00 B N -ATOM 2240 HN ILE B 121 59.309 57.141 44.619 1.00 15.00 B H -ATOM 2241 CA ILE B 121 60.221 56.332 46.357 1.00 15.00 B C -ATOM 2242 CB ILE B 121 61.627 55.949 45.832 1.00 15.00 B C -ATOM 2243 CG1 ILE B 121 61.560 54.688 44.963 1.00 15.00 B C -ATOM 2244 CG2 ILE B 121 62.599 55.748 46.987 1.00 15.00 B C -ATOM 2245 CD1 ILE B 121 62.828 54.409 44.187 1.00 15.00 B C -ATOM 2246 C ILE B 121 60.337 57.617 47.176 1.00 15.00 B C -ATOM 2247 O ILE B 121 60.662 58.680 46.647 1.00 15.00 B O -ATOM 2248 N GLU B 122 60.061 57.500 48.474 1.00 15.00 B N -ATOM 2249 HN GLU B 122 59.751 56.636 48.815 1.00 15.00 B H -ATOM 2250 CA GLU B 122 60.201 58.618 49.404 1.00 15.00 B C -ATOM 2251 CB GLU B 122 58.992 58.720 50.344 1.00 15.00 B C -ATOM 2252 CG GLU B 122 58.751 57.486 51.201 1.00 15.00 B C -ATOM 2253 CD GLU B 122 57.813 57.747 52.367 1.00 15.00 B C -ATOM 2254 OE1 GLU B 122 57.865 56.983 53.352 1.00 15.00 B O -ATOM 2255 OE2 GLU B 122 57.030 58.715 52.301 1.00 15.00 B O -ATOM 2256 C GLU B 122 61.484 58.387 50.201 1.00 15.00 B C -ATOM 2257 O GLU B 122 61.879 57.238 50.402 1.00 15.00 B O -ATOM 2258 N ALA B 123 62.143 59.449 50.654 1.00 15.00 B N -ATOM 2259 HN ALA B 123 61.786 60.348 50.502 1.00 15.00 B H -ATOM 2260 CA ALA B 123 63.395 59.271 51.384 1.00 15.00 B C -ATOM 2261 CB ALA B 123 64.574 59.275 50.424 1.00 15.00 B C -ATOM 2262 C ALA B 123 63.618 60.283 52.502 1.00 15.00 B C -ATOM 2263 O ALA B 123 63.102 61.400 52.477 1.00 15.00 B O -ATOM 2264 N ILE B 124 64.412 59.854 53.481 1.00 15.00 B N -ATOM 2265 HN ILE B 124 64.766 58.942 53.427 1.00 15.00 B H -ATOM 2266 CA ILE B 124 64.774 60.669 54.632 1.00 15.00 B C -ATOM 2267 CB ILE B 124 64.211 60.057 55.939 1.00 15.00 B C -ATOM 2268 CG1 ILE B 124 62.677 60.055 55.916 1.00 15.00 B C -ATOM 2269 CG2 ILE B 124 64.732 60.800 57.162 1.00 15.00 B C -ATOM 2270 CD1 ILE B 124 62.041 59.380 57.111 1.00 15.00 B C -ATOM 2271 C ILE B 124 66.299 60.743 54.726 1.00 15.00 B C -ATOM 2272 O ILE B 124 66.972 59.715 54.740 1.00 15.00 B O -ATOM 2273 N ALA B 125 66.838 61.957 54.777 1.00 15.00 B N -ATOM 2274 HN ALA B 125 66.250 62.742 54.765 1.00 15.00 B H -ATOM 2275 CA ALA B 125 68.284 62.151 54.855 1.00 15.00 B C -ATOM 2276 CB ALA B 125 68.796 62.795 53.575 1.00 15.00 B C -ATOM 2277 C ALA B 125 68.660 62.999 56.065 1.00 15.00 B C -ATOM 2278 O ALA B 125 67.851 63.777 56.558 1.00 15.00 B O -ATOM 2279 N VAL B 126 69.891 62.844 56.544 1.00 15.00 B N -ATOM 2280 HN VAL B 126 70.497 62.207 56.112 1.00 15.00 B H -ATOM 2281 CA VAL B 126 70.360 63.604 57.700 1.00 15.00 B C -ATOM 2282 CB VAL B 126 70.408 62.749 58.988 1.00 15.00 B C -ATOM 2283 CG1 VAL B 126 69.006 62.443 59.488 1.00 15.00 B C -ATOM 2284 CG2 VAL B 126 71.191 61.464 58.756 1.00 15.00 B C -ATOM 2285 C VAL B 126 71.733 64.219 57.451 1.00 15.00 B C -ATOM 2286 O VAL B 126 72.539 63.679 56.694 1.00 15.00 B O -ATOM 2287 N ARG B 127 71.989 65.358 58.089 1.00 15.00 B N -ATOM 2288 HN ARG B 127 71.300 65.746 58.668 1.00 15.00 B H -ATOM 2289 CA ARG B 127 73.267 66.046 57.947 1.00 15.00 B C -ATOM 2290 CB ARG B 127 73.118 67.537 58.261 1.00 15.00 B C -ATOM 2291 CG ARG B 127 72.010 68.222 57.473 1.00 15.00 B C -ATOM 2292 CD ARG B 127 72.140 69.734 57.526 1.00 15.00 B C -ATOM 2293 NE ARG B 127 71.070 70.407 56.786 1.00 15.00 B N -ATOM 2294 HE ARG B 127 70.254 70.637 57.281 1.00 15.00 B H -ATOM 2295 CZ ARG B 127 71.136 70.710 55.493 1.00 15.00 B C -ATOM 2296 NH1 ARG B 127 72.218 70.403 54.791 1.00 15.00 B N -ATOM 2297 HH11 ARG B 127 73.018 69.919 55.251 1.00 15.00 B H -ATOM 2298 HH12 ARG B 127 72.266 70.642 53.781 1.00 15.00 B H -ATOM 2299 NH2 ARG B 127 70.126 71.333 54.905 1.00 15.00 B N -ATOM 2300 HH21 ARG B 127 69.276 71.584 55.452 1.00 15.00 B H -ATOM 2301 HH22 ARG B 127 70.181 71.570 53.893 1.00 15.00 B H -ATOM 2302 C ARG B 127 74.328 65.398 58.835 1.00 15.00 B C -ATOM 2303 O ARG B 127 75.487 65.269 58.442 1.00 15.00 B O -ATOM 2304 N ARG B 128 73.922 64.993 60.037 1.00 15.00 B N -ATOM 2305 HN ARG B 128 72.990 65.148 60.303 1.00 15.00 B H -ATOM 2306 CA ARG B 128 74.827 64.329 60.971 1.00 15.00 B C -ATOM 2307 CB ARG B 128 74.733 64.942 62.371 1.00 15.00 B C -ATOM 2308 CG ARG B 128 75.730 66.059 62.636 1.00 15.00 B C -ATOM 2309 CD ARG B 128 76.084 66.140 64.114 1.00 15.00 B C -ATOM 2310 NE ARG B 128 77.327 65.430 64.428 1.00 15.00 B N -ATOM 2311 HE ARG B 128 77.983 65.328 63.708 1.00 15.00 B H -ATOM 2312 CZ ARG B 128 77.608 64.916 65.626 1.00 15.00 B C -ATOM 2313 NH1 ARG B 128 76.735 65.018 66.620 1.00 15.00 B N -ATOM 2314 HH11 ARG B 128 75.827 65.501 66.466 1.00 15.00 B H -ATOM 2315 HH12 ARG B 128 76.957 64.615 67.552 1.00 15.00 B H -ATOM 2316 NH2 ARG B 128 78.776 64.322 65.840 1.00 15.00 B N -ATOM 2317 HH21 ARG B 128 78.994 63.920 66.776 1.00 15.00 B H -ATOM 2318 HH22 ARG B 128 79.476 64.259 65.073 1.00 15.00 B H -ATOM 2319 C ARG B 128 74.525 62.837 61.040 1.00 15.00 B C -ATOM 2320 O ARG B 128 73.375 62.435 61.225 1.00 15.00 B O -ATOM 2321 N SER C 2 75.185 59.762 61.984 1.00 15.00 C N -ATOM 2322 HN SER C 2 75.885 59.873 61.307 1.00 15.00 C H -ATOM 2323 CA SER C 2 74.354 58.564 61.957 1.00 15.00 C C -ATOM 2324 CB SER C 2 73.286 58.677 60.865 1.00 15.00 C C -ATOM 2325 OG SER C 2 73.873 58.733 59.576 1.00 15.00 C O -ATOM 2326 HG SER C 2 73.884 59.642 59.268 1.00 15.00 C H -ATOM 2327 C SER C 2 75.203 57.314 61.738 1.00 15.00 C C -ATOM 2328 O SER C 2 76.324 57.396 61.238 1.00 15.00 C O -ATOM 2329 N LYS C 3 74.664 56.158 62.121 1.00 15.00 C N -ATOM 2330 HN LYS C 3 73.769 56.158 62.520 1.00 15.00 C H -ATOM 2331 CA LYS C 3 75.374 54.892 61.963 1.00 15.00 C C -ATOM 2332 CB LYS C 3 76.161 54.545 63.234 1.00 15.00 C C -ATOM 2333 CG LYS C 3 75.299 54.123 64.414 1.00 15.00 C C -ATOM 2334 CD LYS C 3 76.114 53.999 65.693 1.00 15.00 C C -ATOM 2335 CE LYS C 3 76.492 55.365 66.244 1.00 15.00 C C -ATOM 2336 NZ LYS C 3 76.989 55.282 67.646 1.00 15.00 C N -ATOM 2337 HZ1 LYS C 3 77.814 54.651 67.698 1.00 15.00 C H -ATOM 2338 HZ2 LYS C 3 76.243 54.910 68.268 1.00 15.00 C H -ATOM 2339 HZ3 LYS C 3 77.266 56.226 67.984 1.00 15.00 C H -ATOM 2340 C LYS C 3 74.419 53.756 61.592 1.00 15.00 C C -ATOM 2341 O LYS C 3 73.207 53.868 61.767 1.00 15.00 C O -ATOM 2342 N THR C 4 74.978 52.668 61.075 1.00 15.00 C N -ATOM 2343 HN THR C 4 75.950 52.646 60.951 1.00 15.00 C H -ATOM 2344 CA THR C 4 74.189 51.504 60.676 1.00 15.00 C C -ATOM 2345 CB THR C 4 74.897 50.728 59.539 1.00 15.00 C C -ATOM 2346 OG1 THR C 4 74.866 51.498 58.332 1.00 15.00 C O -ATOM 2347 HG1 THR C 4 75.114 50.941 57.590 1.00 15.00 C H -ATOM 2348 CG2 THR C 4 74.243 49.375 59.289 1.00 15.00 C C -ATOM 2349 C THR C 4 73.953 50.558 61.857 1.00 15.00 C C -ATOM 2350 O THR C 4 74.860 50.301 62.650 1.00 15.00 C O -ATOM 2351 N ILE C 5 72.726 50.054 61.971 1.00 15.00 C N -ATOM 2352 HN ILE C 5 72.039 50.321 61.326 1.00 15.00 C H -ATOM 2353 CA ILE C 5 72.377 49.114 63.031 1.00 15.00 C C -ATOM 2354 CB ILE C 5 70.962 49.373 63.597 1.00 15.00 C C -ATOM 2355 CG1 ILE C 5 70.855 50.798 64.149 1.00 15.00 C C -ATOM 2356 CG2 ILE C 5 70.630 48.356 64.681 1.00 15.00 C C -ATOM 2357 CD1 ILE C 5 69.486 51.145 64.693 1.00 15.00 C C -ATOM 2358 C ILE C 5 72.456 47.685 62.497 1.00 15.00 C C -ATOM 2359 O ILE C 5 71.644 47.277 61.665 1.00 15.00 C O -ATOM 2360 N ALA C 6 73.447 46.935 62.970 1.00 15.00 C N -ATOM 2361 HN ALA C 6 74.062 47.316 63.631 1.00 15.00 C H -ATOM 2362 CA ALA C 6 73.637 45.557 62.532 1.00 15.00 C C -ATOM 2363 CB ALA C 6 74.943 45.422 61.763 1.00 15.00 C C -ATOM 2364 C ALA C 6 73.602 44.582 63.704 1.00 15.00 C C -ATOM 2365 O ALA C 6 74.448 44.636 64.598 1.00 15.00 C O -ATOM 2366 N THR C 7 72.616 43.690 63.689 1.00 15.00 C N -ATOM 2367 HN THR C 7 71.971 43.706 62.951 1.00 15.00 C H -ATOM 2368 CA THR C 7 72.464 42.692 64.738 1.00 15.00 C C -ATOM 2369 CB THR C 7 71.385 43.089 65.771 1.00 15.00 C C -ATOM 2370 OG1 THR C 7 71.247 42.057 66.755 1.00 15.00 C O -ATOM 2371 HG1 THR C 7 71.893 41.365 66.586 1.00 15.00 C H -ATOM 2372 CG2 THR C 7 70.040 43.335 65.100 1.00 15.00 C C -ATOM 2373 C THR C 7 72.154 41.310 64.158 1.00 15.00 C C -ATOM 2374 O THR C 7 71.469 41.183 63.142 1.00 15.00 C O -ATOM 2375 N GLU C 8 72.674 40.281 64.819 1.00 15.00 C N -ATOM 2376 HN GLU C 8 73.215 40.458 65.618 1.00 15.00 C H -ATOM 2377 CA GLU C 8 72.472 38.897 64.400 1.00 15.00 C C -ATOM 2378 CB GLU C 8 73.602 38.015 64.955 1.00 15.00 C C -ATOM 2379 CG GLU C 8 73.479 37.683 66.442 1.00 15.00 C C -ATOM 2380 CD GLU C 8 74.089 38.728 67.365 1.00 15.00 C C -ATOM 2381 OE1 GLU C 8 74.370 39.854 66.903 1.00 15.00 C O -ATOM 2382 OE2 GLU C 8 74.282 38.417 68.558 1.00 15.00 C O -ATOM 2383 C GLU C 8 71.125 38.368 64.889 1.00 15.00 C C -ATOM 2384 O GLU C 8 70.694 37.279 64.508 1.00 15.00 C O -ATOM 2385 N ASN C 9 70.465 39.160 65.729 1.00 15.00 C N -ATOM 2386 HN ASN C 9 70.858 40.023 65.974 1.00 15.00 C H -ATOM 2387 CA ASN C 9 69.174 38.786 66.292 1.00 15.00 C C -ATOM 2388 CB ASN C 9 68.962 39.493 67.632 1.00 15.00 C C -ATOM 2389 CG ASN C 9 69.964 39.037 68.676 1.00 15.00 C C -ATOM 2390 OD1 ASN C 9 70.297 37.854 68.756 1.00 15.00 C O -ATOM 2391 ND2 ASN C 9 70.466 39.975 69.473 1.00 15.00 C N -ATOM 2392 HD21 ASN C 9 70.167 40.898 69.346 1.00 15.00 C H -ATOM 2393 HD22 ASN C 9 71.117 39.703 70.153 1.00 15.00 C H -ATOM 2394 C ASN C 9 68.032 39.071 65.319 1.00 15.00 C C -ATOM 2395 O ASN C 9 66.877 38.743 65.585 1.00 15.00 C O -ATOM 2396 N ALA C 10 68.373 39.688 64.193 1.00 15.00 C N -ATOM 2397 HN ALA C 10 69.309 39.945 64.058 1.00 15.00 C H -ATOM 2398 CA ALA C 10 67.402 40.001 63.155 1.00 15.00 C C -ATOM 2399 CB ALA C 10 67.189 41.507 63.074 1.00 15.00 C C -ATOM 2400 C ALA C 10 67.900 39.457 61.818 1.00 15.00 C C -ATOM 2401 O ALA C 10 69.107 39.286 61.637 1.00 15.00 C O -ATOM 2402 N PRO C 11 66.983 39.151 60.872 1.00 15.00 C N -ATOM 2403 CA PRO C 11 67.345 38.631 59.545 1.00 15.00 C C -ATOM 2404 CB PRO C 11 66.035 38.714 58.764 1.00 15.00 C C -ATOM 2405 CG PRO C 11 64.979 38.598 59.805 1.00 15.00 C C -ATOM 2406 CD PRO C 11 65.524 39.277 61.031 1.00 15.00 C C -ATOM 2407 C PRO C 11 68.412 39.491 58.876 1.00 15.00 C C -ATOM 2408 O PRO C 11 68.253 40.707 58.753 1.00 15.00 C O -ATOM 2409 N ALA C 12 69.499 38.846 58.455 1.00 15.00 C N -ATOM 2410 HN ALA C 12 69.547 37.874 58.578 1.00 15.00 C H -ATOM 2411 CA ALA C 12 70.619 39.532 57.818 1.00 15.00 C C -ATOM 2412 CB ALA C 12 71.707 38.536 57.447 1.00 15.00 C C -ATOM 2413 C ALA C 12 70.195 40.340 56.595 1.00 15.00 C C -ATOM 2414 O ALA C 12 69.400 39.879 55.773 1.00 15.00 C O -ATOM 2415 N ALA C 13 70.732 41.553 56.494 1.00 15.00 C N -ATOM 2416 HN ALA C 13 71.346 41.862 57.193 1.00 15.00 C H -ATOM 2417 CA ALA C 13 70.436 42.438 55.375 1.00 15.00 C C -ATOM 2418 CB ALA C 13 70.720 43.881 55.766 1.00 15.00 C C -ATOM 2419 C ALA C 13 71.258 42.037 54.151 1.00 15.00 C C -ATOM 2420 O ALA C 13 72.388 42.489 53.971 1.00 15.00 C O -ATOM 2421 N ILE C 14 70.677 41.177 53.319 1.00 15.00 C N -ATOM 2422 HN ILE C 14 69.770 40.866 53.518 1.00 15.00 C H -ATOM 2423 CA ILE C 14 71.348 40.680 52.121 1.00 15.00 C C -ATOM 2424 CB ILE C 14 70.805 39.292 51.711 1.00 15.00 C C -ATOM 2425 CG1 ILE C 14 70.907 38.313 52.886 1.00 15.00 C C -ATOM 2426 CG2 ILE C 14 71.560 38.755 50.503 1.00 15.00 C C -ATOM 2427 CD1 ILE C 14 70.222 36.987 52.648 1.00 15.00 C C -ATOM 2428 C ILE C 14 71.220 41.644 50.944 1.00 15.00 C C -ATOM 2429 O ILE C 14 72.188 41.882 50.220 1.00 15.00 C O -ATOM 2430 N GLY C 15 70.025 42.198 50.753 1.00 15.00 C N -ATOM 2431 HN GLY C 15 69.290 41.982 51.365 1.00 15.00 C H -ATOM 2432 CA GLY C 15 69.804 43.122 49.654 1.00 15.00 C C -ATOM 2433 C GLY C 15 70.449 44.475 49.887 1.00 15.00 C C -ATOM 2434 O GLY C 15 71.193 44.650 50.854 1.00 15.00 C O -ATOM 2435 N PRO C 16 70.190 45.456 49.006 1.00 15.00 C N -ATOM 2436 CA PRO C 16 70.750 46.799 49.139 1.00 15.00 C C -ATOM 2437 CB PRO C 16 70.554 47.410 47.751 1.00 15.00 C C -ATOM 2438 CG PRO C 16 69.404 46.670 47.151 1.00 15.00 C C -ATOM 2439 CD PRO C 16 69.345 45.316 47.806 1.00 15.00 C C -ATOM 2440 C PRO C 16 70.027 47.624 50.206 1.00 15.00 C C -ATOM 2441 O PRO C 16 69.318 48.583 49.897 1.00 15.00 C O -ATOM 2442 N TYR C 17 70.223 47.237 51.466 1.00 15.00 C N -ATOM 2443 HN TYR C 17 70.804 46.465 51.638 1.00 15.00 C H -ATOM 2444 CA TYR C 17 69.602 47.919 52.595 1.00 15.00 C C -ATOM 2445 CB TYR C 17 68.097 47.614 52.639 1.00 15.00 C C -ATOM 2446 CG TYR C 17 67.774 46.170 52.974 1.00 15.00 C C -ATOM 2447 CD1 TYR C 17 67.511 45.780 54.282 1.00 15.00 C C -ATOM 2448 CD2 TYR C 17 67.740 45.198 51.983 1.00 15.00 C C -ATOM 2449 CE1 TYR C 17 67.238 44.462 54.594 1.00 15.00 C C -ATOM 2450 CE2 TYR C 17 67.461 43.880 52.285 1.00 15.00 C C -ATOM 2451 CZ TYR C 17 67.210 43.517 53.590 1.00 15.00 C C -ATOM 2452 OH TYR C 17 66.942 42.202 53.896 1.00 15.00 C O -ATOM 2453 HH TYR C 17 66.245 42.162 54.554 1.00 15.00 C H -ATOM 2454 C TYR C 17 70.236 47.468 53.908 1.00 15.00 C C -ATOM 2455 O TYR C 17 70.915 46.444 53.962 1.00 15.00 C O -ATOM 2456 N VAL C 18 70.019 48.252 54.956 1.00 15.00 C N -ATOM 2457 HN VAL C 18 69.515 49.083 54.833 1.00 15.00 C H -ATOM 2458 CA VAL C 18 70.515 47.917 56.285 1.00 15.00 C C -ATOM 2459 CB VAL C 18 71.390 49.035 56.891 1.00 15.00 C C -ATOM 2460 CG1 VAL C 18 72.686 49.181 56.109 1.00 15.00 C C -ATOM 2461 CG2 VAL C 18 70.634 50.356 56.942 1.00 15.00 C C -ATOM 2462 C VAL C 18 69.326 47.644 57.199 1.00 15.00 C C -ATOM 2463 O VAL C 18 68.220 48.099 56.919 1.00 15.00 C O -ATOM 2464 N GLN C 19 69.545 46.896 58.277 1.00 15.00 C N -ATOM 2465 HN GLN C 19 70.448 46.555 58.447 1.00 15.00 C H -ATOM 2466 CA GLN C 19 68.467 46.563 59.213 1.00 15.00 C C -ATOM 2467 CB GLN C 19 68.971 45.625 60.305 1.00 15.00 C C -ATOM 2468 CG GLN C 19 69.299 44.223 59.818 1.00 15.00 C C -ATOM 2469 CD GLN C 19 70.060 43.425 60.854 1.00 15.00 C C -ATOM 2470 OE1 GLN C 19 70.800 43.987 61.653 1.00 15.00 C O -ATOM 2471 NE2 GLN C 19 69.882 42.112 60.846 1.00 15.00 C N -ATOM 2472 HE21 GLN C 19 69.275 41.730 60.179 1.00 15.00 C H -ATOM 2473 HE22 GLN C 19 70.366 41.575 61.511 1.00 15.00 C H -ATOM 2474 C GLN C 19 67.825 47.805 59.834 1.00 15.00 C C -ATOM 2475 O GLN C 19 66.610 47.857 60.015 1.00 15.00 C O -ATOM 2476 N GLY C 20 68.646 48.798 60.157 1.00 15.00 C N -ATOM 2477 HN GLY C 20 69.605 48.701 59.986 1.00 15.00 C H -ATOM 2478 CA GLY C 20 68.141 50.021 60.753 1.00 15.00 C C -ATOM 2479 C GLY C 20 69.199 51.104 60.808 1.00 15.00 C C -ATOM 2480 O GLY C 20 70.358 50.857 60.479 1.00 15.00 C O -ATOM 2481 N VAL C 21 68.807 52.306 61.224 1.00 15.00 C N -ATOM 2482 HN VAL C 21 67.868 52.447 61.471 1.00 15.00 C H -ATOM 2483 CA VAL C 21 69.744 53.421 61.312 1.00 15.00 C C -ATOM 2484 CB VAL C 21 69.589 54.423 60.145 1.00 15.00 C C -ATOM 2485 CG1 VAL C 21 70.168 53.849 58.860 1.00 15.00 C C -ATOM 2486 CG2 VAL C 21 68.131 54.817 59.952 1.00 15.00 C C -ATOM 2487 C VAL C 21 69.644 54.171 62.639 1.00 15.00 C C -ATOM 2488 O VAL C 21 68.552 54.458 63.131 1.00 15.00 C O -ATOM 2489 N ASP C 22 70.804 54.471 63.209 1.00 15.00 C N -ATOM 2490 HN ASP C 22 71.632 54.184 62.772 1.00 15.00 C H -ATOM 2491 CA ASP C 22 70.893 55.207 64.462 1.00 15.00 C C -ATOM 2492 CB ASP C 22 71.941 54.546 65.368 1.00 15.00 C C -ATOM 2493 CG ASP C 22 71.980 55.097 66.783 1.00 15.00 C C -ATOM 2494 OD1 ASP C 22 72.694 54.507 67.621 1.00 15.00 C O -ATOM 2495 OD2 ASP C 22 71.306 56.113 67.057 1.00 15.00 C O -ATOM 2496 C ASP C 22 71.293 56.648 64.153 1.00 15.00 C C -ATOM 2497 O ASP C 22 72.461 56.935 63.897 1.00 15.00 C O -ATOM 2498 N LEU C 23 70.314 57.546 64.169 1.00 15.00 C N -ATOM 2499 HN LEU C 23 69.406 57.256 64.397 1.00 15.00 C H -ATOM 2500 CA LEU C 23 70.556 58.957 63.864 1.00 15.00 C C -ATOM 2501 CB LEU C 23 69.374 59.529 63.076 1.00 15.00 C C -ATOM 2502 CG LEU C 23 68.719 58.592 62.059 1.00 15.00 C C -ATOM 2503 CD1 LEU C 23 67.440 59.206 61.516 1.00 15.00 C C -ATOM 2504 CD2 LEU C 23 69.681 58.266 60.930 1.00 15.00 C C -ATOM 2505 C LEU C 23 70.764 59.780 65.131 1.00 15.00 C C -ATOM 2506 O LEU C 23 70.658 61.007 65.109 1.00 15.00 C O -ATOM 2507 N GLY C 24 71.071 59.103 66.228 1.00 15.00 C N -ATOM 2508 HN GLY C 24 71.157 58.127 66.185 1.00 15.00 C H -ATOM 2509 CA GLY C 24 71.274 59.789 67.485 1.00 15.00 C C -ATOM 2510 C GLY C 24 70.098 59.585 68.410 1.00 15.00 C C -ATOM 2511 O GLY C 24 70.002 58.560 69.073 1.00 15.00 C O -ATOM 2512 N ASN C 25 69.189 60.552 68.442 1.00 15.00 C N -ATOM 2513 HN ASN C 25 69.314 61.347 67.882 1.00 15.00 C H -ATOM 2514 CA ASN C 25 68.008 60.455 69.289 1.00 15.00 C C -ATOM 2515 CB ASN C 25 67.436 61.847 69.580 1.00 15.00 C C -ATOM 2516 CG ASN C 25 66.179 61.801 70.430 1.00 15.00 C C -ATOM 2517 OD1 ASN C 25 66.215 61.383 71.587 1.00 15.00 C O -ATOM 2518 ND2 ASN C 25 65.060 62.235 69.861 1.00 15.00 C N -ATOM 2519 HD21 ASN C 25 65.105 62.557 68.936 1.00 15.00 C H -ATOM 2520 HD22 ASN C 25 64.233 62.216 70.388 1.00 15.00 C H -ATOM 2521 C ASN C 25 66.947 59.569 68.645 1.00 15.00 C C -ATOM 2522 O ASN C 25 66.244 58.832 69.330 1.00 15.00 C O -ATOM 2523 N MET C 26 66.853 59.633 67.320 1.00 15.00 C N -ATOM 2524 HN MET C 26 67.462 60.219 66.824 1.00 15.00 C H -ATOM 2525 CA MET C 26 65.871 58.846 66.589 1.00 15.00 C C -ATOM 2526 CB MET C 26 65.143 59.714 65.559 1.00 15.00 C C -ATOM 2527 CG MET C 26 64.128 58.960 64.714 1.00 15.00 C C -ATOM 2528 SD MET C 26 63.155 60.045 63.655 1.00 15.00 C S -ATOM 2529 CE MET C 26 62.204 60.944 64.874 1.00 15.00 C C -ATOM 2530 C MET C 26 66.487 57.624 65.913 1.00 15.00 C C -ATOM 2531 O MET C 26 67.556 57.700 65.310 1.00 15.00 C O -ATOM 2532 N ILE C 27 65.792 56.499 66.033 1.00 15.00 C N -ATOM 2533 HN ILE C 27 64.958 56.516 66.548 1.00 15.00 C H -ATOM 2534 CA ILE C 27 66.213 55.240 65.434 1.00 15.00 C C -ATOM 2535 CB ILE C 27 66.489 54.162 66.518 1.00 15.00 C C -ATOM 2536 CG1 ILE C 27 67.929 54.263 67.031 1.00 15.00 C C -ATOM 2537 CG2 ILE C 27 66.202 52.753 66.011 1.00 15.00 C C -ATOM 2538 CD1 ILE C 27 68.131 55.306 68.109 1.00 15.00 C C -ATOM 2539 C ILE C 27 65.124 54.762 64.471 1.00 15.00 C C -ATOM 2540 O ILE C 27 63.953 54.687 64.838 1.00 15.00 C O -ATOM 2541 N ILE C 28 65.506 54.465 63.236 1.00 15.00 C N -ATOM 2542 HN ILE C 28 66.452 54.546 62.992 1.00 15.00 C H -ATOM 2543 CA ILE C 28 64.546 54.013 62.235 1.00 15.00 C C -ATOM 2544 CB ILE C 28 64.436 55.004 61.057 1.00 15.00 C C -ATOM 2545 CG1 ILE C 28 64.199 56.426 61.582 1.00 15.00 C C -ATOM 2546 CG2 ILE C 28 63.309 54.592 60.120 1.00 15.00 C C -ATOM 2547 CD1 ILE C 28 64.219 57.493 60.511 1.00 15.00 C C -ATOM 2548 C ILE C 28 64.904 52.625 61.713 1.00 15.00 C C -ATOM 2549 O ILE C 28 66.014 52.395 61.244 1.00 15.00 C O -ATOM 2550 N THR C 29 63.950 51.706 61.796 1.00 15.00 C N -ATOM 2551 HN THR C 29 63.078 51.956 62.168 1.00 15.00 C H -ATOM 2552 CA THR C 29 64.163 50.335 61.346 1.00 15.00 C C -ATOM 2553 CB THR C 29 63.543 49.320 62.335 1.00 15.00 C C -ATOM 2554 OG1 THR C 29 62.127 49.238 62.120 1.00 15.00 C O -ATOM 2555 HG1 THR C 29 61.934 49.387 61.191 1.00 15.00 C H -ATOM 2556 CG2 THR C 29 63.802 49.741 63.775 1.00 15.00 C C -ATOM 2557 C THR C 29 63.550 50.104 59.967 1.00 15.00 C C -ATOM 2558 O THR C 29 62.666 50.847 59.537 1.00 15.00 C O -ATOM 2559 N SER C 30 64.031 49.074 59.278 1.00 15.00 C N -ATOM 2560 HN SER C 30 64.756 48.538 59.665 1.00 15.00 C H -ATOM 2561 CA SER C 30 63.515 48.724 57.961 1.00 15.00 C C -ATOM 2562 CB SER C 30 64.530 47.861 57.208 1.00 15.00 C C -ATOM 2563 OG SER C 30 65.629 48.628 56.768 1.00 15.00 C O -ATOM 2564 HG SER C 30 66.137 48.120 56.129 1.00 15.00 C H -ATOM 2565 C SER C 30 62.225 47.933 58.108 1.00 15.00 C C -ATOM 2566 O SER C 30 61.890 47.490 59.209 1.00 15.00 C O -ATOM 2567 N GLY C 31 61.496 47.774 57.004 1.00 15.00 C N -ATOM 2568 HN GLY C 31 61.788 48.193 56.167 1.00 15.00 C H -ATOM 2569 CA GLY C 31 60.273 46.995 57.037 1.00 15.00 C C -ATOM 2570 C GLY C 31 60.588 45.558 57.392 1.00 15.00 C C -ATOM 2571 O GLY C 31 61.129 44.815 56.572 1.00 15.00 C O -ATOM 2572 N GLN C 32 60.267 45.171 58.621 1.00 15.00 C N -ATOM 2573 HN GLN C 32 59.815 45.801 59.220 1.00 15.00 C H -ATOM 2574 CA GLN C 32 60.563 43.829 59.097 1.00 15.00 C C -ATOM 2575 CB GLN C 32 60.756 43.814 60.616 1.00 15.00 C C -ATOM 2576 CG GLN C 32 62.002 44.532 61.113 1.00 15.00 C C -ATOM 2577 CD GLN C 32 63.251 44.168 60.336 1.00 15.00 C C -ATOM 2578 OE1 GLN C 32 63.761 43.052 60.439 1.00 15.00 C O -ATOM 2579 NE2 GLN C 32 63.769 45.124 59.575 1.00 15.00 C N -ATOM 2580 HE21 GLN C 32 63.321 45.997 59.561 1.00 15.00 C H -ATOM 2581 HE22 GLN C 32 64.580 44.923 59.064 1.00 15.00 C H -ATOM 2582 C GLN C 32 59.503 42.812 58.712 1.00 15.00 C C -ATOM 2583 O GLN C 32 58.326 42.965 59.037 1.00 15.00 C O -ATOM 2584 N ILE C 33 59.938 41.772 58.014 1.00 15.00 C N -ATOM 2585 HN ILE C 33 60.883 41.731 57.759 1.00 15.00 C H -ATOM 2586 CA ILE C 33 59.050 40.693 57.616 1.00 15.00 C C -ATOM 2587 CB ILE C 33 59.302 40.232 56.162 1.00 15.00 C C -ATOM 2588 CG1 ILE C 33 60.780 39.904 55.934 1.00 15.00 C C -ATOM 2589 CG2 ILE C 33 58.829 41.299 55.184 1.00 15.00 C C -ATOM 2590 CD1 ILE C 33 61.088 39.412 54.534 1.00 15.00 C C -ATOM 2591 C ILE C 33 59.208 39.534 58.604 1.00 15.00 C C -ATOM 2592 O ILE C 33 60.205 39.475 59.325 1.00 15.00 C O -ATOM 2593 N PRO C 34 58.225 38.616 58.670 1.00 15.00 C N -ATOM 2594 CA PRO C 34 58.249 37.475 59.605 1.00 15.00 C C -ATOM 2595 CB PRO C 34 56.833 36.908 59.495 1.00 15.00 C C -ATOM 2596 CG PRO C 34 56.388 37.289 58.128 1.00 15.00 C C -ATOM 2597 CD PRO C 34 56.998 38.630 57.857 1.00 15.00 C C -ATOM 2598 C PRO C 34 59.277 36.382 59.287 1.00 15.00 C C -ATOM 2599 O PRO C 34 58.937 35.201 59.234 1.00 15.00 C O -ATOM 2600 N VAL C 35 60.534 36.767 59.106 1.00 15.00 C N -ATOM 2601 HN VAL C 35 60.756 37.721 59.158 1.00 15.00 C H -ATOM 2602 CA VAL C 35 61.591 35.802 58.826 1.00 15.00 C C -ATOM 2603 CB VAL C 35 62.552 36.303 57.725 1.00 15.00 C C -ATOM 2604 CG1 VAL C 35 63.752 35.375 57.581 1.00 15.00 C C -ATOM 2605 CG2 VAL C 35 61.820 36.420 56.399 1.00 15.00 C C -ATOM 2606 C VAL C 35 62.380 35.496 60.097 1.00 15.00 C C -ATOM 2607 O VAL C 35 62.883 36.406 60.757 1.00 15.00 C O -ATOM 2608 N ASN C 36 62.461 34.215 60.444 1.00 15.00 C N -ATOM 2609 HN ASN C 36 62.012 33.542 59.891 1.00 15.00 C H -ATOM 2610 CA ASN C 36 63.198 33.784 61.626 1.00 15.00 C C -ATOM 2611 CB ASN C 36 62.896 32.308 61.923 1.00 15.00 C C -ATOM 2612 CG ASN C 36 63.341 31.859 63.305 1.00 15.00 C C -ATOM 2613 OD1 ASN C 36 64.466 32.113 63.725 1.00 15.00 C O -ATOM 2614 ND2 ASN C 36 62.450 31.190 64.025 1.00 15.00 C N -ATOM 2615 HD21 ASN C 36 61.568 31.025 63.633 1.00 15.00 C H -ATOM 2616 HD22 ASN C 36 62.711 30.888 64.920 1.00 15.00 C H -ATOM 2617 C ASN C 36 64.696 33.991 61.397 1.00 15.00 C C -ATOM 2618 O ASN C 36 65.254 33.475 60.439 1.00 15.00 C O -ATOM 2619 N PRO C 37 65.358 34.771 62.263 1.00 15.00 C N -ATOM 2620 CA PRO C 37 66.799 35.047 62.137 1.00 15.00 C C -ATOM 2621 CB PRO C 37 67.048 36.104 63.218 1.00 15.00 C C -ATOM 2622 CG PRO C 37 65.956 35.894 64.211 1.00 15.00 C C -ATOM 2623 CD PRO C 37 64.759 35.461 63.420 1.00 15.00 C C -ATOM 2624 C PRO C 37 67.679 33.819 62.394 1.00 15.00 C C -ATOM 2625 O PRO C 37 68.847 33.794 62.006 1.00 15.00 C O -ATOM 2626 N LYS C 38 67.109 32.800 63.032 1.00 15.00 C N -ATOM 2627 HN LYS C 38 66.166 32.868 63.289 1.00 15.00 C H -ATOM 2628 CA LYS C 38 67.847 31.583 63.363 1.00 15.00 C C -ATOM 2629 CB LYS C 38 67.368 31.033 64.709 1.00 15.00 C C -ATOM 2630 CG LYS C 38 68.063 29.757 65.158 1.00 15.00 C C -ATOM 2631 CD LYS C 38 67.425 29.194 66.416 1.00 15.00 C C -ATOM 2632 CE LYS C 38 67.570 30.151 67.591 1.00 15.00 C C -ATOM 2633 NZ LYS C 38 68.998 30.411 67.922 1.00 15.00 C N -ATOM 2634 HZ1 LYS C 38 69.491 30.801 67.093 1.00 15.00 C H -ATOM 2635 HZ2 LYS C 38 69.465 29.527 68.204 1.00 15.00 C H -ATOM 2636 HZ3 LYS C 38 69.067 31.093 68.705 1.00 15.00 C H -ATOM 2637 C LYS C 38 67.744 30.502 62.283 1.00 15.00 C C -ATOM 2638 O LYS C 38 68.719 29.802 62.009 1.00 15.00 C O -ATOM 2639 N THR C 39 66.571 30.360 61.671 1.00 15.00 C N -ATOM 2640 HN THR C 39 65.828 30.954 61.907 1.00 15.00 C H -ATOM 2641 CA THR C 39 66.376 29.334 60.645 1.00 15.00 C C -ATOM 2642 CB THR C 39 65.175 28.419 60.966 1.00 15.00 C C -ATOM 2643 OG1 THR C 39 63.972 29.196 61.028 1.00 15.00 C O -ATOM 2644 HG1 THR C 39 64.100 30.022 60.558 1.00 15.00 C H -ATOM 2645 CG2 THR C 39 65.381 27.705 62.294 1.00 15.00 C C -ATOM 2646 C THR C 39 66.190 29.932 59.254 1.00 15.00 C C -ATOM 2647 O THR C 39 66.537 29.310 58.251 1.00 15.00 C O -ATOM 2648 N GLY C 40 65.643 31.138 59.201 1.00 15.00 C N -ATOM 2649 HN GLY C 40 65.402 31.594 60.036 1.00 15.00 C H -ATOM 2650 CA GLY C 40 65.403 31.794 57.928 1.00 15.00 C C -ATOM 2651 C GLY C 40 64.042 31.436 57.364 1.00 15.00 C C -ATOM 2652 O GLY C 40 63.703 31.821 56.245 1.00 15.00 C O -ATOM 2653 N GLU C 41 63.261 30.700 58.155 1.00 15.00 C N -ATOM 2654 HN GLU C 41 63.590 30.444 59.041 1.00 15.00 C H -ATOM 2655 CA GLU C 41 61.931 30.263 57.745 1.00 15.00 C C -ATOM 2656 CB GLU C 41 61.625 28.881 58.326 1.00 15.00 C C -ATOM 2657 CG GLU C 41 62.622 27.797 57.949 1.00 15.00 C C -ATOM 2658 CD GLU C 41 62.263 26.454 58.553 1.00 15.00 C C -ATOM 2659 OE1 GLU C 41 61.746 26.435 59.691 1.00 15.00 C O -ATOM 2660 OE2 GLU C 41 62.500 25.421 57.893 1.00 15.00 C O -ATOM 2661 C GLU C 41 60.856 31.241 58.195 1.00 15.00 C C -ATOM 2662 O GLU C 41 61.071 32.055 59.092 1.00 15.00 C O -ATOM 2663 N VAL C 42 59.690 31.141 57.566 1.00 15.00 C N -ATOM 2664 HN VAL C 42 59.586 30.467 56.862 1.00 15.00 C H -ATOM 2665 CA VAL C 42 58.561 32.004 57.891 1.00 15.00 C C -ATOM 2666 CB VAL C 42 58.121 32.838 56.665 1.00 15.00 C C -ATOM 2667 CG1 VAL C 42 56.914 33.704 56.995 1.00 15.00 C C -ATOM 2668 CG2 VAL C 42 59.269 33.695 56.156 1.00 15.00 C C -ATOM 2669 C VAL C 42 57.376 31.174 58.383 1.00 15.00 C C -ATOM 2670 O VAL C 42 56.926 30.258 57.693 1.00 15.00 C O -ATOM 2671 N PRO C 43 56.866 31.475 59.593 1.00 15.00 C N -ATOM 2672 CA PRO C 43 55.716 30.763 60.171 1.00 15.00 C C -ATOM 2673 CB PRO C 43 55.527 31.434 61.538 1.00 15.00 C C -ATOM 2674 CG PRO C 43 56.217 32.750 61.420 1.00 15.00 C C -ATOM 2675 CD PRO C 43 57.372 32.526 60.491 1.00 15.00 C C -ATOM 2676 C PRO C 43 54.460 30.947 59.320 1.00 15.00 C C -ATOM 2677 O PRO C 43 54.246 32.009 58.744 1.00 15.00 C O -ATOM 2678 N ALA C 44 53.640 29.905 59.234 1.00 15.00 C N -ATOM 2679 HN ALA C 44 53.864 29.079 59.710 1.00 15.00 C H -ATOM 2680 CA ALA C 44 52.413 29.962 58.445 1.00 15.00 C C -ATOM 2681 CB ALA C 44 51.891 28.563 58.160 1.00 15.00 C C -ATOM 2682 C ALA C 44 51.343 30.802 59.133 1.00 15.00 C C -ATOM 2683 O ALA C 44 50.681 31.617 58.492 1.00 15.00 C O -ATOM 2684 N ASP C 45 51.183 30.596 60.441 1.00 15.00 C N -ATOM 2685 HN ASP C 45 51.742 29.927 60.889 1.00 15.00 C H -ATOM 2686 CA ASP C 45 50.194 31.331 61.225 1.00 15.00 C C -ATOM 2687 CB ASP C 45 50.234 30.874 62.686 1.00 15.00 C C -ATOM 2688 CG ASP C 45 49.095 31.436 63.511 1.00 15.00 C C -ATOM 2689 OD1 ASP C 45 49.359 32.290 64.377 1.00 15.00 C O -ATOM 2690 OD2 ASP C 45 47.938 31.022 63.288 1.00 15.00 C O -ATOM 2691 C ASP C 45 50.424 32.837 61.129 1.00 15.00 C C -ATOM 2692 O ASP C 45 51.558 33.308 61.225 1.00 15.00 C O -ATOM 2693 N VAL C 46 49.339 33.585 60.935 1.00 15.00 C N -ATOM 2694 HN VAL C 46 48.465 33.149 60.886 1.00 15.00 C H -ATOM 2695 CA VAL C 46 49.414 35.038 60.803 1.00 15.00 C C -ATOM 2696 CB VAL C 46 48.110 35.632 60.219 1.00 15.00 C C -ATOM 2697 CG1 VAL C 46 46.936 35.455 61.173 1.00 15.00 C C -ATOM 2698 CG2 VAL C 46 48.292 37.094 59.836 1.00 15.00 C C -ATOM 2699 C VAL C 46 49.776 35.720 62.125 1.00 15.00 C C -ATOM 2700 O VAL C 46 50.467 36.739 62.133 1.00 15.00 C O -ATOM 2701 N ALA C 47 49.320 35.147 63.240 1.00 15.00 C N -ATOM 2702 HN ALA C 47 48.774 34.336 63.173 1.00 15.00 C H -ATOM 2703 CA ALA C 47 49.618 35.699 64.558 1.00 15.00 C C -ATOM 2704 CB ALA C 47 48.745 35.057 65.624 1.00 15.00 C C -ATOM 2705 C ALA C 47 51.091 35.493 64.882 1.00 15.00 C C -ATOM 2706 O ALA C 47 51.724 36.338 65.515 1.00 15.00 C O -ATOM 2707 N ALA C 48 51.628 34.360 64.433 1.00 15.00 C N -ATOM 2708 HN ALA C 48 51.059 33.723 63.950 1.00 15.00 C H -ATOM 2709 CA ALA C 48 53.032 34.039 64.642 1.00 15.00 C C -ATOM 2710 CB ALA C 48 53.290 32.565 64.364 1.00 15.00 C C -ATOM 2711 C ALA C 48 53.903 34.915 63.748 1.00 15.00 C C -ATOM 2712 O ALA C 48 55.030 35.256 64.105 1.00 15.00 C O -ATOM 2713 N GLN C 49 53.363 35.278 62.581 1.00 15.00 C N -ATOM 2714 HN GLN C 49 52.466 34.955 62.352 1.00 15.00 C H -ATOM 2715 CA GLN C 49 54.068 36.136 61.638 1.00 15.00 C C -ATOM 2716 CB GLN C 49 53.365 36.142 60.278 1.00 15.00 C C -ATOM 2717 CG GLN C 49 53.717 34.964 59.387 1.00 15.00 C C -ATOM 2718 CD GLN C 49 53.385 35.216 57.928 1.00 15.00 C C -ATOM 2719 OE1 GLN C 49 53.371 36.358 57.474 1.00 15.00 C O -ATOM 2720 NE2 GLN C 49 53.129 34.149 57.184 1.00 15.00 C N -ATOM 2721 HE21 GLN C 49 53.167 33.267 57.610 1.00 15.00 C H -ATOM 2722 HE22 GLN C 49 52.917 34.285 56.237 1.00 15.00 C H -ATOM 2723 C GLN C 49 54.156 37.557 62.176 1.00 15.00 C C -ATOM 2724 O GLN C 49 55.167 38.237 62.002 1.00 15.00 C O -ATOM 2725 N ALA C 50 53.085 37.997 62.835 1.00 15.00 C N -ATOM 2726 HN ALA C 50 52.310 37.404 62.932 1.00 15.00 C H -ATOM 2727 CA ALA C 50 53.032 39.332 63.414 1.00 15.00 C C -ATOM 2728 CB ALA C 50 51.619 39.655 63.876 1.00 15.00 C C -ATOM 2729 C ALA C 50 54.014 39.455 64.573 1.00 15.00 C C -ATOM 2730 O ALA C 50 54.645 40.494 64.753 1.00 15.00 C O -ATOM 2731 N ARG C 51 54.147 38.376 65.344 1.00 15.00 C N -ATOM 2732 HN ARG C 51 53.619 37.576 65.140 1.00 15.00 C H -ATOM 2733 CA ARG C 51 55.056 38.356 66.484 1.00 15.00 C C -ATOM 2734 CB ARG C 51 54.726 37.197 67.430 1.00 15.00 C C -ATOM 2735 CG ARG C 51 55.623 37.128 68.657 1.00 15.00 C C -ATOM 2736 CD ARG C 51 55.066 36.183 69.711 1.00 15.00 C C -ATOM 2737 NE ARG C 51 53.870 36.720 70.360 1.00 15.00 C N -ATOM 2738 HE ARG C 51 53.001 36.422 70.021 1.00 15.00 C H -ATOM 2739 CZ ARG C 51 53.900 37.578 71.380 1.00 15.00 C C -ATOM 2740 NH1 ARG C 51 55.060 38.003 71.867 1.00 15.00 C N -ATOM 2741 HH11 ARG C 51 55.954 37.667 71.453 1.00 15.00 C H -ATOM 2742 HH12 ARG C 51 55.077 38.672 72.665 1.00 15.00 C H -ATOM 2743 NH2 ARG C 51 52.767 38.013 71.914 1.00 15.00 C N -ATOM 2744 HH21 ARG C 51 51.855 37.685 71.538 1.00 15.00 C H -ATOM 2745 HH22 ARG C 51 52.791 38.681 72.712 1.00 15.00 C H -ATOM 2746 C ARG C 51 56.513 38.284 66.033 1.00 15.00 C C -ATOM 2747 O ARG C 51 57.385 38.882 66.654 1.00 15.00 C O -ATOM 2748 N GLN C 52 56.768 37.552 64.946 1.00 15.00 C N -ATOM 2749 HN GLN C 52 56.030 37.090 64.497 1.00 15.00 C H -ATOM 2750 CA GLN C 52 58.120 37.421 64.413 1.00 15.00 C C -ATOM 2751 CB GLN C 52 58.184 36.325 63.344 1.00 15.00 C C -ATOM 2752 CG GLN C 52 59.578 36.059 62.787 1.00 15.00 C C -ATOM 2753 CD GLN C 52 60.567 35.599 63.844 1.00 15.00 C C -ATOM 2754 OE1 GLN C 52 60.678 34.408 64.130 1.00 15.00 C O -ATOM 2755 NE2 GLN C 52 61.302 36.545 64.419 1.00 15.00 C N -ATOM 2756 HE21 GLN C 52 61.167 37.473 64.134 1.00 15.00 C H -ATOM 2757 HE22 GLN C 52 61.948 36.275 65.103 1.00 15.00 C H -ATOM 2758 C GLN C 52 58.604 38.757 63.854 1.00 15.00 C C -ATOM 2759 O GLN C 52 59.768 39.120 64.013 1.00 15.00 C O -ATOM 2760 N SER C 53 57.697 39.484 63.200 1.00 15.00 C N -ATOM 2761 HN SER C 53 56.792 39.126 63.085 1.00 15.00 C H -ATOM 2762 CA SER C 53 58.020 40.793 62.645 1.00 15.00 C C -ATOM 2763 CB SER C 53 56.867 41.315 61.785 1.00 15.00 C C -ATOM 2764 OG SER C 53 56.873 40.714 60.506 1.00 15.00 C O -ATOM 2765 HG SER C 53 57.624 41.043 60.003 1.00 15.00 C H -ATOM 2766 C SER C 53 58.311 41.781 63.767 1.00 15.00 C C -ATOM 2767 O SER C 53 59.213 42.609 63.659 1.00 15.00 C O -ATOM 2768 N LEU C 54 57.537 41.675 64.847 1.00 15.00 C N -ATOM 2769 HN LEU C 54 56.833 40.994 64.861 1.00 15.00 C H -ATOM 2770 CA LEU C 54 57.705 42.541 66.009 1.00 15.00 C C -ATOM 2771 CB LEU C 54 56.495 42.432 66.939 1.00 15.00 C C -ATOM 2772 CG LEU C 54 55.228 43.159 66.483 1.00 15.00 C C -ATOM 2773 CD1 LEU C 54 54.034 42.732 67.320 1.00 15.00 C C -ATOM 2774 CD2 LEU C 54 55.423 44.666 66.556 1.00 15.00 C C -ATOM 2775 C LEU C 54 58.985 42.197 66.763 1.00 15.00 C C -ATOM 2776 O LEU C 54 59.639 43.077 67.321 1.00 15.00 C O -ATOM 2777 N ASP C 55 59.336 40.909 66.773 1.00 15.00 C N -ATOM 2778 HN ASP C 55 58.760 40.256 66.321 1.00 15.00 C H -ATOM 2779 CA ASP C 55 60.548 40.443 67.440 1.00 15.00 C C -ATOM 2780 CB ASP C 55 60.562 38.916 67.558 1.00 15.00 C C -ATOM 2781 CG ASP C 55 59.858 38.411 68.804 1.00 15.00 C C -ATOM 2782 OD1 ASP C 55 59.314 37.286 68.764 1.00 15.00 C O -ATOM 2783 OD2 ASP C 55 59.854 39.136 69.821 1.00 15.00 C O -ATOM 2784 C ASP C 55 61.785 40.917 66.689 1.00 15.00 C C -ATOM 2785 O ASP C 55 62.823 41.184 67.292 1.00 15.00 C O -ATOM 2786 N ASN C 56 61.661 41.018 65.365 1.00 15.00 C N -ATOM 2787 HN ASN C 56 60.809 40.772 64.946 1.00 15.00 C H -ATOM 2788 CA ASN C 56 62.758 41.483 64.524 1.00 15.00 C C -ATOM 2789 CB ASN C 56 62.493 41.165 63.052 1.00 15.00 C C -ATOM 2790 CG ASN C 56 62.622 39.687 62.737 1.00 15.00 C C -ATOM 2791 OD1 ASN C 56 63.266 38.936 63.469 1.00 15.00 C O -ATOM 2792 ND2 ASN C 56 62.021 39.265 61.633 1.00 15.00 C N -ATOM 2793 HD21 ASN C 56 61.533 39.920 61.091 1.00 15.00 C H -ATOM 2794 HD22 ASN C 56 62.093 38.315 61.400 1.00 15.00 C H -ATOM 2795 C ASN C 56 62.962 42.980 64.712 1.00 15.00 C C -ATOM 2796 O ASN C 56 64.090 43.471 64.683 1.00 15.00 C O -ATOM 2797 N VAL C 57 61.854 43.697 64.905 1.00 15.00 C N -ATOM 2798 HN VAL C 57 60.985 43.243 64.890 1.00 15.00 C H -ATOM 2799 CA VAL C 57 61.896 45.136 65.138 1.00 15.00 C C -ATOM 2800 CB VAL C 57 60.471 45.744 65.137 1.00 15.00 C C -ATOM 2801 CG1 VAL C 57 60.478 47.165 65.682 1.00 15.00 C C -ATOM 2802 CG2 VAL C 57 59.878 45.722 63.739 1.00 15.00 C C -ATOM 2803 C VAL C 57 62.549 45.397 66.489 1.00 15.00 C C -ATOM 2804 O VAL C 57 63.376 46.295 66.632 1.00 15.00 C O -ATOM 2805 N LYS C 58 62.175 44.573 67.467 1.00 15.00 C N -ATOM 2806 HN LYS C 58 61.516 43.875 67.267 1.00 15.00 C H -ATOM 2807 CA LYS C 58 62.704 44.666 68.819 1.00 15.00 C C -ATOM 2808 CB LYS C 58 61.984 43.656 69.721 1.00 15.00 C C -ATOM 2809 CG LYS C 58 62.688 43.354 71.034 1.00 15.00 C C -ATOM 2810 CD LYS C 58 61.952 42.281 71.817 1.00 15.00 C C -ATOM 2811 CE LYS C 58 62.797 41.763 72.969 1.00 15.00 C C -ATOM 2812 NZ LYS C 58 62.019 40.867 73.868 1.00 15.00 C N -ATOM 2813 HZ1 LYS C 58 62.587 40.035 74.123 1.00 15.00 C H -ATOM 2814 HZ2 LYS C 58 61.150 40.549 73.393 1.00 15.00 C H -ATOM 2815 HZ3 LYS C 58 61.757 41.375 74.738 1.00 15.00 C H -ATOM 2816 C LYS C 58 64.210 44.415 68.837 1.00 15.00 C C -ATOM 2817 O LYS C 58 64.947 45.092 69.546 1.00 15.00 C O -ATOM 2818 N ALA C 59 64.656 43.444 68.040 1.00 15.00 C N -ATOM 2819 HN ALA C 59 64.012 42.944 67.496 1.00 15.00 C H -ATOM 2820 CA ALA C 59 66.073 43.096 67.958 1.00 15.00 C C -ATOM 2821 CB ALA C 59 66.266 41.875 67.074 1.00 15.00 C C -ATOM 2822 C ALA C 59 66.916 44.265 67.451 1.00 15.00 C C -ATOM 2823 O ALA C 59 68.023 44.494 67.935 1.00 15.00 C O -ATOM 2824 N ILE C 60 66.383 44.999 66.476 1.00 15.00 C N -ATOM 2825 HN ILE C 60 65.498 44.760 66.131 1.00 15.00 C H -ATOM 2826 CA ILE C 60 67.081 46.149 65.902 1.00 15.00 C C -ATOM 2827 CB ILE C 60 66.452 46.566 64.555 1.00 15.00 C C -ATOM 2828 CG1 ILE C 60 66.548 45.417 63.552 1.00 15.00 C C -ATOM 2829 CG2 ILE C 60 67.119 47.816 64.000 1.00 15.00 C C -ATOM 2830 CD1 ILE C 60 65.712 45.620 62.311 1.00 15.00 C C -ATOM 2831 C ILE C 60 67.067 47.337 66.866 1.00 15.00 C C -ATOM 2832 O ILE C 60 68.066 48.043 67.012 1.00 15.00 C O -ATOM 2833 N VAL C 61 65.929 47.544 67.524 1.00 15.00 C N -ATOM 2834 HN VAL C 61 65.170 46.943 67.365 1.00 15.00 C H -ATOM 2835 CA VAL C 61 65.775 48.640 68.477 1.00 15.00 C C -ATOM 2836 CB VAL C 61 64.300 48.800 68.917 1.00 15.00 C C -ATOM 2837 CG1 VAL C 61 64.169 49.812 70.044 1.00 15.00 C C -ATOM 2838 CG2 VAL C 61 63.437 49.218 67.738 1.00 15.00 C C -ATOM 2839 C VAL C 61 66.672 48.436 69.701 1.00 15.00 C C -ATOM 2840 O VAL C 61 67.292 49.381 70.190 1.00 15.00 C O -ATOM 2841 N GLU C 62 66.753 47.192 70.175 1.00 15.00 C N -ATOM 2842 HN GLU C 62 66.244 46.480 69.733 1.00 15.00 C H -ATOM 2843 CA GLU C 62 67.577 46.860 71.334 1.00 15.00 C C -ATOM 2844 CB GLU C 62 67.185 45.504 71.921 1.00 15.00 C C -ATOM 2845 CG GLU C 62 65.815 45.487 72.577 1.00 15.00 C C -ATOM 2846 CD GLU C 62 65.549 44.204 73.339 1.00 15.00 C C -ATOM 2847 OE1 GLU C 62 64.772 44.247 74.316 1.00 15.00 C O -ATOM 2848 OE2 GLU C 62 66.116 43.157 72.961 1.00 15.00 C O -ATOM 2849 C GLU C 62 69.062 46.876 70.993 1.00 15.00 C C -ATOM 2850 O GLU C 62 69.904 47.073 71.868 1.00 15.00 C O -ATOM 2851 N ALA C 63 69.377 46.666 69.713 1.00 15.00 C N -ATOM 2852 HN ALA C 63 68.661 46.505 69.065 1.00 15.00 C H -ATOM 2853 CA ALA C 63 70.763 46.677 69.259 1.00 15.00 C C -ATOM 2854 CB ALA C 63 70.878 46.067 67.870 1.00 15.00 C C -ATOM 2855 C ALA C 63 71.303 48.102 69.261 1.00 15.00 C C -ATOM 2856 O ALA C 63 72.513 48.323 69.277 1.00 15.00 C O -ATOM 2857 N ALA C 64 70.382 49.063 69.247 1.00 15.00 C N -ATOM 2858 HN ALA C 64 69.435 48.813 69.222 1.00 15.00 C H -ATOM 2859 CA ALA C 64 70.737 50.474 69.268 1.00 15.00 C C -ATOM 2860 CB ALA C 64 69.737 51.278 68.452 1.00 15.00 C C -ATOM 2861 C ALA C 64 70.791 50.992 70.704 1.00 15.00 C C -ATOM 2862 O ALA C 64 71.102 52.157 70.940 1.00 15.00 C O -ATOM 2863 N GLY C 65 70.485 50.115 71.659 1.00 15.00 C N -ATOM 2864 HN GLY C 65 70.248 49.197 71.409 1.00 15.00 C H -ATOM 2865 CA GLY C 65 70.510 50.498 73.060 1.00 15.00 C C -ATOM 2866 C GLY C 65 69.170 51.002 73.568 1.00 15.00 C C -ATOM 2867 O GLY C 65 69.101 51.635 74.621 1.00 15.00 C O -ATOM 2868 N LEU C 66 68.104 50.725 72.821 1.00 15.00 C N -ATOM 2869 HN LEU C 66 68.221 50.218 71.989 1.00 15.00 C H -ATOM 2870 CA LEU C 66 66.763 51.156 73.209 1.00 15.00 C C -ATOM 2871 CB LEU C 66 66.123 52.008 72.108 1.00 15.00 C C -ATOM 2872 CG LEU C 66 66.740 53.387 71.867 1.00 15.00 C C -ATOM 2873 CD1 LEU C 66 65.964 54.134 70.795 1.00 15.00 C C -ATOM 2874 CD2 LEU C 66 66.778 54.192 73.157 1.00 15.00 C C -ATOM 2875 C LEU C 66 65.867 49.965 73.539 1.00 15.00 C C -ATOM 2876 O LEU C 66 66.261 48.813 73.367 1.00 15.00 C O -ATOM 2877 N LYS C 67 64.661 50.255 74.019 1.00 15.00 C N -ATOM 2878 HN LYS C 67 64.408 51.196 74.138 1.00 15.00 C H -ATOM 2879 CA LYS C 67 63.702 49.213 74.376 1.00 15.00 C C -ATOM 2880 CB LYS C 67 63.268 49.373 75.838 1.00 15.00 C C -ATOM 2881 CG LYS C 67 64.405 49.465 76.841 1.00 15.00 C C -ATOM 2882 CD LYS C 67 63.868 49.703 78.244 1.00 15.00 C C -ATOM 2883 CE LYS C 67 64.986 49.744 79.273 1.00 15.00 C C -ATOM 2884 NZ LYS C 67 64.455 49.899 80.657 1.00 15.00 C N -ATOM 2885 HZ1 LYS C 67 63.955 50.807 80.748 1.00 15.00 C H -ATOM 2886 HZ2 LYS C 67 65.235 49.876 81.344 1.00 15.00 C H -ATOM 2887 HZ3 LYS C 67 63.794 49.127 80.874 1.00 15.00 C H -ATOM 2888 C LYS C 67 62.464 49.290 73.486 1.00 15.00 C C -ATOM 2889 O LYS C 67 62.335 50.196 72.663 1.00 15.00 C O -ATOM 2890 N VAL C 68 61.553 48.334 73.663 1.00 15.00 C N -ATOM 2891 HN VAL C 68 61.724 47.630 74.323 1.00 15.00 C H -ATOM 2892 CA VAL C 68 60.306 48.303 72.900 1.00 15.00 C C -ATOM 2893 CB VAL C 68 59.566 46.959 73.098 1.00 15.00 C C -ATOM 2894 CG1 VAL C 68 58.173 46.986 72.483 1.00 15.00 C C -ATOM 2895 CG2 VAL C 68 60.378 45.822 72.502 1.00 15.00 C C -ATOM 2896 C VAL C 68 59.410 49.471 73.321 1.00 15.00 C C -ATOM 2897 O VAL C 68 58.589 49.961 72.542 1.00 15.00 C O -ATOM 2898 N GLY C 69 59.601 49.928 74.560 1.00 15.00 C N -ATOM 2899 HN GLY C 69 60.277 49.500 75.126 1.00 15.00 C H -ATOM 2900 CA GLY C 69 58.829 51.041 75.081 1.00 15.00 C C -ATOM 2901 C GLY C 69 59.263 52.372 74.506 1.00 15.00 C C -ATOM 2902 O GLY C 69 58.587 53.384 74.688 1.00 15.00 C O -ATOM 2903 N ASP C 70 60.393 52.368 73.806 1.00 15.00 C N -ATOM 2904 HN ASP C 70 60.885 51.527 73.699 1.00 15.00 C H -ATOM 2905 CA ASP C 70 60.919 53.579 73.196 1.00 15.00 C C -ATOM 2906 CB ASP C 70 62.448 53.564 73.185 1.00 15.00 C C -ATOM 2907 CG ASP C 70 63.028 53.656 74.583 1.00 15.00 C C -ATOM 2908 OD1 ASP C 70 63.997 52.926 74.875 1.00 15.00 C O -ATOM 2909 OD2 ASP C 70 62.509 54.456 75.390 1.00 15.00 C O -ATOM 2910 C ASP C 70 60.356 53.790 71.792 1.00 15.00 C C -ATOM 2911 O ASP C 70 60.536 54.853 71.199 1.00 15.00 C O -ATOM 2912 N ILE C 71 59.676 52.768 71.266 1.00 15.00 C N -ATOM 2913 HN ILE C 71 59.588 51.939 71.781 1.00 15.00 C H -ATOM 2914 CA ILE C 71 59.062 52.854 69.942 1.00 15.00 C C -ATOM 2915 CB ILE C 71 58.588 51.471 69.445 1.00 15.00 C C -ATOM 2916 CG1 ILE C 71 59.764 50.486 69.410 1.00 15.00 C C -ATOM 2917 CG2 ILE C 71 57.953 51.586 68.068 1.00 15.00 C C -ATOM 2918 CD1 ILE C 71 59.369 49.063 69.080 1.00 15.00 C C -ATOM 2919 C ILE C 71 57.880 53.824 69.994 1.00 15.00 C C -ATOM 2920 O ILE C 71 56.962 53.649 70.794 1.00 15.00 C O -ATOM 2921 N VAL C 72 57.913 54.848 69.142 1.00 15.00 C N -ATOM 2922 HN VAL C 72 58.660 54.922 68.514 1.00 15.00 C H -ATOM 2923 CA VAL C 72 56.866 55.871 69.128 1.00 15.00 C C -ATOM 2924 CB VAL C 72 57.455 57.278 69.351 1.00 15.00 C C -ATOM 2925 CG1 VAL C 72 58.013 57.407 70.758 1.00 15.00 C C -ATOM 2926 CG2 VAL C 72 58.530 57.580 68.316 1.00 15.00 C C -ATOM 2927 C VAL C 72 56.005 55.890 67.860 1.00 15.00 C C -ATOM 2928 O VAL C 72 54.952 56.523 67.850 1.00 15.00 C O -ATOM 2929 N LYS C 73 56.437 55.217 66.796 1.00 15.00 C N -ATOM 2930 HN LYS C 73 57.280 54.720 66.848 1.00 15.00 C H -ATOM 2931 CA LYS C 73 55.664 55.205 65.547 1.00 15.00 C C -ATOM 2932 CB LYS C 73 55.932 56.475 64.724 1.00 15.00 C C -ATOM 2933 CG LYS C 73 55.281 56.496 63.342 1.00 15.00 C C -ATOM 2934 CD LYS C 73 53.762 56.422 63.433 1.00 15.00 C C -ATOM 2935 CE LYS C 73 53.101 56.691 62.086 1.00 15.00 C C -ATOM 2936 NZ LYS C 73 53.472 55.681 61.056 1.00 15.00 C N -ATOM 2937 HZ1 LYS C 73 53.193 54.728 61.368 1.00 15.00 C H -ATOM 2938 HZ2 LYS C 73 54.499 55.693 60.895 1.00 15.00 C H -ATOM 2939 HZ3 LYS C 73 52.990 55.895 60.158 1.00 15.00 C H -ATOM 2940 C LYS C 73 55.946 53.961 64.712 1.00 15.00 C C -ATOM 2941 O LYS C 73 57.095 53.611 64.475 1.00 15.00 C O -ATOM 2942 N THR C 74 54.881 53.297 64.264 1.00 15.00 C N -ATOM 2943 HN THR C 74 53.984 53.622 64.493 1.00 15.00 C H -ATOM 2944 CA THR C 74 55.009 52.092 63.450 1.00 15.00 C C -ATOM 2945 CB THR C 74 54.740 50.816 64.280 1.00 15.00 C C -ATOM 2946 OG1 THR C 74 53.371 50.799 64.695 1.00 15.00 C O -ATOM 2947 HG1 THR C 74 52.869 51.425 64.168 1.00 15.00 C H -ATOM 2948 CG2 THR C 74 55.635 50.755 65.508 1.00 15.00 C C -ATOM 2949 C THR C 74 54.026 52.105 62.279 1.00 15.00 C C -ATOM 2950 O THR C 74 52.959 52.713 62.357 1.00 15.00 C O -ATOM 2951 N THR C 75 54.400 51.436 61.194 1.00 15.00 C N -ATOM 2952 HN THR C 75 55.278 51.006 61.182 1.00 15.00 C H -ATOM 2953 CA THR C 75 53.543 51.327 60.016 1.00 15.00 C C -ATOM 2954 CB THR C 75 54.113 52.089 58.804 1.00 15.00 C C -ATOM 2955 OG1 THR C 75 54.230 53.478 59.133 1.00 15.00 C O -ATOM 2956 HG1 THR C 75 53.575 53.979 58.640 1.00 15.00 C H -ATOM 2957 CG2 THR C 75 53.193 51.951 57.603 1.00 15.00 C C -ATOM 2958 C THR C 75 53.347 49.850 59.675 1.00 15.00 C C -ATOM 2959 O THR C 75 54.275 49.177 59.221 1.00 15.00 C O -ATOM 2960 N VAL C 76 52.133 49.357 59.901 1.00 15.00 C N -ATOM 2961 HN VAL C 76 51.427 49.957 60.224 1.00 15.00 C H -ATOM 2962 CA VAL C 76 51.820 47.952 59.674 1.00 15.00 C C -ATOM 2963 CB VAL C 76 50.903 47.399 60.787 1.00 15.00 C C -ATOM 2964 CG1 VAL C 76 50.710 45.900 60.635 1.00 15.00 C C -ATOM 2965 CG2 VAL C 76 51.466 47.731 62.162 1.00 15.00 C C -ATOM 2966 C VAL C 76 51.184 47.678 58.313 1.00 15.00 C C -ATOM 2967 O VAL C 76 50.028 48.027 58.066 1.00 15.00 C O -ATOM 2968 N PHE C 77 51.957 47.043 57.437 1.00 15.00 C N -ATOM 2969 HN PHE C 77 52.880 46.829 57.688 1.00 15.00 C H -ATOM 2970 CA PHE C 77 51.482 46.665 56.113 1.00 15.00 C C -ATOM 2971 CB PHE C 77 52.615 46.775 55.088 1.00 15.00 C C -ATOM 2972 CG PHE C 77 53.267 48.123 55.001 1.00 15.00 C C -ATOM 2973 CD1 PHE C 77 54.511 48.341 55.572 1.00 15.00 C C -ATOM 2974 CD2 PHE C 77 52.650 49.165 54.330 1.00 15.00 C C -ATOM 2975 CE1 PHE C 77 55.127 49.574 55.477 1.00 15.00 C C -ATOM 2976 CE2 PHE C 77 53.259 50.402 54.233 1.00 15.00 C C -ATOM 2977 CZ PHE C 77 54.500 50.606 54.806 1.00 15.00 C C -ATOM 2978 C PHE C 77 51.011 45.216 56.158 1.00 15.00 C C -ATOM 2979 O PHE C 77 51.797 44.315 56.443 1.00 15.00 C O -ATOM 2980 N VAL C 78 49.734 44.987 55.891 1.00 15.00 C N -ATOM 2981 HN VAL C 78 49.144 45.739 55.667 1.00 15.00 C H -ATOM 2982 CA VAL C 78 49.193 43.632 55.919 1.00 15.00 C C -ATOM 2983 CB VAL C 78 48.071 43.470 56.968 1.00 15.00 C C -ATOM 2984 CG1 VAL C 78 48.622 43.661 58.374 1.00 15.00 C C -ATOM 2985 CG2 VAL C 78 46.927 44.439 56.700 1.00 15.00 C C -ATOM 2986 C VAL C 78 48.683 43.197 54.550 1.00 15.00 C C -ATOM 2987 O VAL C 78 48.357 44.027 53.706 1.00 15.00 C O -ATOM 2988 N LYS C 79 48.627 41.887 54.336 1.00 15.00 C N -ATOM 2989 HN LYS C 79 48.916 41.276 55.046 1.00 15.00 C H -ATOM 2990 CA LYS C 79 48.149 41.334 53.075 1.00 15.00 C C -ATOM 2991 CB LYS C 79 48.844 39.994 52.788 1.00 15.00 C C -ATOM 2992 CG LYS C 79 48.277 39.216 51.608 1.00 15.00 C C -ATOM 2993 CD LYS C 79 48.481 39.954 50.295 1.00 15.00 C C -ATOM 2994 CE LYS C 79 47.565 39.406 49.211 1.00 15.00 C C -ATOM 2995 NZ LYS C 79 46.132 39.697 49.493 1.00 15.00 C N -ATOM 2996 HZ1 LYS C 79 45.983 40.724 49.568 1.00 15.00 C H -ATOM 2997 HZ2 LYS C 79 45.847 39.251 50.389 1.00 15.00 C H -ATOM 2998 HZ3 LYS C 79 45.534 39.324 48.728 1.00 15.00 C H -ATOM 2999 C LYS C 79 46.631 41.163 53.112 1.00 15.00 C C -ATOM 3000 O LYS C 79 45.958 41.216 52.081 1.00 15.00 C O -ATOM 3001 N ASP C 80 46.098 40.971 54.315 1.00 15.00 C N -ATOM 3002 HN ASP C 80 46.687 40.947 55.098 1.00 15.00 C H -ATOM 3003 CA ASP C 80 44.664 40.802 54.503 1.00 15.00 C C -ATOM 3004 CB ASP C 80 44.294 39.313 54.502 1.00 15.00 C C -ATOM 3005 CG ASP C 80 42.825 39.061 54.205 1.00 15.00 C C -ATOM 3006 OD1 ASP C 80 42.452 37.882 54.033 1.00 15.00 C O -ATOM 3007 OD2 ASP C 80 42.048 40.038 54.141 1.00 15.00 C O -ATOM 3008 C ASP C 80 44.220 41.455 55.807 1.00 15.00 C C -ATOM 3009 O ASP C 80 44.673 41.076 56.888 1.00 15.00 C O -ATOM 3010 N LEU C 81 43.336 42.448 55.695 1.00 15.00 C N -ATOM 3011 HN LEU C 81 43.025 42.709 54.803 1.00 15.00 C H -ATOM 3012 CA LEU C 81 42.822 43.156 56.863 1.00 15.00 C C -ATOM 3013 CB LEU C 81 42.247 44.518 56.472 1.00 15.00 C C -ATOM 3014 CG LEU C 81 43.211 45.702 56.530 1.00 15.00 C C -ATOM 3015 CD1 LEU C 81 42.551 46.946 55.964 1.00 15.00 C C -ATOM 3016 CD2 LEU C 81 43.672 45.953 57.958 1.00 15.00 C C -ATOM 3017 C LEU C 81 41.776 42.335 57.608 1.00 15.00 C C -ATOM 3018 O LEU C 81 41.336 42.713 58.692 1.00 15.00 C O -ATOM 3019 N ASN C 82 41.373 41.211 57.014 1.00 15.00 C N -ATOM 3020 HN ASN C 82 41.746 40.973 56.139 1.00 15.00 C H -ATOM 3021 CA ASN C 82 40.396 40.327 57.638 1.00 15.00 C C -ATOM 3022 CB ASN C 82 39.811 39.350 56.613 1.00 15.00 C C -ATOM 3023 CG ASN C 82 38.692 39.957 55.788 1.00 15.00 C C -ATOM 3024 OD1 ASN C 82 37.954 40.824 56.258 1.00 15.00 C O -ATOM 3025 ND2 ASN C 82 38.559 39.501 54.548 1.00 15.00 C N -ATOM 3026 HD21 ASN C 82 39.182 38.810 54.240 1.00 15.00 C H -ATOM 3027 HD22 ASN C 82 37.841 39.872 53.992 1.00 15.00 C H -ATOM 3028 C ASN C 82 41.037 39.563 58.793 1.00 15.00 C C -ATOM 3029 O ASN C 82 40.349 39.010 59.649 1.00 15.00 C O -ATOM 3030 N ASP C 83 42.371 39.552 58.802 1.00 15.00 C N -ATOM 3031 HN ASP C 83 42.851 40.014 58.084 1.00 15.00 C H -ATOM 3032 CA ASP C 83 43.141 38.881 59.843 1.00 15.00 C C -ATOM 3033 CB ASP C 83 44.325 38.129 59.218 1.00 15.00 C C -ATOM 3034 CG ASP C 83 43.953 36.798 58.600 1.00 15.00 C C -ATOM 3035 OD1 ASP C 83 44.599 36.409 57.603 1.00 15.00 C O -ATOM 3036 OD2 ASP C 83 43.027 36.139 59.115 1.00 15.00 C O -ATOM 3037 C ASP C 83 43.701 39.900 60.830 1.00 15.00 C C -ATOM 3038 O ASP C 83 44.558 39.568 61.648 1.00 15.00 C O -ATOM 3039 N PHE C 84 43.207 41.137 60.766 1.00 15.00 C N -ATOM 3040 HN PHE C 84 42.490 41.337 60.127 1.00 15.00 C H -ATOM 3041 CA PHE C 84 43.708 42.195 61.637 1.00 15.00 C C -ATOM 3042 CB PHE C 84 43.400 43.592 61.102 1.00 15.00 C C -ATOM 3043 CG PHE C 84 44.494 44.578 61.401 1.00 15.00 C C -ATOM 3044 CD1 PHE C 84 44.300 45.597 62.319 1.00 15.00 C C -ATOM 3045 CD2 PHE C 84 45.723 44.475 60.771 1.00 15.00 C C -ATOM 3046 CE1 PHE C 84 45.312 46.495 62.601 1.00 15.00 C C -ATOM 3047 CE2 PHE C 84 46.738 45.371 61.047 1.00 15.00 C C -ATOM 3048 CZ PHE C 84 46.532 46.382 61.965 1.00 15.00 C C -ATOM 3049 C PHE C 84 43.294 42.049 63.096 1.00 15.00 C C -ATOM 3050 O PHE C 84 43.967 42.571 63.978 1.00 15.00 C O -ATOM 3051 N ALA C 85 42.188 41.355 63.356 1.00 15.00 C N -ATOM 3052 HN ALA C 85 41.661 40.988 62.615 1.00 15.00 C H -ATOM 3053 CA ALA C 85 41.744 41.141 64.730 1.00 15.00 C C -ATOM 3054 CB ALA C 85 40.382 40.465 64.756 1.00 15.00 C C -ATOM 3055 C ALA C 85 42.778 40.296 65.471 1.00 15.00 C C -ATOM 3056 O ALA C 85 43.055 40.517 66.651 1.00 15.00 C O -ATOM 3057 N THR C 86 43.356 39.341 64.745 1.00 15.00 C N -ATOM 3058 HN THR C 86 43.078 39.224 63.813 1.00 15.00 C H -ATOM 3059 CA THR C 86 44.380 38.458 65.287 1.00 15.00 C C -ATOM 3060 CB THR C 86 44.578 37.231 64.374 1.00 15.00 C C -ATOM 3061 OG1 THR C 86 43.316 36.594 64.145 1.00 15.00 C O -ATOM 3062 HG1 THR C 86 43.462 35.687 63.867 1.00 15.00 C H -ATOM 3063 CG2 THR C 86 45.529 36.230 65.008 1.00 15.00 C C -ATOM 3064 C THR C 86 45.707 39.206 65.415 1.00 15.00 C C -ATOM 3065 O THR C 86 46.431 39.044 66.399 1.00 15.00 C O -ATOM 3066 N VAL C 87 46.013 40.031 64.411 1.00 15.00 C N -ATOM 3067 HN VAL C 87 45.395 40.109 63.655 1.00 15.00 C H -ATOM 3068 CA VAL C 87 47.243 40.820 64.404 1.00 15.00 C C -ATOM 3069 CB VAL C 87 47.443 41.540 63.050 1.00 15.00 C C -ATOM 3070 CG1 VAL C 87 48.614 42.512 63.109 1.00 15.00 C C -ATOM 3071 CG2 VAL C 87 47.655 40.526 61.935 1.00 15.00 C C -ATOM 3072 C VAL C 87 47.233 41.846 65.536 1.00 15.00 C C -ATOM 3073 O VAL C 87 48.248 42.067 66.190 1.00 15.00 C O -ATOM 3074 N ASN C 88 46.070 42.459 65.763 1.00 15.00 C N -ATOM 3075 HN ASN C 88 45.298 42.234 65.202 1.00 15.00 C H -ATOM 3076 CA ASN C 88 45.908 43.457 66.818 1.00 15.00 C C -ATOM 3077 CB ASN C 88 44.521 44.103 66.746 1.00 15.00 C C -ATOM 3078 CG ASN C 88 44.552 45.497 66.156 1.00 15.00 C C -ATOM 3079 OD1 ASN C 88 45.568 46.184 66.214 1.00 15.00 C O -ATOM 3080 ND2 ASN C 88 43.429 45.926 65.590 1.00 15.00 C N -ATOM 3081 HD21 ASN C 88 42.654 45.326 65.585 1.00 15.00 C H -ATOM 3082 HD22 ASN C 88 43.421 46.826 65.201 1.00 15.00 C H -ATOM 3083 C ASN C 88 46.115 42.846 68.197 1.00 15.00 C C -ATOM 3084 O ASN C 88 46.705 43.473 69.075 1.00 15.00 C O -ATOM 3085 N ALA C 89 45.622 41.621 68.380 1.00 15.00 C N -ATOM 3086 HN ALA C 89 45.153 41.182 67.640 1.00 15.00 C H -ATOM 3087 CA ALA C 89 45.754 40.918 69.653 1.00 15.00 C C -ATOM 3088 CB ALA C 89 44.926 39.642 69.648 1.00 15.00 C C -ATOM 3089 C ALA C 89 47.216 40.611 69.963 1.00 15.00 C C -ATOM 3090 O ALA C 89 47.663 40.765 71.099 1.00 15.00 C O -ATOM 3091 N THR C 90 47.956 40.175 68.945 1.00 15.00 C N -ATOM 3092 HN THR C 90 47.535 40.062 68.066 1.00 15.00 C H -ATOM 3093 CA THR C 90 49.373 39.858 69.098 1.00 15.00 C C -ATOM 3094 CB THR C 90 49.904 39.085 67.871 1.00 15.00 C C -ATOM 3095 OG1 THR C 90 49.230 37.825 67.774 1.00 15.00 C O -ATOM 3096 HG1 THR C 90 49.080 37.475 68.655 1.00 15.00 C H -ATOM 3097 CG2 THR C 90 51.404 38.843 67.980 1.00 15.00 C C -ATOM 3098 C THR C 90 50.189 41.136 69.287 1.00 15.00 C C -ATOM 3099 O THR C 90 51.126 41.177 70.085 1.00 15.00 C O -ATOM 3100 N TYR C 91 49.811 42.176 68.547 1.00 15.00 C N -ATOM 3101 HN TYR C 91 49.053 42.066 67.935 1.00 15.00 C H -ATOM 3102 CA TYR C 91 50.478 43.471 68.611 1.00 15.00 C C -ATOM 3103 CB TYR C 91 49.864 44.403 67.559 1.00 15.00 C C -ATOM 3104 CG TYR C 91 50.560 45.734 67.393 1.00 15.00 C C -ATOM 3105 CD1 TYR C 91 51.441 45.951 66.343 1.00 15.00 C C -ATOM 3106 CD2 TYR C 91 50.329 46.777 68.281 1.00 15.00 C C -ATOM 3107 CE1 TYR C 91 52.064 47.173 66.176 1.00 15.00 C C -ATOM 3108 CE2 TYR C 91 50.946 47.999 68.123 1.00 15.00 C C -ATOM 3109 CZ TYR C 91 51.817 48.190 67.074 1.00 15.00 C C -ATOM 3110 OH TYR C 91 52.430 49.407 66.914 1.00 15.00 C O -ATOM 3111 HH TYR C 91 52.661 49.764 67.775 1.00 15.00 C H -ATOM 3112 C TYR C 91 50.330 44.086 70.000 1.00 15.00 C C -ATOM 3113 O TYR C 91 51.296 44.593 70.572 1.00 15.00 C O -ATOM 3114 N GLU C 92 49.111 44.032 70.533 1.00 15.00 C N -ATOM 3115 HN GLU C 92 48.387 43.612 70.022 1.00 15.00 C H -ATOM 3116 CA GLU C 92 48.818 44.577 71.852 1.00 15.00 C C -ATOM 3117 CB GLU C 92 47.309 44.567 72.110 1.00 15.00 C C -ATOM 3118 CG GLU C 92 46.907 45.065 73.488 1.00 15.00 C C -ATOM 3119 CD GLU C 92 45.464 45.528 73.544 1.00 15.00 C C -ATOM 3120 OE1 GLU C 92 45.141 46.343 74.433 1.00 15.00 C O -ATOM 3121 OE2 GLU C 92 44.660 45.081 72.699 1.00 15.00 C O -ATOM 3122 C GLU C 92 49.542 43.796 72.940 1.00 15.00 C C -ATOM 3123 O GLU C 92 50.112 44.384 73.857 1.00 15.00 C O -ATOM 3124 N ALA C 93 49.520 42.470 72.821 1.00 15.00 C N -ATOM 3125 HN ALA C 93 49.050 42.067 72.060 1.00 15.00 C H -ATOM 3126 CA ALA C 93 50.175 41.603 73.789 1.00 15.00 C C -ATOM 3127 CB ALA C 93 49.889 40.142 73.479 1.00 15.00 C C -ATOM 3128 C ALA C 93 51.677 41.857 73.821 1.00 15.00 C C -ATOM 3129 O ALA C 93 52.275 41.910 74.890 1.00 15.00 C O -ATOM 3130 N PHE C 94 52.269 42.033 72.641 1.00 15.00 C N -ATOM 3131 HN PHE C 94 51.723 41.992 71.828 1.00 15.00 C H -ATOM 3132 CA PHE C 94 53.702 42.283 72.515 1.00 15.00 C C -ATOM 3133 CB PHE C 94 54.085 42.432 71.038 1.00 15.00 C C -ATOM 3134 CG PHE C 94 55.562 42.574 70.792 1.00 15.00 C C -ATOM 3135 CD1 PHE C 94 56.384 41.458 70.761 1.00 15.00 C C -ATOM 3136 CD2 PHE C 94 56.128 43.823 70.590 1.00 15.00 C C -ATOM 3137 CE1 PHE C 94 57.741 41.585 70.533 1.00 15.00 C C -ATOM 3138 CE2 PHE C 94 57.484 43.956 70.362 1.00 15.00 C C -ATOM 3139 CZ PHE C 94 58.293 42.836 70.334 1.00 15.00 C C -ATOM 3140 C PHE C 94 54.138 43.519 73.302 1.00 15.00 C C -ATOM 3141 O PHE C 94 55.101 43.466 74.062 1.00 15.00 C O -ATOM 3142 N PHE C 95 53.418 44.626 73.125 1.00 15.00 C N -ATOM 3143 HN PHE C 95 52.649 44.606 72.517 1.00 15.00 C H -ATOM 3144 CA PHE C 95 53.750 45.870 73.818 1.00 15.00 C C -ATOM 3145 CB PHE C 95 53.105 47.079 73.136 1.00 15.00 C C -ATOM 3146 CG PHE C 95 53.817 47.495 71.879 1.00 15.00 C C -ATOM 3147 CD1 PHE C 95 53.444 46.976 70.650 1.00 15.00 C C -ATOM 3148 CD2 PHE C 95 54.871 48.391 71.929 1.00 15.00 C C -ATOM 3149 CE1 PHE C 95 54.104 47.348 69.496 1.00 15.00 C C -ATOM 3150 CE2 PHE C 95 55.534 48.769 70.778 1.00 15.00 C C -ATOM 3151 CZ PHE C 95 55.153 48.243 69.559 1.00 15.00 C C -ATOM 3152 C PHE C 95 53.419 45.822 75.311 1.00 15.00 C C -ATOM 3153 O PHE C 95 54.079 46.478 76.116 1.00 15.00 C O -ATOM 3154 N THR C 96 52.402 45.042 75.677 1.00 15.00 C N -ATOM 3155 HN THR C 96 51.901 44.555 74.990 1.00 15.00 C H -ATOM 3156 CA THR C 96 52.014 44.898 77.079 1.00 15.00 C C -ATOM 3157 CB THR C 96 50.633 44.216 77.216 1.00 15.00 C C -ATOM 3158 OG1 THR C 96 49.630 45.041 76.612 1.00 15.00 C O -ATOM 3159 HG1 THR C 96 49.193 45.563 77.289 1.00 15.00 C H -ATOM 3160 CG2 THR C 96 50.271 43.990 78.679 1.00 15.00 C C -ATOM 3161 C THR C 96 53.068 44.084 77.832 1.00 15.00 C C -ATOM 3162 O THR C 96 53.340 44.329 79.009 1.00 15.00 C O -ATOM 3163 N GLU C 97 53.670 43.127 77.122 1.00 15.00 C N -ATOM 3164 HN GLU C 97 53.405 42.997 76.188 1.00 15.00 C H -ATOM 3165 CA GLU C 97 54.708 42.266 77.686 1.00 15.00 C C -ATOM 3166 CB GLU C 97 55.085 41.175 76.678 1.00 15.00 C C -ATOM 3167 CG GLU C 97 54.059 40.063 76.527 1.00 15.00 C C -ATOM 3168 CD GLU C 97 54.125 39.392 75.168 1.00 15.00 C C -ATOM 3169 OE1 GLU C 97 55.154 39.546 74.474 1.00 15.00 C O -ATOM 3170 OE2 GLU C 97 53.145 38.715 74.794 1.00 15.00 C O -ATOM 3171 C GLU C 97 55.960 43.061 78.040 1.00 15.00 C C -ATOM 3172 O GLU C 97 56.723 42.675 78.924 1.00 15.00 C O -ATOM 3173 N HIS C 98 56.164 44.173 77.343 1.00 15.00 C N -ATOM 3174 HN HIS C 98 55.511 44.438 76.662 1.00 15.00 C H -ATOM 3175 CA HIS C 98 57.333 45.010 77.572 1.00 15.00 C C -ATOM 3176 CB HIS C 98 57.963 45.416 76.237 1.00 15.00 C C -ATOM 3177 CG HIS C 98 58.538 44.266 75.471 1.00 15.00 C C -ATOM 3178 ND1 HIS C 98 57.833 43.528 74.546 1.00 15.00 C N -ATOM 3179 HD1 HIS C 98 56.897 43.668 74.288 1.00 15.00 C H -ATOM 3180 CD2 HIS C 98 59.778 43.722 75.512 1.00 15.00 C C -ATOM 3181 CE1 HIS C 98 58.648 42.582 74.067 1.00 15.00 C C -ATOM 3182 NE2 HIS C 98 59.841 42.657 74.621 1.00 15.00 C N -ATOM 3183 C HIS C 98 57.003 46.249 78.398 1.00 15.00 C C -ATOM 3184 O HIS C 98 57.846 47.137 78.538 1.00 15.00 C O -ATOM 3185 N ASN C 99 55.780 46.294 78.952 1.00 15.00 C N -ATOM 3186 HN ASN C 99 55.167 45.542 78.813 1.00 15.00 C H -ATOM 3187 CA ASN C 99 55.331 47.434 79.763 1.00 15.00 C C -ATOM 3188 CB ASN C 99 56.069 47.444 81.108 1.00 15.00 C C -ATOM 3189 CG ASN C 99 55.491 48.427 82.107 1.00 15.00 C C -ATOM 3190 OD1 ASN C 99 54.281 48.650 82.155 1.00 15.00 C O -ATOM 3191 ND2 ASN C 99 56.363 49.030 82.909 1.00 15.00 C N -ATOM 3192 HD21 ASN C 99 57.312 48.807 82.810 1.00 15.00 C H -ATOM 3193 HD22 ASN C 99 56.023 49.674 83.564 1.00 15.00 C H -ATOM 3194 C ASN C 99 55.574 48.735 78.997 1.00 15.00 C C -ATOM 3195 O ASN C 99 56.085 49.717 79.538 1.00 15.00 C O -ATOM 3196 N ALA C 100 55.195 48.723 77.727 1.00 15.00 C N -ATOM 3197 HN ALA C 100 54.754 47.925 77.369 1.00 15.00 C H -ATOM 3198 CA ALA C 100 55.411 49.859 76.853 1.00 15.00 C C -ATOM 3199 CB ALA C 100 56.167 49.392 75.623 1.00 15.00 C C -ATOM 3200 C ALA C 100 54.118 50.527 76.420 1.00 15.00 C C -ATOM 3201 O ALA C 100 53.103 49.866 76.192 1.00 15.00 C O -ATOM 3202 N THR C 101 54.174 51.850 76.307 1.00 15.00 C N -ATOM 3203 HN THR C 101 55.005 52.313 76.535 1.00 15.00 C H -ATOM 3204 CA THR C 101 53.035 52.628 75.858 1.00 15.00 C C -ATOM 3205 CB THR C 101 53.253 54.133 76.132 1.00 15.00 C C -ATOM 3206 OG1 THR C 101 53.406 54.348 77.539 1.00 15.00 C O -ATOM 3207 HG1 THR C 101 54.339 54.356 77.762 1.00 15.00 C H -ATOM 3208 CG2 THR C 101 52.078 54.960 75.622 1.00 15.00 C C -ATOM 3209 C THR C 101 52.874 52.419 74.360 1.00 15.00 C C -ATOM 3210 O THR C 101 53.857 52.455 73.616 1.00 15.00 C O -ATOM 3211 N PHE C 102 51.646 52.170 73.926 1.00 15.00 C N -ATOM 3212 HN PHE C 102 50.910 52.131 74.570 1.00 15.00 C H -ATOM 3213 CA PHE C 102 51.367 51.952 72.514 1.00 15.00 C C -ATOM 3214 CB PHE C 102 49.872 51.728 72.298 1.00 15.00 C C -ATOM 3215 CG PHE C 102 49.319 50.582 73.095 1.00 15.00 C C -ATOM 3216 CD1 PHE C 102 48.181 50.742 73.868 1.00 15.00 C C -ATOM 3217 CD2 PHE C 102 49.942 49.344 73.075 1.00 15.00 C C -ATOM 3218 CE1 PHE C 102 47.673 49.689 74.605 1.00 15.00 C C -ATOM 3219 CE2 PHE C 102 49.440 48.287 73.808 1.00 15.00 C C -ATOM 3220 CZ PHE C 102 48.303 48.459 74.576 1.00 15.00 C C -ATOM 3221 C PHE C 102 51.859 53.125 71.677 1.00 15.00 C C -ATOM 3222 O PHE C 102 51.595 54.281 71.998 1.00 15.00 C O -ATOM 3223 N PRO C 103 52.608 52.844 70.606 1.00 15.00 C N -ATOM 3224 CA PRO C 103 53.147 53.870 69.725 1.00 15.00 C C -ATOM 3225 CB PRO C 103 54.333 53.162 69.042 1.00 15.00 C C -ATOM 3226 CG PRO C 103 54.318 51.741 69.514 1.00 15.00 C C -ATOM 3227 CD PRO C 103 52.988 51.502 70.163 1.00 15.00 C C -ATOM 3228 C PRO C 103 52.133 54.278 68.667 1.00 15.00 C C -ATOM 3229 O PRO C 103 51.136 53.585 68.459 1.00 15.00 C O -ATOM 3230 N ALA C 104 52.363 55.430 68.037 1.00 15.00 C N -ATOM 3231 HN ALA C 104 53.122 55.987 68.316 1.00 15.00 C H -ATOM 3232 CA ALA C 104 51.492 55.890 66.961 1.00 15.00 C C -ATOM 3233 CB ALA C 104 51.918 57.273 66.492 1.00 15.00 C C -ATOM 3234 C ALA C 104 51.595 54.886 65.817 1.00 15.00 C C -ATOM 3235 O ALA C 104 52.660 54.308 65.603 1.00 15.00 C O -ATOM 3236 N ARG C 105 50.513 54.644 65.092 1.00 15.00 C N -ATOM 3237 HN ARG C 105 49.671 55.115 65.276 1.00 15.00 C H -ATOM 3238 CA ARG C 105 50.586 53.658 64.032 1.00 15.00 C C -ATOM 3239 CB ARG C 105 50.456 52.247 64.639 1.00 15.00 C C -ATOM 3240 CG ARG C 105 49.451 51.347 63.956 1.00 15.00 C C -ATOM 3241 CD ARG C 105 48.317 50.991 64.897 1.00 15.00 C C -ATOM 3242 NE ARG C 105 48.581 49.799 65.711 1.00 15.00 C N -ATOM 3243 HE ARG C 105 49.407 49.785 66.243 1.00 15.00 C H -ATOM 3244 CZ ARG C 105 47.739 48.753 65.765 1.00 15.00 C C -ATOM 3245 NH1 ARG C 105 46.627 48.770 65.049 1.00 15.00 C N -ATOM 3246 HH11 ARG C 105 46.409 49.585 64.451 1.00 15.00 C H -ATOM 3247 HH12 ARG C 105 45.977 47.965 65.073 1.00 15.00 C H -ATOM 3248 NH2 ARG C 105 47.959 47.739 66.590 1.00 15.00 C N -ATOM 3249 HH21 ARG C 105 47.297 46.930 66.619 1.00 15.00 C H -ATOM 3250 HH22 ARG C 105 48.784 47.754 67.224 1.00 15.00 C H -ATOM 3251 C ARG C 105 49.621 53.881 62.849 1.00 15.00 C C -ATOM 3252 O ARG C 105 48.513 54.413 62.993 1.00 15.00 C O -ATOM 3253 N SER C 106 50.096 53.477 61.668 1.00 15.00 C N -ATOM 3254 HN SER C 106 51.008 53.124 61.627 1.00 15.00 C H -ATOM 3255 CA SER C 106 49.322 53.536 60.436 1.00 15.00 C C -ATOM 3256 CB SER C 106 50.049 54.354 59.366 1.00 15.00 C C -ATOM 3257 OG SER C 106 50.037 55.736 59.684 1.00 15.00 C O -ATOM 3258 HG SER C 106 50.779 55.950 60.255 1.00 15.00 C H -ATOM 3259 C SER C 106 49.115 52.102 59.969 1.00 15.00 C C -ATOM 3260 O SER C 106 50.040 51.291 60.041 1.00 15.00 C O -ATOM 3261 N CSP C 107 47.904 51.778 59.534 1.00 15.00 C N -ATOM 3262 HN CSP C 107 47.209 52.463 59.501 1.00 15.00 C H -ATOM 3263 CA CSP C 107 47.584 50.413 59.118 1.00 15.00 C C -ATOM 3264 CB CSP C 107 46.660 49.759 60.174 0.67 15.00 C C -ATOM 3265 SG CSP C 107 46.825 50.433 61.859 0.67 15.00 C S -ATOM 3266 P CSP C 107 44.988 51.446 62.012 0.67 15.00 C P -ATOM 3267 O1P CSP C 107 45.207 51.590 60.552 0.67 15.00 C O -ATOM 3268 O2P CSP C 107 43.586 50.963 62.021 0.67 15.00 C O -ATOM 3269 O3P CSP C 107 45.250 50.425 63.235 0.67 15.00 C O -ATOM 3270 C CSP C 107 46.912 50.378 57.743 1.00 15.00 C C -ATOM 3271 O CSP C 107 45.855 50.975 57.548 1.00 15.00 C O -ATOM 3272 N VAL C 108 47.527 49.674 56.791 1.00 15.00 C N -ATOM 3273 HN VAL C 108 48.367 49.223 57.003 1.00 15.00 C H -ATOM 3274 CA VAL C 108 46.968 49.560 55.435 1.00 15.00 C C -ATOM 3275 CB VAL C 108 47.580 50.581 54.439 1.00 15.00 C C -ATOM 3276 CG1 VAL C 108 47.333 52.012 54.871 1.00 15.00 C C -ATOM 3277 CG2 VAL C 108 49.066 50.320 54.219 1.00 15.00 C C -ATOM 3278 C VAL C 108 47.162 48.155 54.858 1.00 15.00 C C -ATOM 3279 O VAL C 108 48.108 47.455 55.218 1.00 15.00 C O -ATOM 3280 N GLU C 109 46.259 47.747 53.962 1.00 15.00 C N -ATOM 3281 HN GLU C 109 45.512 48.341 53.732 1.00 15.00 C H -ATOM 3282 CA GLU C 109 46.355 46.440 53.313 1.00 15.00 C C -ATOM 3283 CB GLU C 109 44.976 45.779 53.198 1.00 15.00 C C -ATOM 3284 CG GLU C 109 45.005 44.352 52.662 1.00 15.00 C C -ATOM 3285 CD GLU C 109 43.635 43.857 52.238 1.00 15.00 C C -ATOM 3286 OE1 GLU C 109 43.467 43.515 51.049 1.00 15.00 C O -ATOM 3287 OE2 GLU C 109 42.728 43.811 53.096 1.00 15.00 C O -ATOM 3288 C GLU C 109 46.962 46.623 51.928 1.00 15.00 C C -ATOM 3289 O GLU C 109 46.423 47.354 51.105 1.00 15.00 C O -ATOM 3290 N VAL C 110 48.090 45.974 51.680 1.00 15.00 C N -ATOM 3291 HN VAL C 110 48.475 45.399 52.375 1.00 15.00 C H -ATOM 3292 CA VAL C 110 48.769 46.093 50.395 1.00 15.00 C C -ATOM 3293 CB VAL C 110 50.297 46.194 50.572 1.00 15.00 C C -ATOM 3294 CG1 VAL C 110 50.653 47.467 51.328 1.00 15.00 C C -ATOM 3295 CG2 VAL C 110 50.827 44.969 51.302 1.00 15.00 C C -ATOM 3296 C VAL C 110 48.435 44.935 49.464 1.00 15.00 C C -ATOM 3297 O VAL C 110 47.776 43.969 49.862 1.00 15.00 C O -ATOM 3298 N ALA C 111 48.882 45.050 48.218 1.00 15.00 C N -ATOM 3299 HN ALA C 111 49.389 45.847 47.964 1.00 15.00 C H -ATOM 3300 CA ALA C 111 48.644 44.022 47.228 1.00 15.00 C C -ATOM 3301 CB ALA C 111 49.006 44.518 45.831 1.00 15.00 C C -ATOM 3302 C ALA C 111 49.450 42.788 47.566 1.00 15.00 C C -ATOM 3303 O ALA C 111 48.926 41.672 47.606 1.00 15.00 C O -ATOM 3304 N ARG C 112 50.736 42.989 47.789 1.00 15.00 C N -ATOM 3305 HN ARG C 112 51.112 43.892 47.704 1.00 15.00 C H -ATOM 3306 CA ARG C 112 51.604 41.892 48.118 1.00 15.00 C C -ATOM 3307 CB ARG C 112 52.014 41.182 46.832 1.00 15.00 C C -ATOM 3308 CG ARG C 112 52.379 39.738 47.063 1.00 15.00 C C -ATOM 3309 CD ARG C 112 53.678 39.401 46.384 1.00 15.00 C C -ATOM 3310 NE ARG C 112 53.505 39.191 44.960 1.00 15.00 C N -ATOM 3311 HE ARG C 112 52.788 39.701 44.495 1.00 15.00 C H -ATOM 3312 CZ ARG C 112 54.270 38.355 44.269 1.00 15.00 C C -ATOM 3313 NH1 ARG C 112 55.248 37.679 44.889 1.00 15.00 C N -ATOM 3314 HH11 ARG C 112 55.395 37.811 45.909 1.00 15.00 C H -ATOM 3315 HH12 ARG C 112 55.855 37.020 44.364 1.00 15.00 C H -ATOM 3316 NH2 ARG C 112 54.062 38.205 42.982 1.00 15.00 C N -ATOM 3317 HH21 ARG C 112 53.296 38.743 42.522 1.00 15.00 C H -ATOM 3318 HH22 ARG C 112 54.653 37.556 42.426 1.00 15.00 C H -ATOM 3319 C ARG C 112 52.838 42.372 48.891 1.00 15.00 C C -ATOM 3320 O ARG C 112 53.225 43.541 48.798 1.00 15.00 C O -ATOM 3321 N LEU C 113 53.463 41.462 49.644 1.00 15.00 C N -ATOM 3322 HN LEU C 113 53.118 40.547 49.674 1.00 15.00 C H -ATOM 3323 CA LEU C 113 54.651 41.784 50.428 1.00 15.00 C C -ATOM 3324 CB LEU C 113 54.337 41.627 51.919 1.00 15.00 C C -ATOM 3325 CG LEU C 113 53.379 42.663 52.511 1.00 15.00 C C -ATOM 3326 CD1 LEU C 113 52.817 42.196 53.843 1.00 15.00 C C -ATOM 3327 CD2 LEU C 113 54.074 44.002 52.665 1.00 15.00 C C -ATOM 3328 C LEU C 113 55.812 40.871 50.030 1.00 15.00 C C -ATOM 3329 O LEU C 113 55.588 39.812 49.444 1.00 15.00 C O -ATOM 3330 N PRO C 114 57.067 41.278 50.323 1.00 15.00 C N -ATOM 3331 CA PRO C 114 58.259 40.483 49.996 1.00 15.00 C C -ATOM 3332 CB PRO C 114 59.392 41.241 50.690 1.00 15.00 C C -ATOM 3333 CG PRO C 114 58.903 42.645 50.765 1.00 15.00 C C -ATOM 3334 CD PRO C 114 57.423 42.550 50.981 1.00 15.00 C C -ATOM 3335 C PRO C 114 58.167 39.060 50.538 1.00 15.00 C C -ATOM 3336 O PRO C 114 57.872 38.855 51.719 1.00 15.00 C O -ATOM 3337 N LYS C 115 58.406 38.088 49.651 1.00 15.00 C N -ATOM 3338 HN LYS C 115 58.628 38.340 48.730 1.00 15.00 C H -ATOM 3339 CA LYS C 115 58.353 36.664 49.996 1.00 15.00 C C -ATOM 3340 CB LYS C 115 59.257 36.329 51.188 1.00 15.00 C C -ATOM 3341 CG LYS C 115 60.738 36.564 50.937 1.00 15.00 C C -ATOM 3342 CD LYS C 115 61.565 36.185 52.152 1.00 15.00 C C -ATOM 3343 CE LYS C 115 63.048 36.174 51.829 1.00 15.00 C C -ATOM 3344 NZ LYS C 115 63.684 34.883 52.209 1.00 15.00 C N -ATOM 3345 HZ1 LYS C 115 63.242 34.100 51.686 1.00 15.00 C H -ATOM 3346 HZ2 LYS C 115 63.566 34.713 53.228 1.00 15.00 C H -ATOM 3347 HZ3 LYS C 115 64.700 34.905 51.988 1.00 15.00 C H -ATOM 3348 C LYS C 115 56.923 36.177 50.242 1.00 15.00 C C -ATOM 3349 O LYS C 115 56.719 35.110 50.822 1.00 15.00 C O -ATOM 3350 N ASP C 116 55.941 36.967 49.789 1.00 15.00 C N -ATOM 3351 HN ASP C 116 56.180 37.803 49.338 1.00 15.00 C H -ATOM 3352 CA ASP C 116 54.521 36.635 49.944 1.00 15.00 C C -ATOM 3353 CB ASP C 116 54.159 35.341 49.205 1.00 15.00 C C -ATOM 3354 CG ASP C 116 53.959 35.551 47.718 1.00 15.00 C C -ATOM 3355 OD1 ASP C 116 54.926 35.354 46.954 1.00 15.00 C O -ATOM 3356 OD2 ASP C 116 52.832 35.911 47.316 1.00 15.00 C O -ATOM 3357 C ASP C 116 54.092 36.557 51.407 1.00 15.00 C C -ATOM 3358 O ASP C 116 53.166 35.819 51.751 1.00 15.00 C O -ATOM 3359 N VAL C 117 54.754 37.331 52.266 1.00 15.00 C N -ATOM 3360 HN VAL C 117 55.476 37.906 51.937 1.00 15.00 C H -ATOM 3361 CA VAL C 117 54.423 37.337 53.688 1.00 15.00 C C -ATOM 3362 CB VAL C 117 55.533 37.960 54.560 1.00 15.00 C C -ATOM 3363 CG1 VAL C 117 56.821 37.159 54.438 1.00 15.00 C C -ATOM 3364 CG2 VAL C 117 55.769 39.417 54.193 1.00 15.00 C C -ATOM 3365 C VAL C 117 53.091 38.035 53.945 1.00 15.00 C C -ATOM 3366 O VAL C 117 52.565 38.734 53.078 1.00 15.00 C O -ATOM 3367 N LYS C 118 52.551 37.841 55.140 1.00 15.00 C N -ATOM 3368 HN LYS C 118 53.025 37.286 55.795 1.00 15.00 C H -ATOM 3369 CA LYS C 118 51.269 38.430 55.502 1.00 15.00 C C -ATOM 3370 CB LYS C 118 50.427 37.427 56.297 1.00 15.00 C C -ATOM 3371 CG LYS C 118 50.182 36.107 55.586 1.00 15.00 C C -ATOM 3372 CD LYS C 118 49.528 35.102 56.519 1.00 15.00 C C -ATOM 3373 CE LYS C 118 49.313 33.760 55.837 1.00 15.00 C C -ATOM 3374 NZ LYS C 118 48.711 32.765 56.764 1.00 15.00 C N -ATOM 3375 HZ1 LYS C 118 49.349 32.594 57.569 1.00 15.00 C H -ATOM 3376 HZ2 LYS C 118 48.549 31.865 56.269 1.00 15.00 C H -ATOM 3377 HZ3 LYS C 118 47.802 33.117 57.127 1.00 15.00 C H -ATOM 3378 C LYS C 118 51.407 39.731 56.292 1.00 15.00 C C -ATOM 3379 O LYS C 118 50.401 40.381 56.583 1.00 15.00 C O -ATOM 3380 N ILE C 119 52.636 40.123 56.639 1.00 15.00 C N -ATOM 3381 HN ILE C 119 53.413 39.585 56.380 1.00 15.00 C H -ATOM 3382 CA ILE C 119 52.827 41.354 57.406 1.00 15.00 C C -ATOM 3383 CB ILE C 119 52.383 41.177 58.881 1.00 15.00 C C -ATOM 3384 CG1 ILE C 119 52.301 42.528 59.600 1.00 15.00 C C -ATOM 3385 CG2 ILE C 119 53.306 40.218 59.622 1.00 15.00 C C -ATOM 3386 CD1 ILE C 119 51.683 42.453 60.977 1.00 15.00 C C -ATOM 3387 C ILE C 119 54.256 41.909 57.352 1.00 15.00 C C -ATOM 3388 O ILE C 119 55.234 41.165 57.289 1.00 15.00 C O -ATOM 3389 N GLU C 120 54.346 43.238 57.359 1.00 15.00 C N -ATOM 3390 HN GLU C 120 53.517 43.762 57.356 1.00 15.00 C H -ATOM 3391 CA GLU C 120 55.619 43.953 57.359 1.00 15.00 C C -ATOM 3392 CB GLU C 120 55.985 44.427 55.952 1.00 15.00 C C -ATOM 3393 CG GLU C 120 57.368 45.051 55.862 1.00 15.00 C C -ATOM 3394 CD GLU C 120 57.699 45.543 54.470 1.00 15.00 C C -ATOM 3395 OE1 GLU C 120 58.306 46.628 54.352 1.00 15.00 C O -ATOM 3396 OE2 GLU C 120 57.348 44.844 53.500 1.00 15.00 C O -ATOM 3397 C GLU C 120 55.495 45.149 58.297 1.00 15.00 C C -ATOM 3398 O GLU C 120 54.576 45.955 58.157 1.00 15.00 C O -ATOM 3399 N ILE C 121 56.409 45.268 59.254 1.00 15.00 C N -ATOM 3400 HN ILE C 121 57.141 44.619 59.310 1.00 15.00 C H -ATOM 3401 CA ILE C 121 56.333 46.358 60.222 1.00 15.00 C C -ATOM 3402 CB ILE C 121 55.950 45.834 61.627 1.00 15.00 C C -ATOM 3403 CG1 ILE C 121 54.690 44.964 61.560 1.00 15.00 C C -ATOM 3404 CG2 ILE C 121 55.748 46.989 62.599 1.00 15.00 C C -ATOM 3405 CD1 ILE C 121 54.411 44.187 62.827 1.00 15.00 C C -ATOM 3406 C ILE C 121 57.620 47.176 60.338 1.00 15.00 C C -ATOM 3407 O ILE C 121 58.683 46.646 60.660 1.00 15.00 C O -ATOM 3408 N GLU C 122 57.502 48.475 60.065 1.00 15.00 C N -ATOM 3409 HN GLU C 122 56.638 48.817 59.758 1.00 15.00 C H -ATOM 3410 CA GLU C 122 58.620 49.406 60.205 1.00 15.00 C C -ATOM 3411 CB GLU C 122 58.720 50.344 58.994 1.00 15.00 C C -ATOM 3412 CG GLU C 122 57.482 51.195 58.750 1.00 15.00 C C -ATOM 3413 CD GLU C 122 57.739 52.364 57.815 1.00 15.00 C C -ATOM 3414 OE1 GLU C 122 56.967 53.343 57.865 1.00 15.00 C O -ATOM 3415 OE2 GLU C 122 58.711 52.305 57.036 1.00 15.00 C O -ATOM 3416 C GLU C 122 58.388 50.206 61.485 1.00 15.00 C C -ATOM 3417 O GLU C 122 57.239 50.419 61.872 1.00 15.00 C O -ATOM 3418 N ALA C 123 59.450 50.649 62.151 1.00 15.00 C N -ATOM 3419 HN ALA C 123 60.351 50.485 61.803 1.00 15.00 C H -ATOM 3420 CA ALA C 123 59.272 51.383 63.401 1.00 15.00 C C -ATOM 3421 CB ALA C 123 59.278 50.425 64.583 1.00 15.00 C C -ATOM 3422 C ALA C 123 60.282 52.503 63.621 1.00 15.00 C C -ATOM 3423 O ALA C 123 61.398 52.479 63.100 1.00 15.00 C O -ATOM 3424 N ILE C 124 59.854 53.481 64.415 1.00 15.00 C N -ATOM 3425 HN ILE C 124 58.943 53.426 64.771 1.00 15.00 C H -ATOM 3426 CA ILE C 124 60.669 54.633 64.774 1.00 15.00 C C -ATOM 3427 CB ILE C 124 60.056 55.939 64.211 1.00 15.00 C C -ATOM 3428 CG1 ILE C 124 60.054 55.915 62.677 1.00 15.00 C C -ATOM 3429 CG2 ILE C 124 60.798 57.163 64.732 1.00 15.00 C C -ATOM 3430 CD1 ILE C 124 59.380 57.110 62.040 1.00 15.00 C C -ATOM 3431 C ILE C 124 60.743 54.729 66.299 1.00 15.00 C C -ATOM 3432 O ILE C 124 59.716 54.745 66.973 1.00 15.00 C O -ATOM 3433 N ALA C 125 61.957 54.777 66.838 1.00 15.00 C N -ATOM 3434 HN ALA C 125 62.742 54.764 66.251 1.00 15.00 C H -ATOM 3435 CA ALA C 125 62.152 54.856 68.284 1.00 15.00 C C -ATOM 3436 CB ALA C 125 62.795 53.576 68.797 1.00 15.00 C C -ATOM 3437 C ALA C 125 62.999 56.066 68.662 1.00 15.00 C C -ATOM 3438 O ALA C 125 63.778 56.559 67.854 1.00 15.00 C O -ATOM 3439 N VAL C 126 62.842 56.544 69.892 1.00 15.00 C N -ATOM 3440 HN VAL C 126 62.205 56.113 70.498 1.00 15.00 C H -ATOM 3441 CA VAL C 126 63.602 57.701 70.363 1.00 15.00 C C -ATOM 3442 CB VAL C 126 62.748 58.989 70.410 1.00 15.00 C C -ATOM 3443 CG1 VAL C 126 62.443 59.488 69.007 1.00 15.00 C C -ATOM 3444 CG2 VAL C 126 61.463 58.759 71.193 1.00 15.00 C C -ATOM 3445 C VAL C 126 64.215 57.451 71.738 1.00 15.00 C C -ATOM 3446 O VAL C 126 63.678 56.690 72.541 1.00 15.00 C O -ATOM 3447 N ARG C 127 65.350 58.096 71.998 1.00 15.00 C N -ATOM 3448 HN ARG C 127 65.736 58.679 71.311 1.00 15.00 C H -ATOM 3449 CA ARG C 127 66.039 57.953 73.277 1.00 15.00 C C -ATOM 3450 CB ARG C 127 67.532 58.254 73.123 1.00 15.00 C C -ATOM 3451 CG ARG C 127 68.212 57.460 72.016 1.00 15.00 C C -ATOM 3452 CD ARG C 127 69.727 57.522 72.138 1.00 15.00 C C -ATOM 3453 NE ARG C 127 70.399 56.783 71.067 1.00 15.00 C N -ATOM 3454 HE ARG C 127 70.629 57.278 70.252 1.00 15.00 C H -ATOM 3455 CZ ARG C 127 70.709 55.492 71.136 1.00 15.00 C C -ATOM 3456 NH1 ARG C 127 70.401 54.789 72.217 1.00 15.00 C N -ATOM 3457 HH11 ARG C 127 69.918 55.249 73.016 1.00 15.00 C H -ATOM 3458 HH12 ARG C 127 70.643 53.780 72.266 1.00 15.00 C H -ATOM 3459 NH2 ARG C 127 71.333 54.905 70.126 1.00 15.00 C N -ATOM 3460 HH21 ARG C 127 71.573 53.894 70.181 1.00 15.00 C H -ATOM 3461 HH22 ARG C 127 71.584 55.452 69.276 1.00 15.00 C H -ATOM 3462 C ARG C 127 65.407 58.853 74.339 1.00 15.00 C C -ATOM 3463 O ARG C 127 65.282 58.464 75.500 1.00 15.00 C O -ATOM 3464 N ARG C 128 65.012 60.058 73.932 1.00 15.00 C N -ATOM 3465 HN ARG C 128 65.157 60.316 72.997 1.00 15.00 C H -ATOM 3466 CA ARG C 128 64.374 61.008 74.841 1.00 15.00 C C -ATOM 3467 CB ARG C 128 65.060 62.376 74.775 1.00 15.00 C C -ATOM 3468 CG ARG C 128 66.352 62.464 75.574 1.00 15.00 C C -ATOM 3469 CD ARG C 128 67.134 63.721 75.223 1.00 15.00 C C -ATOM 3470 NE ARG C 128 66.824 64.847 76.105 1.00 15.00 C N -ATOM 3471 HE ARG C 128 66.302 64.661 76.915 1.00 15.00 C H -ATOM 3472 CZ ARG C 128 67.208 66.100 75.863 1.00 15.00 C C -ATOM 3473 NH1 ARG C 128 67.903 66.382 74.768 1.00 15.00 C N -ATOM 3474 HH11 ARG C 128 68.202 67.360 74.580 1.00 15.00 C H -ATOM 3475 HH12 ARG C 128 68.147 65.625 74.098 1.00 15.00 C H -ATOM 3476 NH2 ARG C 128 66.919 67.066 76.725 1.00 15.00 C N -ATOM 3477 HH21 ARG C 128 66.392 66.848 77.594 1.00 15.00 C H -ATOM 3478 HH22 ARG C 128 67.222 68.044 76.533 1.00 15.00 C H -ATOM 3479 C ARG C 128 62.891 61.153 74.518 1.00 15.00 C C -ATOM 3480 O ARG C 128 62.505 61.235 73.351 1.00 15.00 C O -END diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.psf b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.psf deleted file mode 100644 index 46b78afa2..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/homotrimer_haddock.psf +++ /dev/null @@ -1,26846 +0,0 @@ -data_cns_mtf - -_cns_mtf.title -; FILENAME="homotrimer_haddock.psf" - Patching histidine 98 to HISD - Patching histidine 98 to HISD - Patching histidine 98 to HISD - DATE:01-Oct-2024 16:32:31 created by user: unknown - VERSION:1.3U -; - -loop_ -_cns_mtf_atom.id -_cns_mtf_atom.segment_id -_cns_mtf_atom.residue_id -_cns_mtf_atom.residue_name -_cns_mtf_atom.atom_name -_cns_mtf_atom.chemical_type -_cns_mtf_atom.charge -_cns_mtf_atom.atom_mass -1 'A' '2' 'SER' 'N' 'NH1' -0.570000 14.0070 -2 'A' '2' 'SER' 'HN' 'H' 0.370000 1.00800 -3 'A' '2' 'SER' 'CA' 'CH1E' 0.200000 12.0110 -4 'A' '2' 'SER' 'CB' 'CH2E' 0.265000 12.0110 -5 'A' '2' 'SER' 'OG' 'OH1' -0.700000 15.9990 -6 'A' '2' 'SER' 'HG' 'H' 0.435000 1.00800 -7 'A' '2' 'SER' 'C' 'C' 0.500000 12.0110 -8 'A' '2' 'SER' 'O' 'O' -0.500000 15.9990 -9 'A' '3' 'LYS' 'N' 'NH1' -0.570000 14.0070 -10 'A' '3' 'LYS' 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"homotrimer_haddock.psf", - "md5": null, - "path": "/Users/vreys/Desktop/HADDOCK3/haddock3-dev/examples/thirdparty/prodigy/run-prodigy-prot-prot/0_topoaa", - "py/object": "haddock.libs.libontology.TopologyFile", - "rel_path": { - "py/reduce": [ - { - "py/type": "pathlib.PosixPath" - }, - { - "py/tuple": [ - "..", - "0_topoaa", - "homotrimer_haddock.psf" - ] - } - ] - }, - "restr_fname": null - }, - "unw_energies": null - } - } - ] -} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/params.cfg b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/params.cfg deleted file mode 100644 index 637d447e6..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/params.cfg +++ /dev/null @@ -1,34 +0,0 @@ -[topoaa] -cns_exec = "" -ncores = 4 -max_cpus = true -mode = "local" -batch_type = "slurm" -queue = "" -clean = false -offline = false -autohis = true -delenph = true -log_level = "quiet" -iniseed = 917 -ligand_param_fname = "" -ligand_top_fname = "" -limit = true -set_bfactor = true -tolerance = 0 -cyclicpept_dist = 2.0 -disulphide_dist = 2.2 - -[topoaa.mol1] -cyclicpept = false -nhisd = 0 -hisd_1 = nan -nhise = 0 -hise_1 = nan - -[topoaa.mol2] -cyclicpept = false -nhisd = 0 -hisd_1 = nan -nhise = 0 -hise_1 = nan diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.pdb b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.pdb deleted file mode 100644 index a17029739..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.pdb +++ /dev/null @@ -1,2154 +0,0 @@ -REMARK FILENAME="prot-prot_haddock.pdb" -REMARK Patching histidine 75 to HISD -REMARK Patching histidine 90 to HISD -REMARK Patching histidine 76 to HISD -REMARK Patching histidine 15 to HISE -REMARK DATE:01-Oct-2024 16:32:30 created by user: unknown -REMARK VERSION:1.3U -ATOM 1 N THR A 19 51.382 49.015 12.266 1.00 15.00 A N -ATOM 2 HN THR A 19 50.503 49.282 11.924 1.00 15.00 A H -ATOM 3 CA THR A 19 51.464 47.969 13.285 1.00 15.00 A C -ATOM 4 CB THR A 19 52.915 47.521 13.637 1.00 15.00 A C -ATOM 5 OG1 THR A 19 52.992 46.104 13.665 1.00 15.00 A O -ATOM 6 HG1 THR A 19 52.277 45.755 14.202 1.00 15.00 A H -ATOM 7 CG2 THR A 19 53.358 48.069 15.002 1.00 15.00 A C -ATOM 8 C THR A 19 50.687 48.310 14.540 1.00 15.00 A C -ATOM 9 O THR A 19 50.904 49.317 15.188 1.00 15.00 A O -ATOM 10 N ILE A 20 49.771 47.410 14.891 1.00 15.00 A N -ATOM 11 HN ILE A 20 49.621 46.623 14.326 1.00 15.00 A H -ATOM 12 CA ILE A 20 49.010 47.580 16.076 1.00 15.00 A C -ATOM 13 CB ILE A 20 47.541 47.355 15.789 1.00 15.00 A C -ATOM 14 CG1 ILE A 20 47.124 48.242 14.572 1.00 15.00 A C -ATOM 15 CG2 ILE A 20 46.684 47.697 17.013 1.00 15.00 A C -ATOM 16 CD1 ILE A 20 46.614 47.391 13.409 1.00 15.00 A C -ATOM 17 C ILE A 20 49.479 46.624 17.158 1.00 15.00 A C -ATOM 18 O ILE A 20 49.608 45.428 16.967 1.00 15.00 A O -ATOM 19 N GLU A 21 49.697 47.189 18.314 1.00 15.00 A N -ATOM 20 HN GLU A 21 49.599 48.161 18.388 1.00 15.00 A H -ATOM 21 CA GLU A 21 50.078 46.438 19.494 1.00 15.00 A C -ATOM 22 CB GLU A 21 51.156 47.156 20.303 1.00 15.00 A C -ATOM 23 CG GLU A 21 52.561 46.600 20.010 1.00 15.00 A C -ATOM 24 CD GLU A 21 53.641 47.575 20.497 1.00 15.00 A C -ATOM 25 OE1 GLU A 21 53.427 48.234 21.507 1.00 15.00 A O -ATOM 26 OE2 GLU A 21 54.669 47.650 19.836 1.00 15.00 A O -ATOM 27 C GLU A 21 48.864 46.222 20.401 1.00 15.00 A C -ATOM 28 O GLU A 21 48.211 47.155 20.833 1.00 15.00 A O -ATOM 29 N ILE A 22 48.608 44.981 20.708 1.00 15.00 A N -ATOM 30 HN ILE A 22 49.157 44.273 20.310 1.00 15.00 A H -ATOM 31 CA ILE A 22 47.531 44.605 21.626 1.00 15.00 A C -ATOM 32 CB ILE A 22 46.798 43.298 21.232 1.00 15.00 A C -ATOM 33 CG1 ILE A 22 46.411 43.262 19.744 1.00 15.00 A C -ATOM 34 CG2 ILE A 22 45.569 43.084 22.117 1.00 15.00 A C -ATOM 35 CD1 ILE A 22 45.253 44.213 19.451 1.00 15.00 A C -ATOM 36 C ILE A 22 48.175 44.467 22.989 1.00 15.00 A C -ATOM 37 O ILE A 22 49.129 43.730 23.172 1.00 15.00 A O -ATOM 38 N ILE A 23 47.674 45.200 23.936 1.00 15.00 A N -ATOM 39 HN ILE A 23 46.906 45.776 23.739 1.00 15.00 A H -ATOM 40 CA ILE A 23 48.214 45.187 25.257 1.00 15.00 A C -ATOM 41 CB ILE A 23 48.244 46.597 25.858 1.00 15.00 A C -ATOM 42 CG1 ILE A 23 48.863 47.564 24.839 1.00 15.00 A C -ATOM 43 CG2 ILE A 23 49.061 46.606 27.152 1.00 15.00 A C -ATOM 44 CD1 ILE A 23 50.332 47.223 24.576 1.00 15.00 A C -ATOM 45 C ILE A 23 47.524 44.180 26.133 1.00 15.00 A C -ATOM 46 O ILE A 23 46.365 43.887 25.994 1.00 15.00 A O -ATOM 47 N ALA A 24 48.283 43.611 27.034 1.00 15.00 A N -ATOM 48 HN ALA A 24 49.225 43.865 27.128 1.00 15.00 A H -ATOM 49 CA ALA A 24 47.709 42.611 27.878 1.00 15.00 A C -ATOM 50 CB ALA A 24 48.786 42.193 28.879 1.00 15.00 A C -ATOM 51 C ALA A 24 46.519 43.065 28.708 1.00 15.00 A C -ATOM 52 O ALA A 24 46.580 44.043 29.435 1.00 15.00 A O -ATOM 53 N PRO A 25 45.399 42.414 28.524 1.00 15.00 A N -ATOM 54 CA PRO A 25 44.171 42.792 29.225 1.00 15.00 A C -ATOM 55 CB PRO A 25 43.034 42.136 28.433 1.00 15.00 A C -ATOM 56 CG PRO A 25 43.668 41.077 27.566 1.00 15.00 A C -ATOM 57 CD PRO A 25 45.127 41.454 27.409 1.00 15.00 A C -ATOM 58 C PRO A 25 44.198 42.324 30.711 1.00 15.00 A C -ATOM 59 O PRO A 25 43.497 42.859 31.546 1.00 15.00 A O -ATOM 60 N LEU A 26 45.039 41.362 31.023 1.00 15.00 A N -ATOM 61 HN LEU A 26 45.550 40.943 30.299 1.00 15.00 A H -ATOM 62 CA LEU A 26 45.258 40.877 32.399 1.00 15.00 A C -ATOM 63 CB LEU A 26 44.284 39.798 33.045 1.00 15.00 A C -ATOM 64 CG LEU A 26 43.438 38.919 32.089 1.00 15.00 A C -ATOM 65 CD1 LEU A 26 44.229 38.417 30.898 1.00 15.00 A C -ATOM 66 CD2 LEU A 26 42.899 37.696 32.874 1.00 15.00 A C -ATOM 67 C LEU A 26 46.724 40.422 32.577 1.00 15.00 A C -ATOM 68 O LEU A 26 47.431 40.153 31.624 1.00 15.00 A O -ATOM 69 N SER A 27 47.172 40.328 33.834 1.00 15.00 A N -ATOM 70 HN SER A 27 46.582 40.577 34.576 1.00 15.00 A H -ATOM 71 CA SER A 27 48.525 39.860 34.118 1.00 15.00 A C -ATOM 72 CB SER A 27 49.037 40.332 35.469 1.00 15.00 A C -ATOM 73 OG SER A 27 49.037 41.751 35.525 1.00 15.00 A O -ATOM 74 HG SER A 27 49.281 42.037 36.408 1.00 15.00 A H -ATOM 75 C SER A 27 48.590 38.363 34.115 1.00 15.00 A C -ATOM 76 O SER A 27 47.653 37.682 34.484 1.00 15.00 A O -ATOM 77 N GLY A 28 49.717 37.836 33.717 1.00 15.00 A N -ATOM 78 HN GLY A 28 50.455 38.411 33.425 1.00 15.00 A H -ATOM 79 CA GLY A 28 49.856 36.412 33.714 1.00 15.00 A C -ATOM 80 C GLY A 28 50.928 35.974 32.741 1.00 15.00 A C -ATOM 81 O GLY A 28 51.862 36.691 32.426 1.00 15.00 A O -ATOM 82 N GLU A 29 50.783 34.763 32.308 1.00 15.00 A N -ATOM 83 HN GLU A 29 49.995 34.259 32.599 1.00 15.00 A H -ATOM 84 CA GLU A 29 51.720 34.110 31.417 1.00 15.00 A C -ATOM 85 CB GLU A 29 52.330 32.838 32.078 1.00 15.00 A C -ATOM 86 CG GLU A 29 53.877 32.953 32.241 1.00 15.00 A C -ATOM 87 CD GLU A 29 54.571 31.908 31.374 1.00 15.00 A C -ATOM 88 OE1 GLU A 29 54.250 30.741 31.546 1.00 15.00 A O -ATOM 89 OE2 GLU A 29 55.393 32.287 30.552 1.00 15.00 A O -ATOM 90 C GLU A 29 51.052 33.780 30.117 1.00 15.00 A C -ATOM 91 O GLU A 29 49.942 33.287 30.091 1.00 15.00 A O -ATOM 92 N ILE A 30 51.718 34.059 29.015 1.00 15.00 A N -ATOM 93 HN ILE A 30 52.614 34.452 29.050 1.00 15.00 A H -ATOM 94 CA ILE A 30 51.087 33.766 27.768 1.00 15.00 A C -ATOM 95 CB ILE A 30 51.692 34.547 26.609 1.00 15.00 A C -ATOM 96 CG1 ILE A 30 51.330 36.020 26.804 1.00 15.00 A C -ATOM 97 CG2 ILE A 30 51.132 34.032 25.275 1.00 15.00 A C -ATOM 98 CD1 ILE A 30 51.972 36.885 25.722 1.00 15.00 A C -ATOM 99 C ILE A 30 51.099 32.268 27.509 1.00 15.00 A C -ATOM 100 O ILE A 30 52.035 31.557 27.813 1.00 15.00 A O -ATOM 101 N VAL A 31 50.007 31.804 26.952 1.00 15.00 A N -ATOM 102 HN VAL A 31 49.290 32.432 26.726 1.00 15.00 A H -ATOM 103 CA VAL A 31 49.820 30.401 26.658 1.00 15.00 A C -ATOM 104 CB VAL A 31 48.846 29.829 27.687 1.00 15.00 A C -ATOM 105 CG1 VAL A 31 48.242 28.510 27.205 1.00 15.00 A C -ATOM 106 CG2 VAL A 31 49.548 29.614 29.025 1.00 15.00 A C -ATOM 107 C VAL A 31 49.295 30.264 25.218 1.00 15.00 A C -ATOM 108 O VAL A 31 48.700 31.177 24.679 1.00 15.00 A O -ATOM 109 N ASN A 32 49.517 29.120 24.605 1.00 15.00 A N -ATOM 110 HN ASN A 32 50.013 28.415 25.071 1.00 15.00 A H -ATOM 111 CA ASN A 32 49.037 28.878 23.238 1.00 15.00 A C -ATOM 112 CB ASN A 32 49.563 27.579 22.571 1.00 15.00 A C -ATOM 113 CG ASN A 32 51.071 27.562 22.387 1.00 15.00 A C -ATOM 114 OD1 ASN A 32 51.680 26.500 22.400 1.00 15.00 A O -ATOM 115 ND2 ASN A 32 51.695 28.684 22.193 1.00 15.00 A N -ATOM 116 HD21 ASN A 32 51.167 29.509 22.172 1.00 15.00 A H -ATOM 117 HD22 ASN A 32 52.668 28.658 22.076 1.00 15.00 A H -ATOM 118 C ASN A 32 47.549 28.716 23.211 1.00 15.00 A C -ATOM 119 O ASN A 32 46.967 28.050 24.047 1.00 15.00 A O -ATOM 120 N ILE A 33 46.921 29.294 22.238 1.00 15.00 A N -ATOM 121 HN ILE A 33 47.411 29.806 21.561 1.00 15.00 A H -ATOM 122 CA ILE A 33 45.491 29.170 22.170 1.00 15.00 A C -ATOM 123 CB ILE A 33 44.833 30.207 21.226 1.00 15.00 A C -ATOM 124 CG1 ILE A 33 43.340 30.333 21.601 1.00 15.00 A C -ATOM 125 CG2 ILE A 33 44.983 29.790 19.753 1.00 15.00 A C -ATOM 126 CD1 ILE A 33 42.789 31.682 21.188 1.00 15.00 A C -ATOM 127 C ILE A 33 45.147 27.742 21.863 1.00 15.00 A C -ATOM 128 O ILE A 33 44.070 27.266 22.185 1.00 15.00 A O -ATOM 129 N GLU A 34 46.048 27.032 21.271 1.00 15.00 A N -ATOM 130 HN GLU A 34 46.917 27.420 21.037 1.00 15.00 A H -ATOM 131 CA GLU A 34 45.754 25.673 20.965 1.00 15.00 A C -ATOM 132 CB GLU A 34 46.584 25.088 19.807 1.00 15.00 A C -ATOM 133 CG GLU A 34 48.023 25.596 19.810 1.00 15.00 A C -ATOM 134 CD GLU A 34 48.106 26.983 19.159 1.00 15.00 A C -ATOM 135 OE1 GLU A 34 47.335 27.241 18.249 1.00 15.00 A O -ATOM 136 OE2 GLU A 34 48.956 27.756 19.566 1.00 15.00 A O -ATOM 137 C GLU A 34 45.783 24.833 22.210 1.00 15.00 A C -ATOM 138 O GLU A 34 45.287 23.721 22.201 1.00 15.00 A O -ATOM 139 N ASP A 35 46.322 25.341 23.287 1.00 15.00 A N -ATOM 140 HN ASP A 35 46.691 26.249 23.271 1.00 15.00 A H -ATOM 141 CA ASP A 35 46.372 24.560 24.500 1.00 15.00 A C -ATOM 142 CB ASP A 35 47.701 24.694 25.230 1.00 15.00 A C -ATOM 143 CG ASP A 35 48.870 24.444 24.279 1.00 15.00 A C -ATOM 144 OD1 ASP A 35 48.631 23.898 23.215 1.00 15.00 A O -ATOM 145 OD2 ASP A 35 49.988 24.807 24.629 1.00 15.00 A O -ATOM 146 C ASP A 35 45.216 24.829 25.447 1.00 15.00 A C -ATOM 147 O ASP A 35 45.229 24.396 26.586 1.00 15.00 A O -ATOM 148 N VAL A 36 44.221 25.503 24.981 1.00 15.00 A N -ATOM 149 HN VAL A 36 44.253 25.820 24.054 1.00 15.00 A H -ATOM 150 CA VAL A 36 43.039 25.810 25.801 1.00 15.00 A C -ATOM 151 CB VAL A 36 42.350 27.104 25.340 1.00 15.00 A C -ATOM 152 CG1 VAL A 36 40.876 27.140 25.723 1.00 15.00 A C -ATOM 153 CG2 VAL A 36 43.056 28.339 25.913 1.00 15.00 A C -ATOM 154 C VAL A 36 42.030 24.651 25.721 1.00 15.00 A C -ATOM 155 O VAL A 36 41.819 24.076 24.669 1.00 15.00 A O -ATOM 156 N PRO A 37 41.556 24.207 26.863 1.00 15.00 A N -ATOM 157 CA PRO A 37 40.691 23.029 26.956 1.00 15.00 A C -ATOM 158 CB PRO A 37 40.585 22.740 28.471 1.00 15.00 A C -ATOM 159 CG PRO A 37 41.360 23.779 29.226 1.00 15.00 A C -ATOM 160 CD PRO A 37 42.043 24.660 28.210 1.00 15.00 A C -ATOM 161 C PRO A 37 39.301 23.299 26.377 1.00 15.00 A C -ATOM 162 O PRO A 37 38.285 22.999 26.981 1.00 15.00 A O -ATOM 163 N ASP A 38 39.245 23.864 25.218 1.00 15.00 A N -ATOM 164 HN ASP A 38 40.072 24.102 24.749 1.00 15.00 A H -ATOM 165 CA ASP A 38 37.962 24.146 24.610 1.00 15.00 A C -ATOM 166 CB ASP A 38 37.414 25.506 25.059 1.00 15.00 A C -ATOM 167 CG ASP A 38 35.978 25.667 24.558 1.00 15.00 A C -ATOM 168 OD1 ASP A 38 35.556 24.849 23.757 1.00 15.00 A O -ATOM 169 OD2 ASP A 38 35.322 26.601 24.987 1.00 15.00 A O -ATOM 170 C ASP A 38 38.145 24.095 23.103 1.00 15.00 A C -ATOM 171 O ASP A 38 38.884 24.871 22.531 1.00 15.00 A O -ATOM 172 N VAL A 39 37.501 23.164 22.447 1.00 15.00 A N -ATOM 173 HN VAL A 39 36.907 22.543 22.919 1.00 15.00 A H -ATOM 174 CA VAL A 39 37.679 23.064 21.011 1.00 15.00 A C -ATOM 175 CB VAL A 39 37.057 21.845 20.323 1.00 15.00 A C -ATOM 176 CG1 VAL A 39 37.626 20.565 20.939 1.00 15.00 A C -ATOM 177 CG2 VAL A 39 35.539 21.871 20.517 1.00 15.00 A C -ATOM 178 C VAL A 39 37.250 24.328 20.309 1.00 15.00 A C -ATOM 179 O VAL A 39 37.896 24.717 19.352 1.00 15.00 A O -ATOM 180 N VAL A 40 36.211 24.997 20.712 1.00 15.00 A N -ATOM 181 HN VAL A 40 35.679 24.704 21.481 1.00 15.00 A H -ATOM 182 CA VAL A 40 35.874 26.201 19.968 1.00 15.00 A C -ATOM 183 CB VAL A 40 34.454 26.799 20.091 1.00 15.00 A C -ATOM 184 CG1 VAL A 40 33.446 25.870 19.410 1.00 15.00 A C -ATOM 185 CG2 VAL A 40 34.097 26.943 21.575 1.00 15.00 A C -ATOM 186 C VAL A 40 36.968 27.239 20.038 1.00 15.00 A C -ATOM 187 O VAL A 40 37.196 27.944 19.070 1.00 15.00 A O -ATOM 188 N PHE A 41 37.652 27.365 21.090 1.00 15.00 A N -ATOM 189 HN PHE A 41 37.478 26.798 21.870 1.00 15.00 A H -ATOM 190 CA PHE A 41 38.695 28.359 21.124 1.00 15.00 A C -ATOM 191 CB PHE A 41 39.002 28.721 22.577 1.00 15.00 A C -ATOM 192 CG PHE A 41 37.992 29.708 23.111 1.00 15.00 A C -ATOM 193 CD1 PHE A 41 38.161 31.083 22.855 1.00 15.00 A C -ATOM 194 CD2 PHE A 41 36.901 29.264 23.880 1.00 15.00 A C -ATOM 195 CE1 PHE A 41 37.241 32.013 23.370 1.00 15.00 A C -ATOM 196 CE2 PHE A 41 35.976 30.196 24.392 1.00 15.00 A C -ATOM 197 CZ PHE A 41 36.149 31.571 24.138 1.00 15.00 A C -ATOM 198 C PHE A 41 39.985 27.785 20.503 1.00 15.00 A C -ATOM 199 O PHE A 41 40.689 28.436 19.757 1.00 15.00 A O -ATOM 200 N ALA A 42 40.298 26.573 20.872 1.00 15.00 A N -ATOM 201 HN ALA A 42 39.691 26.098 21.477 1.00 15.00 A H -ATOM 202 CA ALA A 42 41.505 25.895 20.427 1.00 15.00 A C -ATOM 203 CB ALA A 42 41.653 24.529 21.098 1.00 15.00 A C -ATOM 204 C ALA A 42 41.474 25.777 18.945 1.00 15.00 A C -ATOM 205 O ALA A 42 42.496 25.893 18.288 1.00 15.00 A O -ATOM 206 N GLU A 43 40.322 25.563 18.389 1.00 15.00 A N -ATOM 207 HN GLU A 43 39.509 25.484 18.930 1.00 15.00 A H -ATOM 208 CA GLU A 43 40.269 25.443 16.937 1.00 15.00 A C -ATOM 209 CB GLU A 43 39.339 24.302 16.419 1.00 15.00 A C -ATOM 210 CG GLU A 43 39.837 22.956 16.950 1.00 15.00 A C -ATOM 211 CD GLU A 43 38.973 21.830 16.381 1.00 15.00 A C -ATOM 212 OE1 GLU A 43 37.963 22.137 15.769 1.00 15.00 A O -ATOM 213 OE2 GLU A 43 39.335 20.680 16.566 1.00 15.00 A O -ATOM 214 C GLU A 43 40.012 26.815 16.290 1.00 15.00 A C -ATOM 215 O GLU A 43 39.855 26.951 15.094 1.00 15.00 A O -ATOM 216 N LYS A 44 40.049 27.819 17.102 1.00 15.00 A N -ATOM 217 HN LYS A 44 40.184 27.633 18.055 1.00 15.00 A H -ATOM 218 CA LYS A 44 39.903 29.211 16.692 1.00 15.00 A C -ATOM 219 CB LYS A 44 41.095 29.763 15.959 1.00 15.00 A C -ATOM 220 CG LYS A 44 42.417 29.445 16.648 1.00 15.00 A C -ATOM 221 CD LYS A 44 43.351 28.785 15.606 1.00 15.00 A C -ATOM 222 CE LYS A 44 44.800 29.237 15.767 1.00 15.00 A C -ATOM 223 NZ LYS A 44 45.664 28.038 15.791 1.00 15.00 A N -ATOM 224 HZ1 LYS A 44 45.560 27.505 14.904 1.00 15.00 A H -ATOM 225 HZ2 LYS A 44 45.399 27.422 16.586 1.00 15.00 A H -ATOM 226 HZ3 LYS A 44 46.660 28.317 15.900 1.00 15.00 A H -ATOM 227 C LYS A 44 38.679 29.477 15.861 1.00 15.00 A C -ATOM 228 O LYS A 44 38.703 30.258 14.928 1.00 15.00 A O -ATOM 229 N ILE A 45 37.616 28.876 16.202 1.00 15.00 A N -ATOM 230 HN ILE A 45 37.623 28.257 16.962 1.00 15.00 A H -ATOM 231 CA ILE A 45 36.414 29.103 15.479 1.00 15.00 A C -ATOM 232 CB ILE A 45 35.422 28.160 16.114 1.00 15.00 A C -ATOM 233 CG1 ILE A 45 35.958 26.707 16.089 1.00 15.00 A C -ATOM 234 CG2 ILE A 45 34.076 28.235 15.372 1.00 15.00 A C -ATOM 235 CD1 ILE A 45 36.604 26.339 14.741 1.00 15.00 A C -ATOM 236 C ILE A 45 35.921 30.546 15.684 1.00 15.00 A C -ATOM 237 O ILE A 45 35.225 31.141 14.885 1.00 15.00 A O -ATOM 238 N VAL A 46 36.242 31.009 16.821 1.00 15.00 A N -ATOM 239 HN VAL A 46 36.805 30.437 17.383 1.00 15.00 A H -ATOM 240 CA VAL A 46 35.869 32.280 17.372 1.00 15.00 A C -ATOM 241 CB VAL A 46 35.660 31.929 18.858 1.00 15.00 A C -ATOM 242 CG1 VAL A 46 34.748 32.980 19.505 1.00 15.00 A C -ATOM 243 CG2 VAL A 46 35.032 30.533 19.022 1.00 15.00 A C -ATOM 244 C VAL A 46 36.898 33.396 17.005 1.00 15.00 A C -ATOM 245 O VAL A 46 36.651 34.568 17.211 1.00 15.00 A O -ATOM 246 N GLY A 47 38.003 33.036 16.409 1.00 15.00 A N -ATOM 247 HN GLY A 47 38.158 32.079 16.266 1.00 15.00 A H -ATOM 248 CA GLY A 47 39.012 33.980 15.948 1.00 15.00 A C -ATOM 249 C GLY A 47 40.353 33.495 16.376 1.00 15.00 A C -ATOM 250 O GLY A 47 40.447 32.447 16.967 1.00 15.00 A O -ATOM 251 N ASP A 48 41.403 34.243 16.140 1.00 15.00 A N -ATOM 252 HN ASP A 48 41.317 35.106 15.685 1.00 15.00 A H -ATOM 253 CA ASP A 48 42.697 33.751 16.575 1.00 15.00 A C -ATOM 254 CB ASP A 48 43.642 33.605 15.350 1.00 15.00 A C -ATOM 255 CG ASP A 48 44.837 32.697 15.644 1.00 15.00 A C -ATOM 256 OD1 ASP A 48 44.904 32.143 16.729 1.00 15.00 A O -ATOM 257 OD2 ASP A 48 45.672 32.570 14.754 1.00 15.00 A O -ATOM 258 C ASP A 48 43.373 34.676 17.581 1.00 15.00 A C -ATOM 259 O ASP A 48 43.132 35.867 17.601 1.00 15.00 A O -ATOM 260 N GLY A 49 44.266 34.138 18.405 1.00 15.00 A N -ATOM 261 HN GLY A 49 44.449 33.175 18.390 1.00 15.00 A H -ATOM 262 CA GLY A 49 44.957 35.025 19.324 1.00 15.00 A C -ATOM 263 C GLY A 49 45.805 34.231 20.330 1.00 15.00 A C -ATOM 264 O GLY A 49 46.455 33.274 19.966 1.00 15.00 A O -ATOM 265 N ILE A 50 45.790 34.621 21.606 1.00 15.00 A N -ATOM 266 HN ILE A 50 45.260 35.405 21.862 1.00 15.00 A H -ATOM 267 CA ILE A 50 46.543 33.907 22.623 1.00 15.00 A C -ATOM 268 CB ILE A 50 47.825 34.652 23.072 1.00 15.00 A C -ATOM 269 CG1 ILE A 50 47.564 36.120 23.466 1.00 15.00 A C -ATOM 270 CG2 ILE A 50 48.894 34.624 21.973 1.00 15.00 A C -ATOM 271 CD1 ILE A 50 47.049 36.234 24.902 1.00 15.00 A C -ATOM 272 C ILE A 50 45.647 33.721 23.855 1.00 15.00 A C -ATOM 273 O ILE A 50 44.552 34.244 23.930 1.00 15.00 A O -ATOM 274 N ALA A 51 46.158 33.007 24.820 1.00 15.00 A N -ATOM 275 HN ALA A 51 47.032 32.591 24.665 1.00 15.00 A H -ATOM 276 CA ALA A 51 45.521 32.783 26.117 1.00 15.00 A C -ATOM 277 CB ALA A 51 45.306 31.291 26.329 1.00 15.00 A C -ATOM 278 C ALA A 51 46.471 33.296 27.223 1.00 15.00 A C -ATOM 279 O ALA A 51 47.667 33.406 27.014 1.00 15.00 A O -ATOM 280 N ILE A 52 45.945 33.590 28.395 1.00 15.00 A N -ATOM 281 HN ILE A 52 44.976 33.501 28.508 1.00 15.00 A H -ATOM 282 CA ILE A 52 46.733 34.039 29.523 1.00 15.00 A C -ATOM 283 CB ILE A 52 46.555 35.520 29.810 1.00 15.00 A C -ATOM 284 CG1 ILE A 52 47.171 36.333 28.659 1.00 15.00 A C -ATOM 285 CG2 ILE A 52 47.243 35.906 31.130 1.00 15.00 A C -ATOM 286 CD1 ILE A 52 46.589 37.750 28.622 1.00 15.00 A C -ATOM 287 C ILE A 52 46.347 33.293 30.788 1.00 15.00 A C -ATOM 288 O ILE A 52 45.196 33.254 31.169 1.00 15.00 A O -ATOM 289 N LYS A 53 47.325 32.753 31.468 1.00 15.00 A N -ATOM 290 HN LYS A 53 48.237 32.777 31.110 1.00 15.00 A H -ATOM 291 CA LYS A 53 47.073 32.119 32.746 1.00 15.00 A C -ATOM 292 CB LYS A 53 48.064 31.002 33.081 1.00 15.00 A C -ATOM 293 CG LYS A 53 47.373 29.772 33.749 1.00 15.00 A C -ATOM 294 CD LYS A 53 47.317 29.902 35.288 1.00 15.00 A C -ATOM 295 CE LYS A 53 46.424 28.781 35.871 1.00 15.00 A C -ATOM 296 NZ LYS A 53 46.079 29.045 37.304 1.00 15.00 A N -ATOM 297 HZ1 LYS A 53 45.565 29.945 37.388 1.00 15.00 A H -ATOM 298 HZ2 LYS A 53 46.945 29.099 37.876 1.00 15.00 A H -ATOM 299 HZ3 LYS A 53 45.480 28.279 37.674 1.00 15.00 A H -ATOM 300 C LYS A 53 47.162 33.312 33.700 1.00 15.00 A C -ATOM 301 O LYS A 53 48.207 33.909 33.825 1.00 15.00 A O -ATOM 302 N PRO A 54 46.049 33.734 34.243 1.00 15.00 A N -ATOM 303 CA PRO A 54 45.940 34.975 35.019 1.00 15.00 A C -ATOM 304 CB PRO A 54 44.419 35.156 35.247 1.00 15.00 A C -ATOM 305 CG PRO A 54 43.711 33.998 34.631 1.00 15.00 A C -ATOM 306 CD PRO A 54 44.762 32.985 34.242 1.00 15.00 A C -ATOM 307 C PRO A 54 46.634 34.889 36.403 1.00 15.00 A C -ATOM 308 O PRO A 54 46.687 33.848 37.022 1.00 15.00 A O -ATOM 309 N THR A 55 47.121 36.009 36.890 1.00 15.00 A N -ATOM 310 HN THR A 55 47.056 36.823 36.348 1.00 15.00 A H -ATOM 311 CA THR A 55 47.759 36.093 38.212 1.00 15.00 A C -ATOM 312 CB THR A 55 49.294 36.242 38.145 1.00 15.00 A C -ATOM 313 OG1 THR A 55 49.622 37.403 37.398 1.00 15.00 A O -ATOM 314 HG1 THR A 55 48.962 38.082 37.554 1.00 15.00 A H -ATOM 315 CG2 THR A 55 49.937 35.013 37.502 1.00 15.00 A C -ATOM 316 C THR A 55 47.322 37.366 38.926 1.00 15.00 A C -ATOM 317 O THR A 55 47.803 37.649 40.005 1.00 15.00 A O -ATOM 318 N GLY A 56 46.458 38.162 38.327 1.00 15.00 A N -ATOM 319 HN GLY A 56 46.090 37.904 37.456 1.00 15.00 A H -ATOM 320 CA GLY A 56 46.046 39.418 38.947 1.00 15.00 A C -ATOM 321 C GLY A 56 44.604 39.428 39.471 1.00 15.00 A C -ATOM 322 O GLY A 56 44.100 38.441 39.966 1.00 15.00 A O -ATOM 323 N ASN A 57 43.945 40.588 39.356 1.00 15.00 A N -ATOM 324 HN ASN A 57 44.399 41.353 38.944 1.00 15.00 A H -ATOM 325 CA ASN A 57 42.577 40.750 39.822 1.00 15.00 A C -ATOM 326 CB ASN A 57 42.521 41.365 41.224 1.00 15.00 A C -ATOM 327 CG ASN A 57 43.170 42.748 41.224 1.00 15.00 A C -ATOM 328 OD1 ASN A 57 42.697 43.664 40.576 1.00 15.00 A O -ATOM 329 ND2 ASN A 57 44.248 42.933 41.939 1.00 15.00 A N -ATOM 330 HD21 ASN A 57 44.600 42.175 42.450 1.00 15.00 A H -ATOM 331 HD22 ASN A 57 44.659 43.823 41.935 1.00 15.00 A H -ATOM 332 C ASN A 57 41.778 41.630 38.920 1.00 15.00 A C -ATOM 333 O ASN A 57 40.710 42.075 39.306 1.00 15.00 A O -ATOM 334 N LYS A 58 42.221 41.917 37.734 1.00 15.00 A N -ATOM 335 HN LYS A 58 43.084 41.590 37.404 1.00 15.00 A H -ATOM 336 CA LYS A 58 41.372 42.734 36.950 1.00 15.00 A C -ATOM 337 CB LYS A 58 41.517 44.141 37.443 1.00 15.00 A C -ATOM 338 CG LYS A 58 42.825 44.723 36.916 1.00 15.00 A C -ATOM 339 CD LYS A 58 43.121 46.093 37.579 1.00 15.00 A C -ATOM 340 CE LYS A 58 44.587 46.176 38.062 1.00 15.00 A C -ATOM 341 NZ LYS A 58 45.416 46.936 37.087 1.00 15.00 A N -ATOM 342 HZ1 LYS A 58 45.046 47.902 36.980 1.00 15.00 A H -ATOM 343 HZ2 LYS A 58 45.398 46.466 36.160 1.00 15.00 A H -ATOM 344 HZ3 LYS A 58 46.401 46.987 37.418 1.00 15.00 A H -ATOM 345 C LYS A 58 41.628 42.600 35.448 1.00 15.00 A C -ATOM 346 O LYS A 58 42.701 42.244 35.001 1.00 15.00 A O -ATOM 347 N MET A 59 40.589 42.903 34.674 1.00 15.00 A N -ATOM 348 HN MET A 59 39.746 43.166 35.100 1.00 15.00 A H -ATOM 349 CA MET A 59 40.652 42.860 33.238 1.00 15.00 A C -ATOM 350 CB MET A 59 39.550 41.917 32.785 1.00 15.00 A C -ATOM 351 CG MET A 59 40.023 40.839 31.827 1.00 15.00 A C -ATOM 352 SD MET A 59 38.785 39.504 31.625 1.00 15.00 A S -ATOM 353 CE MET A 59 37.878 39.625 33.193 1.00 15.00 A C -ATOM 354 C MET A 59 40.472 44.289 32.682 1.00 15.00 A C -ATOM 355 O MET A 59 39.477 44.941 32.942 1.00 15.00 A O -ATOM 356 N VAL A 60 41.451 44.782 31.927 1.00 15.00 A N -ATOM 357 HN VAL A 60 42.237 44.228 31.738 1.00 15.00 A H -ATOM 358 CA VAL A 60 41.380 46.121 31.378 1.00 15.00 A C -ATOM 359 CB VAL A 60 42.591 46.937 31.700 1.00 15.00 A C -ATOM 360 CG1 VAL A 60 42.961 46.748 33.170 1.00 15.00 A C -ATOM 361 CG2 VAL A 60 43.758 46.432 30.833 1.00 15.00 A C -ATOM 362 C VAL A 60 41.289 46.084 29.877 1.00 15.00 A C -ATOM 363 O VAL A 60 41.393 45.055 29.237 1.00 15.00 A O -ATOM 364 N ALA A 61 41.112 47.242 29.340 1.00 15.00 A N -ATOM 365 HN ALA A 61 41.039 48.030 29.918 1.00 15.00 A H -ATOM 366 CA ALA A 61 41.017 47.412 27.883 1.00 15.00 A C -ATOM 367 CB ALA A 61 40.618 48.853 27.559 1.00 15.00 A C -ATOM 368 C ALA A 61 42.345 47.121 27.252 1.00 15.00 A C -ATOM 369 O ALA A 61 43.335 47.704 27.655 1.00 15.00 A O -ATOM 370 N PRO A 62 42.432 46.240 26.269 1.00 15.00 A N -ATOM 371 CA PRO A 62 43.755 45.976 25.683 1.00 15.00 A C -ATOM 372 CB PRO A 62 43.679 44.581 25.038 1.00 15.00 A C -ATOM 373 CG PRO A 62 42.193 44.301 24.871 1.00 15.00 A C -ATOM 374 CD PRO A 62 41.397 45.423 25.597 1.00 15.00 A C -ATOM 375 C PRO A 62 44.066 46.999 24.574 1.00 15.00 A C -ATOM 376 O PRO A 62 45.111 46.948 23.959 1.00 15.00 A O -ATOM 377 N VAL A 63 43.138 47.896 24.302 1.00 15.00 A N -ATOM 378 HN VAL A 63 42.308 47.899 24.823 1.00 15.00 A H -ATOM 379 CA VAL A 63 43.319 48.897 23.230 1.00 15.00 A C -ATOM 380 CB VAL A 63 43.003 48.369 21.817 1.00 15.00 A C -ATOM 381 CG1 VAL A 63 43.818 47.114 21.503 1.00 15.00 A C -ATOM 382 CG2 VAL A 63 41.508 48.055 21.709 1.00 15.00 A C -ATOM 383 C VAL A 63 42.415 50.097 23.442 1.00 15.00 A C -ATOM 384 O VAL A 63 41.448 50.042 24.178 1.00 15.00 A O -ATOM 385 N ASP A 64 42.708 51.169 22.735 1.00 15.00 A N -ATOM 386 HN ASP A 64 43.516 51.177 22.180 1.00 15.00 A H -ATOM 387 CA ASP A 64 41.847 52.343 22.767 1.00 15.00 A C -ATOM 388 CB ASP A 64 42.570 53.649 22.472 1.00 15.00 A C -ATOM 389 CG ASP A 64 43.757 53.886 23.407 1.00 15.00 A C -ATOM 390 OD1 ASP A 64 43.758 53.367 24.508 1.00 15.00 A O -ATOM 391 OD2 ASP A 64 44.659 54.594 22.986 1.00 15.00 A O -ATOM 392 C ASP A 64 40.735 51.996 21.791 1.00 15.00 A C -ATOM 393 O ASP A 64 40.979 51.554 20.685 1.00 15.00 A O -ATOM 394 N GLY A 65 39.517 52.108 22.234 1.00 15.00 A N -ATOM 395 HN GLY A 65 39.367 52.466 23.134 1.00 15.00 A H -ATOM 396 CA GLY A 65 38.385 51.714 21.424 1.00 15.00 A C -ATOM 397 C GLY A 65 37.103 51.805 22.216 1.00 15.00 A C -ATOM 398 O GLY A 65 37.014 52.544 23.179 1.00 15.00 A O -ATOM 399 N THR A 66 36.090 51.081 21.795 1.00 15.00 A N -ATOM 400 HN THR A 66 36.199 50.484 21.025 1.00 15.00 A H -ATOM 401 CA THR A 66 34.809 51.167 22.473 1.00 15.00 A C -ATOM 402 CB THR A 66 33.791 51.680 21.429 1.00 15.00 A C -ATOM 403 OG1 THR A 66 34.241 52.927 20.930 1.00 15.00 A O -ATOM 404 HG1 THR A 66 34.073 53.612 21.581 1.00 15.00 A H -ATOM 405 CG2 THR A 66 32.403 51.847 22.051 1.00 15.00 A C -ATOM 406 C THR A 66 34.346 49.805 22.951 1.00 15.00 A C -ATOM 407 O THR A 66 34.398 48.843 22.209 1.00 15.00 A O -ATOM 408 N ILE A 67 33.865 49.698 24.170 1.00 15.00 A N -ATOM 409 HN ILE A 67 33.819 50.473 24.768 1.00 15.00 A H -ATOM 410 CA ILE A 67 33.400 48.379 24.603 1.00 15.00 A C -ATOM 411 CB ILE A 67 32.975 48.289 26.069 1.00 15.00 A C -ATOM 412 CG1 ILE A 67 34.148 48.553 27.064 1.00 15.00 A C -ATOM 413 CG2 ILE A 67 32.332 46.912 26.330 1.00 15.00 A C -ATOM 414 CD1 ILE A 67 35.526 48.301 26.445 1.00 15.00 A C -ATOM 415 C ILE A 67 32.165 48.060 23.817 1.00 15.00 A C -ATOM 416 O ILE A 67 31.323 48.910 23.603 1.00 15.00 A O -ATOM 417 N GLY A 68 32.043 46.847 23.422 1.00 15.00 A N -ATOM 418 HN GLY A 68 32.746 46.205 23.646 1.00 15.00 A H -ATOM 419 CA GLY A 68 30.906 46.409 22.664 1.00 15.00 A C -ATOM 420 C GLY A 68 29.880 45.657 23.465 1.00 15.00 A C -ATOM 421 O GLY A 68 28.741 46.063 23.598 1.00 15.00 A O -ATOM 422 N LYS A 69 30.264 44.542 23.959 1.00 15.00 A N -ATOM 423 HN LYS A 69 31.189 44.246 23.829 1.00 15.00 A H -ATOM 424 CA LYS A 69 29.359 43.724 24.698 1.00 15.00 A C -ATOM 425 CB LYS A 69 28.559 42.766 23.808 1.00 15.00 A C -ATOM 426 CG LYS A 69 27.458 42.034 24.639 1.00 15.00 A C -ATOM 427 CD LYS A 69 27.688 40.514 24.625 1.00 15.00 A C -ATOM 428 CE LYS A 69 26.566 39.820 25.402 1.00 15.00 A C -ATOM 429 NZ LYS A 69 25.251 40.133 24.770 1.00 15.00 A N -ATOM 430 HZ1 LYS A 69 25.086 41.160 24.779 1.00 15.00 A H -ATOM 431 HZ2 LYS A 69 24.483 39.666 25.292 1.00 15.00 A H -ATOM 432 HZ3 LYS A 69 25.239 39.798 23.785 1.00 15.00 A H -ATOM 433 C LYS A 69 30.026 43.072 25.879 1.00 15.00 A C -ATOM 434 O LYS A 69 31.116 42.569 25.821 1.00 15.00 A O -ATOM 435 N ILE A 70 29.287 43.116 26.978 1.00 15.00 A N -ATOM 436 HN ILE A 70 28.411 43.553 26.929 1.00 15.00 A H -ATOM 437 CA ILE A 70 29.698 42.559 28.238 1.00 15.00 A C -ATOM 438 CB ILE A 70 29.740 43.624 29.331 1.00 15.00 A C -ATOM 439 CG1 ILE A 70 30.772 44.689 28.924 1.00 15.00 A C -ATOM 440 CG2 ILE A 70 30.139 42.986 30.662 1.00 15.00 A C -ATOM 441 CD1 ILE A 70 30.833 45.831 29.941 1.00 15.00 A C -ATOM 442 C ILE A 70 28.705 41.448 28.535 1.00 15.00 A C -ATOM 443 O ILE A 70 27.504 41.651 28.511 1.00 15.00 A O -ATOM 444 N PHE A 71 29.203 40.266 28.772 1.00 15.00 A N -ATOM 445 HN PHE A 71 30.175 40.138 28.761 1.00 15.00 A H -ATOM 446 CA PHE A 71 28.329 39.132 29.053 1.00 15.00 A C -ATOM 447 CB PHE A 71 29.169 37.845 29.165 1.00 15.00 A C -ATOM 448 CG PHE A 71 29.326 37.209 27.797 1.00 15.00 A C -ATOM 449 CD1 PHE A 71 29.833 37.965 26.723 1.00 15.00 A C -ATOM 450 CD2 PHE A 71 28.957 35.863 27.596 1.00 15.00 A C -ATOM 451 CE1 PHE A 71 29.972 37.377 25.450 1.00 15.00 A C -ATOM 452 CE2 PHE A 71 29.097 35.276 26.324 1.00 15.00 A C -ATOM 453 CZ PHE A 71 29.604 36.033 25.252 1.00 15.00 A C -ATOM 454 C PHE A 71 27.553 39.433 30.351 1.00 15.00 A C -ATOM 455 O PHE A 71 28.035 40.082 31.258 1.00 15.00 A O -ATOM 456 N GLU A 72 26.340 38.977 30.395 1.00 15.00 A N -ATOM 457 HN GLU A 72 26.012 38.461 29.629 1.00 15.00 A H -ATOM 458 CA GLU A 72 25.439 39.189 31.517 1.00 15.00 A C -ATOM 459 CB GLU A 72 23.982 38.713 31.244 1.00 15.00 A C -ATOM 460 CG GLU A 72 23.351 39.613 30.181 1.00 15.00 A C -ATOM 461 CD GLU A 72 21.882 39.233 29.992 1.00 15.00 A C -ATOM 462 OE1 GLU A 72 21.504 38.164 30.442 1.00 15.00 A O -ATOM 463 OE2 GLU A 72 21.160 40.023 29.408 1.00 15.00 A O -ATOM 464 C GLU A 72 26.018 38.543 32.809 1.00 15.00 A C -ATOM 465 O GLU A 72 25.596 38.839 33.909 1.00 15.00 A O -ATOM 466 N THR A 73 26.992 37.696 32.662 1.00 15.00 A N -ATOM 467 HN THR A 73 27.288 37.496 31.750 1.00 15.00 A H -ATOM 468 CA THR A 73 27.683 37.015 33.772 1.00 15.00 A C -ATOM 469 CB THR A 73 27.918 35.516 33.548 1.00 15.00 A C -ATOM 470 OG1 THR A 73 28.602 35.327 32.319 1.00 15.00 A O -ATOM 471 HG1 THR A 73 28.770 36.180 31.912 1.00 15.00 A H -ATOM 472 CG2 THR A 73 26.576 34.777 33.505 1.00 15.00 A C -ATOM 473 C THR A 73 28.957 37.756 34.087 1.00 15.00 A C -ATOM 474 O THR A 73 29.737 37.413 34.948 1.00 15.00 A O -ATOM 475 N ASN A 74 29.092 38.818 33.422 1.00 15.00 A N -ATOM 476 HN ASN A 74 28.422 39.025 32.738 1.00 15.00 A H -ATOM 477 CA ASN A 74 30.179 39.745 33.613 1.00 15.00 A C -ATOM 478 CB ASN A 74 29.936 40.411 34.967 1.00 15.00 A C -ATOM 479 CG ASN A 74 28.553 41.025 35.040 1.00 15.00 A C -ATOM 480 OD1 ASN A 74 27.800 40.738 35.954 1.00 15.00 A O -ATOM 481 ND2 ASN A 74 28.195 41.884 34.130 1.00 15.00 A N -ATOM 482 HD21 ASN A 74 28.838 42.105 33.424 1.00 15.00 A H -ATOM 483 HD22 ASN A 74 27.298 42.274 34.189 1.00 15.00 A H -ATOM 484 C ASN A 74 31.530 39.067 33.600 1.00 15.00 A C -ATOM 485 O ASN A 74 32.365 39.352 34.438 1.00 15.00 A O -ATOM 486 N HIS A 75 31.758 38.167 32.668 1.00 15.00 A N -ATOM 487 HN HIS A 75 31.078 37.979 31.988 1.00 15.00 A H -ATOM 488 CA HIS A 75 33.001 37.465 32.653 1.00 15.00 A C -ATOM 489 CB HIS A 75 32.757 36.006 33.049 1.00 15.00 A C -ATOM 490 CG HIS A 75 32.243 35.218 31.873 1.00 15.00 A C -ATOM 491 ND1 HIS A 75 30.894 35.144 31.561 1.00 15.00 A N -ATOM 492 HD1 HIS A 75 30.163 35.584 32.037 1.00 15.00 A H -ATOM 493 CD2 HIS A 75 32.888 34.457 30.928 1.00 15.00 A C -ATOM 494 CE1 HIS A 75 30.770 34.363 30.472 1.00 15.00 A C -ATOM 495 NE2 HIS A 75 31.955 33.922 30.048 1.00 15.00 A N -ATOM 496 C HIS A 75 33.742 37.541 31.293 1.00 15.00 A C -ATOM 497 O HIS A 75 34.825 37.010 31.144 1.00 15.00 A O -ATOM 498 N ALA A 76 33.181 38.178 30.324 1.00 15.00 A N -ATOM 499 HN ALA A 76 32.307 38.594 30.476 1.00 15.00 A H -ATOM 500 CA ALA A 76 33.778 38.299 29.051 1.00 15.00 A C -ATOM 501 CB ALA A 76 33.344 37.093 28.273 1.00 15.00 A C -ATOM 502 C ALA A 76 33.306 39.548 28.345 1.00 15.00 A C -ATOM 503 O ALA A 76 32.212 40.026 28.574 1.00 15.00 A O -ATOM 504 N PHE A 77 34.110 40.089 27.466 1.00 15.00 A N -ATOM 505 HN PHE A 77 34.992 39.702 27.287 1.00 15.00 A H -ATOM 506 CA PHE A 77 33.667 41.265 26.769 1.00 15.00 A C -ATOM 507 CB PHE A 77 33.925 42.500 27.619 1.00 15.00 A C -ATOM 508 CG PHE A 77 35.399 42.843 27.671 1.00 15.00 A C -ATOM 509 CD1 PHE A 77 35.969 43.669 26.690 1.00 15.00 A C -ATOM 510 CD2 PHE A 77 36.187 42.371 28.723 1.00 15.00 A C -ATOM 511 CE1 PHE A 77 37.322 44.022 26.769 1.00 15.00 A C -ATOM 512 CE2 PHE A 77 37.541 42.719 28.798 1.00 15.00 A C -ATOM 513 CZ PHE A 77 38.108 43.548 27.825 1.00 15.00 A C -ATOM 514 C PHE A 77 34.299 41.422 25.389 1.00 15.00 A C -ATOM 515 O PHE A 77 35.258 40.769 25.019 1.00 15.00 A O -ATOM 516 N SER A 78 33.697 42.321 24.640 1.00 15.00 A N -ATOM 517 HN SER A 78 32.937 42.804 25.026 1.00 15.00 A H -ATOM 518 CA SER A 78 34.082 42.642 23.291 1.00 15.00 A C -ATOM 519 CB SER A 78 32.836 42.581 22.404 1.00 15.00 A C -ATOM 520 OG SER A 78 32.516 41.228 22.141 1.00 15.00 A O -ATOM 521 HG SER A 78 32.427 40.753 22.970 1.00 15.00 A H -ATOM 522 C SER A 78 34.502 44.100 23.209 1.00 15.00 A C -ATOM 523 O SER A 78 33.832 44.949 23.762 1.00 15.00 A O -ATOM 524 N ILE A 79 35.532 44.414 22.477 1.00 15.00 A N -ATOM 525 HN ILE A 79 36.055 43.707 22.044 1.00 15.00 A H -ATOM 526 CA ILE A 79 35.912 45.804 22.297 1.00 15.00 A C -ATOM 527 CB ILE A 79 37.006 46.218 23.273 1.00 15.00 A C -ATOM 528 CG1 ILE A 79 37.588 47.602 22.949 1.00 15.00 A C -ATOM 529 CG2 ILE A 79 38.107 45.178 23.244 1.00 15.00 A C -ATOM 530 CD1 ILE A 79 38.417 48.111 24.142 1.00 15.00 A C -ATOM 531 C ILE A 79 36.407 45.963 20.875 1.00 15.00 A C -ATOM 532 O ILE A 79 36.941 45.038 20.294 1.00 15.00 A O -ATOM 533 N GLU A 80 36.231 47.127 20.318 1.00 15.00 A N -ATOM 534 HN GLU A 80 35.768 47.828 20.822 1.00 15.00 A H -ATOM 535 CA GLU A 80 36.698 47.421 18.975 1.00 15.00 A C -ATOM 536 CB GLU A 80 35.554 47.799 18.031 1.00 15.00 A C -ATOM 537 CG GLU A 80 36.100 47.977 16.613 1.00 15.00 A C -ATOM 538 CD GLU A 80 34.977 48.454 15.690 1.00 15.00 A C -ATOM 539 OE1 GLU A 80 33.875 48.641 16.178 1.00 15.00 A O -ATOM 540 OE2 GLU A 80 35.238 48.623 14.510 1.00 15.00 A O -ATOM 541 C GLU A 80 37.686 48.529 19.126 1.00 15.00 A C -ATOM 542 O GLU A 80 37.411 49.491 19.790 1.00 15.00 A O -ATOM 543 N SER A 81 38.846 48.400 18.559 1.00 15.00 A N -ATOM 544 HN SER A 81 39.051 47.616 18.008 1.00 15.00 A H -ATOM 545 CA SER A 81 39.819 49.429 18.757 1.00 15.00 A C -ATOM 546 CB SER A 81 41.185 48.957 18.353 1.00 15.00 A C -ATOM 547 OG SER A 81 41.147 48.769 16.947 1.00 15.00 A O -ATOM 548 HG SER A 81 40.280 48.448 16.690 1.00 15.00 A H -ATOM 549 C SER A 81 39.515 50.543 17.823 1.00 15.00 A C -ATOM 550 O SER A 81 38.755 50.388 16.884 1.00 15.00 A O -ATOM 551 N ASP A 82 40.123 51.646 18.029 1.00 15.00 A N -ATOM 552 HN ASP A 82 40.731 51.748 18.791 1.00 15.00 A H -ATOM 553 CA ASP A 82 39.894 52.747 17.111 1.00 15.00 A C -ATOM 554 CB ASP A 82 40.434 54.112 17.606 1.00 15.00 A C -ATOM 555 CG ASP A 82 39.735 54.603 18.874 1.00 15.00 A C -ATOM 556 OD1 ASP A 82 38.593 54.223 19.086 1.00 15.00 A O -ATOM 557 OD2 ASP A 82 40.353 55.373 19.602 1.00 15.00 A O -ATOM 558 C ASP A 82 40.511 52.374 15.746 1.00 15.00 A C -ATOM 559 O ASP A 82 40.033 52.776 14.701 1.00 15.00 A O -ATOM 560 N SER A 83 41.570 51.598 15.798 1.00 15.00 A N -ATOM 561 HN SER A 83 41.879 51.317 16.684 1.00 15.00 A H -ATOM 562 CA SER A 83 42.317 51.125 14.651 1.00 15.00 A C -ATOM 563 CB SER A 83 43.627 50.470 15.061 1.00 15.00 A C -ATOM 564 OG SER A 83 43.562 50.103 16.432 1.00 15.00 A O -ATOM 565 HG SER A 83 44.380 50.351 16.869 1.00 15.00 A H -ATOM 566 C SER A 83 41.526 50.095 13.833 1.00 15.00 A C -ATOM 567 O SER A 83 42.036 49.508 12.896 1.00 15.00 A O -ATOM 568 N GLY A 84 40.325 49.878 14.218 1.00 15.00 A N -ATOM 569 HN GLY A 84 39.996 50.392 14.984 1.00 15.00 A H -ATOM 570 CA GLY A 84 39.414 48.918 13.594 1.00 15.00 A C -ATOM 571 C GLY A 84 39.603 47.429 13.946 1.00 15.00 A C -ATOM 572 O GLY A 84 39.040 46.587 13.269 1.00 15.00 A O -ATOM 573 N VAL A 85 40.336 47.062 14.962 1.00 15.00 A N -ATOM 574 HN VAL A 85 40.806 47.732 15.501 1.00 15.00 A H -ATOM 575 CA VAL A 85 40.448 45.637 15.287 1.00 15.00 A C -ATOM 576 CB VAL A 85 41.852 45.293 15.855 1.00 15.00 A C -ATOM 577 CG1 VAL A 85 41.990 43.788 16.135 1.00 15.00 A C -ATOM 578 CG2 VAL A 85 42.915 45.752 14.854 1.00 15.00 A C -ATOM 579 C VAL A 85 39.368 45.219 16.331 1.00 15.00 A C -ATOM 580 O VAL A 85 39.185 45.866 17.344 1.00 15.00 A O -ATOM 581 N GLU A 86 38.677 44.104 16.077 1.00 15.00 A N -ATOM 582 HN GLU A 86 38.843 43.630 15.236 1.00 15.00 A H -ATOM 583 CA GLU A 86 37.674 43.557 17.011 1.00 15.00 A C -ATOM 584 CB GLU A 86 36.476 42.971 16.256 1.00 15.00 A C -ATOM 585 CG GLU A 86 35.777 44.086 15.474 1.00 15.00 A C -ATOM 586 CD GLU A 86 34.583 43.509 14.712 1.00 15.00 A C -ATOM 587 OE1 GLU A 86 34.522 42.300 14.574 1.00 15.00 A O -ATOM 588 OE2 GLU A 86 33.750 44.288 14.279 1.00 15.00 A O -ATOM 589 C GLU A 86 38.302 42.449 17.877 1.00 15.00 A C -ATOM 590 O GLU A 86 38.826 41.474 17.374 1.00 15.00 A O -ATOM 591 N LEU A 87 38.263 42.620 19.185 1.00 15.00 A N -ATOM 592 HN LEU A 87 37.828 43.423 19.541 1.00 15.00 A H -ATOM 593 CA LEU A 87 38.838 41.667 20.119 1.00 15.00 A C -ATOM 594 CB LEU A 87 39.801 42.345 21.125 1.00 15.00 A C -ATOM 595 CG LEU A 87 41.183 42.838 20.650 1.00 15.00 A C -ATOM 596 CD1 LEU A 87 41.826 41.874 19.689 1.00 15.00 A C -ATOM 597 CD2 LEU A 87 41.077 44.229 20.039 1.00 15.00 A C -ATOM 598 C LEU A 87 37.765 41.055 20.993 1.00 15.00 A C -ATOM 599 O LEU A 87 36.707 41.618 21.205 1.00 15.00 A O -ATOM 600 N PHE A 88 38.069 39.920 21.545 1.00 15.00 A N -ATOM 601 HN PHE A 88 38.934 39.501 21.351 1.00 15.00 A H -ATOM 602 CA PHE A 88 37.146 39.270 22.441 1.00 15.00 A C -ATOM 603 CB PHE A 88 36.217 38.306 21.700 1.00 15.00 A C -ATOM 604 CG PHE A 88 35.195 37.751 22.665 1.00 15.00 A C -ATOM 605 CD1 PHE A 88 34.236 38.608 23.236 1.00 15.00 A C -ATOM 606 CD2 PHE A 88 35.198 36.380 22.992 1.00 15.00 A C -ATOM 607 CE1 PHE A 88 33.280 38.097 24.134 1.00 15.00 A C -ATOM 608 CE2 PHE A 88 34.241 35.868 23.889 1.00 15.00 A C -ATOM 609 CZ PHE A 88 33.282 36.727 24.460 1.00 15.00 A C -ATOM 610 C PHE A 88 37.920 38.580 23.573 1.00 15.00 A C -ATOM 611 O PHE A 88 38.624 37.606 23.395 1.00 15.00 A O -ATOM 612 N VAL A 89 37.742 39.127 24.754 1.00 15.00 A N -ATOM 613 HN VAL A 89 37.157 39.911 24.811 1.00 15.00 A H -ATOM 614 CA VAL A 89 38.356 38.646 25.987 1.00 15.00 A C -ATOM 615 CB VAL A 89 38.877 39.844 26.725 1.00 15.00 A C -ATOM 616 CG1 VAL A 89 39.703 39.424 27.945 1.00 15.00 A C -ATOM 617 CG2 VAL A 89 39.737 40.622 25.730 1.00 15.00 A C -ATOM 618 C VAL A 89 37.377 37.849 26.818 1.00 15.00 A C -ATOM 619 O VAL A 89 36.374 38.345 27.292 1.00 15.00 A O -ATOM 620 N HIS A 90 37.677 36.573 26.984 1.00 15.00 A N -ATOM 621 HN HIS A 90 38.499 36.208 26.594 1.00 15.00 A H -ATOM 622 CA HIS A 90 36.797 35.720 27.737 1.00 15.00 A C -ATOM 623 CB HIS A 90 36.172 34.677 26.766 1.00 15.00 A C -ATOM 624 CG HIS A 90 35.330 33.706 27.547 1.00 15.00 A C -ATOM 625 ND1 HIS A 90 35.881 32.806 28.445 1.00 15.00 A N -ATOM 626 HD1 HIS A 90 36.831 32.703 28.662 1.00 15.00 A H -ATOM 627 CD2 HIS A 90 33.975 33.483 27.576 1.00 15.00 A C -ATOM 628 CE1 HIS A 90 34.871 32.089 28.972 1.00 15.00 A C -ATOM 629 NE2 HIS A 90 33.688 32.461 28.476 1.00 15.00 A N -ATOM 630 C HIS A 90 37.548 35.048 28.923 1.00 15.00 A C -ATOM 631 O HIS A 90 38.296 34.127 28.744 1.00 15.00 A O -ATOM 632 N PHE A 91 37.322 35.505 30.162 1.00 15.00 A N -ATOM 633 HN PHE A 91 36.711 36.258 30.301 1.00 15.00 A H -ATOM 634 CA PHE A 91 37.981 34.887 31.299 1.00 15.00 A C -ATOM 635 CB PHE A 91 37.615 35.640 32.583 1.00 15.00 A C -ATOM 636 CG PHE A 91 38.570 35.251 33.687 1.00 15.00 A C -ATOM 637 CD1 PHE A 91 38.322 34.107 34.466 1.00 15.00 A C -ATOM 638 CD2 PHE A 91 39.712 36.037 33.935 1.00 15.00 A C -ATOM 639 CE1 PHE A 91 39.217 33.746 35.493 1.00 15.00 A C -ATOM 640 CE2 PHE A 91 40.606 35.678 34.961 1.00 15.00 A C -ATOM 641 CZ PHE A 91 40.359 34.532 35.740 1.00 15.00 A C -ATOM 642 C PHE A 91 37.629 33.397 31.586 1.00 15.00 A C -ATOM 643 O PHE A 91 36.490 33.050 31.828 1.00 15.00 A O -ATOM 644 N GLY A 92 38.652 32.527 31.637 1.00 15.00 A N -ATOM 645 HN GLY A 92 39.557 32.844 31.435 1.00 15.00 A H -ATOM 646 CA GLY A 92 38.442 31.136 31.983 1.00 15.00 A C -ATOM 647 C GLY A 92 37.692 30.329 30.931 1.00 15.00 A C -ATOM 648 O GLY A 92 37.345 30.803 29.868 1.00 15.00 A O -ATOM 649 N ILE A 93 37.429 29.084 31.290 1.00 15.00 A N -ATOM 650 HN ILE A 93 37.733 28.783 32.172 1.00 15.00 A H -ATOM 651 CA ILE A 93 36.724 28.149 30.462 1.00 15.00 A C -ATOM 652 CB ILE A 93 37.626 26.986 30.060 1.00 15.00 A C -ATOM 653 CG1 ILE A 93 38.890 27.508 29.368 1.00 15.00 A C -ATOM 654 CG2 ILE A 93 36.887 25.990 29.164 1.00 15.00 A C -ATOM 655 CD1 ILE A 93 38.541 28.334 28.130 1.00 15.00 A C -ATOM 656 C ILE A 93 35.432 27.729 31.165 1.00 15.00 A C -ATOM 657 O ILE A 93 35.381 27.439 32.344 1.00 15.00 A O -ATOM 658 N ASP A 94 34.373 27.766 30.401 1.00 15.00 A N -ATOM 659 HN ASP A 94 34.483 28.008 29.458 1.00 15.00 A H -ATOM 660 CA ASP A 94 33.061 27.469 30.883 1.00 15.00 A C -ATOM 661 CB ASP A 94 32.843 26.015 31.315 1.00 15.00 A C -ATOM 662 CG ASP A 94 32.968 25.097 30.098 1.00 15.00 A C -ATOM 663 OD1 ASP A 94 32.946 25.608 28.990 1.00 15.00 A O -ATOM 664 OD2 ASP A 94 33.082 23.898 30.293 1.00 15.00 A O -ATOM 665 C ASP A 94 32.701 28.346 32.105 1.00 15.00 A C -ATOM 666 O ASP A 94 31.893 27.959 32.926 1.00 15.00 A O -ATOM 667 N THR A 95 33.282 29.503 32.244 1.00 15.00 A N -ATOM 668 HN THR A 95 33.931 29.800 31.572 1.00 15.00 A H -ATOM 669 CA THR A 95 32.988 30.350 33.364 1.00 15.00 A C -ATOM 670 CB THR A 95 34.054 31.455 33.419 1.00 15.00 A C -ATOM 671 OG1 THR A 95 34.344 31.849 32.087 1.00 15.00 A O -ATOM 672 HG1 THR A 95 35.210 31.519 31.836 1.00 15.00 A H -ATOM 673 CG2 THR A 95 35.317 30.900 34.061 1.00 15.00 A C -ATOM 674 C THR A 95 31.528 30.879 33.436 1.00 15.00 A C -ATOM 675 O THR A 95 31.080 31.254 34.507 1.00 15.00 A O -ATOM 676 N VAL A 96 30.782 30.891 32.381 1.00 15.00 A N -ATOM 677 HN VAL A 96 31.152 30.592 31.524 1.00 15.00 A H -ATOM 678 CA VAL A 96 29.381 31.348 32.449 1.00 15.00 A C -ATOM 679 CB VAL A 96 28.584 31.190 31.131 1.00 15.00 A C -ATOM 680 CG1 VAL A 96 28.409 29.705 30.786 1.00 15.00 A C -ATOM 681 CG2 VAL A 96 27.207 31.845 31.279 1.00 15.00 A C -ATOM 682 C VAL A 96 28.626 30.511 33.479 1.00 15.00 A C -ATOM 683 O VAL A 96 27.717 30.980 34.136 1.00 15.00 A O -ATOM 684 N GLU A 97 28.993 29.262 33.611 1.00 15.00 A N -ATOM 685 HN GLU A 97 29.729 28.907 33.070 1.00 15.00 A H -ATOM 686 CA GLU A 97 28.307 28.401 34.562 1.00 15.00 A C -ATOM 687 CB GLU A 97 28.741 26.911 34.483 1.00 15.00 A C -ATOM 688 CG GLU A 97 28.385 26.340 33.107 1.00 15.00 A C -ATOM 689 CD GLU A 97 26.865 26.325 32.931 1.00 15.00 A C -ATOM 690 OE1 GLU A 97 26.171 26.412 33.930 1.00 15.00 A O -ATOM 691 OE2 GLU A 97 26.421 26.226 31.799 1.00 15.00 A O -ATOM 692 C GLU A 97 28.385 28.958 36.024 1.00 15.00 A C -ATOM 693 O GLU A 97 27.562 28.608 36.847 1.00 15.00 A O -ATOM 694 N LEU A 98 29.308 29.828 36.357 1.00 15.00 A N -ATOM 695 HN LEU A 98 29.971 30.108 35.691 1.00 15.00 A H -ATOM 696 CA LEU A 98 29.363 30.382 37.694 1.00 15.00 A C -ATOM 697 CB LEU A 98 30.741 30.978 37.954 1.00 15.00 A C -ATOM 698 CG LEU A 98 31.698 29.928 38.520 1.00 15.00 A C -ATOM 699 CD1 LEU A 98 31.504 28.595 37.792 1.00 15.00 A C -ATOM 700 CD2 LEU A 98 33.135 30.420 38.330 1.00 15.00 A C -ATOM 701 C LEU A 98 28.312 31.510 37.955 1.00 15.00 A C -ATOM 702 O LEU A 98 28.220 32.041 39.045 1.00 15.00 A O -ATOM 703 N LYS A 99 27.577 31.863 36.971 1.00 15.00 A N -ATOM 704 HN LYS A 99 27.712 31.396 36.120 1.00 15.00 A H -ATOM 705 CA LYS A 99 26.555 32.901 37.008 1.00 15.00 A C -ATOM 706 CB LYS A 99 25.223 32.439 37.615 1.00 15.00 A C -ATOM 707 CG LYS A 99 24.651 31.293 36.776 1.00 15.00 A C -ATOM 708 CD LYS A 99 23.216 30.990 37.224 1.00 15.00 A C -ATOM 709 CE LYS A 99 23.211 30.462 38.665 1.00 15.00 A C -ATOM 710 NZ LYS A 99 23.257 31.609 39.615 1.00 15.00 A N -ATOM 711 HZ1 LYS A 99 24.143 32.140 39.493 1.00 15.00 A H -ATOM 712 HZ2 LYS A 99 23.205 31.264 40.595 1.00 15.00 A H -ATOM 713 HZ3 LYS A 99 22.455 32.249 39.442 1.00 15.00 A H -ATOM 714 C LYS A 99 26.975 34.234 37.619 1.00 15.00 A C -ATOM 715 O LYS A 99 26.239 34.837 38.374 1.00 15.00 A O -ATOM 716 N GLY A 100 28.118 34.736 37.243 1.00 15.00 A N -ATOM 717 HN GLY A 100 28.692 34.226 36.634 1.00 15.00 A H -ATOM 718 CA GLY A 100 28.547 36.049 37.723 1.00 15.00 A C -ATOM 719 C GLY A 100 29.380 36.040 39.021 1.00 15.00 A C -ATOM 720 O GLY A 100 29.981 37.037 39.387 1.00 15.00 A O -ATOM 721 N GLU A 101 29.409 34.955 39.706 1.00 15.00 A N -ATOM 722 HN GLU A 101 28.913 34.176 39.380 1.00 15.00 A H -ATOM 723 CA GLU A 101 30.155 34.843 40.952 1.00 15.00 A C -ATOM 724 CB GLU A 101 29.936 33.470 41.602 1.00 15.00 A C -ATOM 725 CG GLU A 101 29.601 33.592 43.122 1.00 15.00 A C -ATOM 726 CD GLU A 101 30.363 32.545 43.942 1.00 15.00 A C -ATOM 727 OE1 GLU A 101 30.358 31.390 43.543 1.00 15.00 A O -ATOM 728 OE2 GLU A 101 30.925 32.918 44.965 1.00 15.00 A O -ATOM 729 C GLU A 101 31.670 35.057 40.741 1.00 15.00 A C -ATOM 730 O GLU A 101 32.304 34.329 40.002 1.00 15.00 A O -ATOM 731 N GLY A 102 32.242 36.057 41.425 1.00 15.00 A N -ATOM 732 HN GLY A 102 31.676 36.614 41.999 1.00 15.00 A H -ATOM 733 CA GLY A 102 33.663 36.346 41.348 1.00 15.00 A C -ATOM 734 C GLY A 102 34.037 37.460 40.386 1.00 15.00 A C -ATOM 735 O GLY A 102 35.165 37.871 40.347 1.00 15.00 A O -ATOM 736 N PHE A 103 33.101 37.932 39.646 1.00 15.00 A N -ATOM 737 HN PHE A 103 32.211 37.527 39.716 1.00 15.00 A H -ATOM 738 CA PHE A 103 33.278 39.036 38.705 1.00 15.00 A C -ATOM 739 CB PHE A 103 32.807 38.647 37.280 1.00 15.00 A C -ATOM 740 CG PHE A 103 33.515 37.392 36.833 1.00 15.00 A C -ATOM 741 CD1 PHE A 103 34.812 37.464 36.328 1.00 15.00 A C -ATOM 742 CD2 PHE A 103 32.862 36.158 36.911 1.00 15.00 A C -ATOM 743 CE1 PHE A 103 35.458 36.300 35.894 1.00 15.00 A C -ATOM 744 CE2 PHE A 103 33.506 34.994 36.483 1.00 15.00 A C -ATOM 745 CZ PHE A 103 34.804 35.065 35.971 1.00 15.00 A C -ATOM 746 C PHE A 103 32.430 40.259 39.120 1.00 15.00 A C -ATOM 747 O PHE A 103 31.382 40.132 39.721 1.00 15.00 A O -ATOM 748 N LYS A 104 32.896 41.432 38.742 1.00 15.00 A N -ATOM 749 HN LYS A 104 33.757 41.451 38.274 1.00 15.00 A H -ATOM 750 CA LYS A 104 32.228 42.690 38.968 1.00 15.00 A C -ATOM 751 CB LYS A 104 32.642 43.452 40.217 1.00 15.00 A C -ATOM 752 CG LYS A 104 32.857 42.506 41.420 1.00 15.00 A C -ATOM 753 CD LYS A 104 34.239 41.818 41.348 1.00 15.00 A C -ATOM 754 CE LYS A 104 34.229 40.470 42.093 1.00 15.00 A C -ATOM 755 NZ LYS A 104 35.477 39.704 41.796 1.00 15.00 A N -ATOM 756 HZ1 LYS A 104 36.311 40.247 42.100 1.00 15.00 A H -ATOM 757 HZ2 LYS A 104 35.550 39.521 40.775 1.00 15.00 A H -ATOM 758 HZ3 LYS A 104 35.466 38.794 42.300 1.00 15.00 A H -ATOM 759 C LYS A 104 32.422 43.580 37.763 1.00 15.00 A C -ATOM 760 O LYS A 104 33.520 44.017 37.472 1.00 15.00 A O -ATOM 761 N ARG A 105 31.345 43.858 37.070 1.00 15.00 A N -ATOM 762 HN ARG A 105 30.482 43.478 37.337 1.00 15.00 A H -ATOM 763 CA ARG A 105 31.422 44.722 35.913 1.00 15.00 A C -ATOM 764 CB ARG A 105 30.170 44.662 35.063 1.00 15.00 A C -ATOM 765 CG ARG A 105 29.981 45.853 34.129 1.00 15.00 A C -ATOM 766 CD ARG A 105 28.582 45.813 33.476 1.00 15.00 A C -ATOM 767 NE ARG A 105 28.176 44.391 33.193 1.00 15.00 A N -ATOM 768 HE ARG A 105 28.592 43.670 33.711 1.00 15.00 A H -ATOM 769 CZ ARG A 105 27.284 44.106 32.274 1.00 15.00 A C -ATOM 770 NH1 ARG A 105 26.790 45.062 31.516 1.00 15.00 A N -ATOM 771 HH11 ARG A 105 27.107 46.044 31.645 1.00 15.00 A H -ATOM 772 HH12 ARG A 105 26.083 44.835 30.788 1.00 15.00 A H -ATOM 773 NH2 ARG A 105 26.890 42.873 32.087 1.00 15.00 A N -ATOM 774 HH21 ARG A 105 26.182 42.660 31.356 1.00 15.00 A H -ATOM 775 HH22 ARG A 105 27.283 42.107 32.666 1.00 15.00 A H -ATOM 776 C ARG A 105 31.755 46.083 36.329 1.00 15.00 A C -ATOM 777 O ARG A 105 31.069 46.672 37.144 1.00 15.00 A O -ATOM 778 N ILE A 106 32.834 46.629 35.785 1.00 15.00 A N -ATOM 779 HN ILE A 106 33.387 46.159 35.126 1.00 15.00 A H -ATOM 780 CA ILE A 106 33.127 47.940 36.226 1.00 15.00 A C -ATOM 781 CB ILE A 106 34.587 48.049 36.605 1.00 15.00 A C -ATOM 782 CG1 ILE A 106 34.931 47.101 37.746 1.00 15.00 A C -ATOM 783 CG2 ILE A 106 34.973 49.502 36.933 1.00 15.00 A C -ATOM 784 CD1 ILE A 106 34.335 47.554 39.080 1.00 15.00 A C -ATOM 785 C ILE A 106 32.774 48.896 35.118 1.00 15.00 A C -ATOM 786 O ILE A 106 32.323 49.999 35.369 1.00 15.00 A O -ATOM 787 N ALA A 107 32.968 48.498 33.880 1.00 15.00 A N -ATOM 788 HN ALA A 107 33.321 47.603 33.692 1.00 15.00 A H -ATOM 789 CA ALA A 107 32.652 49.400 32.809 1.00 15.00 A C -ATOM 790 CB ALA A 107 33.688 49.282 31.697 1.00 15.00 A C -ATOM 791 C ALA A 107 31.241 49.164 32.249 1.00 15.00 A C -ATOM 792 O ALA A 107 30.533 48.272 32.683 1.00 15.00 A O -ATOM 793 N GLU A 108 30.832 49.981 31.266 1.00 15.00 A N -ATOM 794 HN GLU A 108 31.425 50.696 30.954 1.00 15.00 A H -ATOM 795 CA GLU A 108 29.516 49.819 30.654 1.00 15.00 A C -ATOM 796 CB GLU A 108 28.666 51.102 30.727 1.00 15.00 A C -ATOM 797 CG GLU A 108 28.699 51.805 32.080 1.00 15.00 A C -ATOM 798 CD GLU A 108 27.819 53.060 31.992 1.00 15.00 A C -ATOM 799 OE1 GLU A 108 27.467 53.447 30.883 1.00 15.00 A O -ATOM 800 OE2 GLU A 108 27.503 53.607 33.039 1.00 15.00 A O -ATOM 801 C GLU A 108 29.598 49.502 29.161 1.00 15.00 A C -ATOM 802 O GLU A 108 30.503 49.943 28.485 1.00 15.00 A O -ATOM 803 N GLU A 109 28.613 48.790 28.621 1.00 15.00 A N -ATOM 804 HN GLU A 109 27.895 48.424 29.179 1.00 15.00 A H -ATOM 805 CA GLU A 109 28.624 48.563 27.164 1.00 15.00 A C -ATOM 806 CB GLU A 109 27.573 47.598 26.537 1.00 15.00 A C -ATOM 807 CG GLU A 109 27.709 46.212 27.140 1.00 15.00 A C -ATOM 808 CD GLU A 109 26.631 45.298 26.557 1.00 15.00 A C -ATOM 809 OE1 GLU A 109 25.843 45.778 25.758 1.00 15.00 A O -ATOM 810 OE2 GLU A 109 26.604 44.137 26.926 1.00 15.00 A O -ATOM 811 C GLU A 109 28.551 49.935 26.469 1.00 15.00 A C -ATOM 812 O GLU A 109 27.810 50.815 26.861 1.00 15.00 A O -ATOM 813 N GLY A 110 29.344 50.106 25.433 1.00 15.00 A N -ATOM 814 HN GLY A 110 29.921 49.362 25.161 1.00 15.00 A H -ATOM 815 CA GLY A 110 29.399 51.366 24.668 1.00 15.00 A C -ATOM 816 C GLY A 110 30.417 52.318 25.239 1.00 15.00 A C -ATOM 817 O GLY A 110 30.672 53.377 24.691 1.00 15.00 A O -ATOM 818 N GLN A 111 31.000 51.967 26.333 1.00 15.00 A N -ATOM 819 HN GLN A 111 30.777 51.119 26.771 1.00 15.00 A H -ATOM 820 CA GLN A 111 31.983 52.848 26.895 1.00 15.00 A C -ATOM 821 CB GLN A 111 32.432 52.339 28.287 1.00 15.00 A C -ATOM 822 CG GLN A 111 33.037 53.489 29.104 1.00 15.00 A C -ATOM 823 CD GLN A 111 33.268 53.040 30.542 1.00 15.00 A C -ATOM 824 OE1 GLN A 111 32.370 52.527 31.192 1.00 15.00 A O -ATOM 825 NE2 GLN A 111 34.451 53.223 31.064 1.00 15.00 A N -ATOM 826 HE21 GLN A 111 35.142 53.642 30.509 1.00 15.00 A H -ATOM 827 HE22 GLN A 111 34.599 52.934 31.989 1.00 15.00 A H -ATOM 828 C GLN A 111 33.220 52.993 26.017 1.00 15.00 A C -ATOM 829 O GLN A 111 33.776 52.043 25.495 1.00 15.00 A O -ATOM 830 N ARG A 112 33.671 54.218 25.927 1.00 15.00 A N -ATOM 831 HN ARG A 112 33.166 54.940 26.357 1.00 15.00 A H -ATOM 832 CA ARG A 112 34.866 54.540 25.229 1.00 15.00 A C -ATOM 833 CB ARG A 112 34.852 55.918 24.588 1.00 15.00 A C -ATOM 834 CG ARG A 112 35.198 55.803 23.085 1.00 15.00 A C -ATOM 835 CD ARG A 112 34.867 57.120 22.329 1.00 15.00 A C -ATOM 836 NE ARG A 112 36.005 57.637 21.512 1.00 15.00 A N -ATOM 837 HE ARG A 112 36.149 58.606 21.499 1.00 15.00 A H -ATOM 838 CZ ARG A 112 36.794 56.891 20.836 1.00 15.00 A C -ATOM 839 NH1 ARG A 112 36.488 55.623 20.643 1.00 15.00 A N -ATOM 840 HH11 ARG A 112 35.609 55.234 21.038 1.00 15.00 A H -ATOM 841 HH12 ARG A 112 37.127 55.012 20.095 1.00 15.00 A H -ATOM 842 NH2 ARG A 112 37.852 57.402 20.268 1.00 15.00 A N -ATOM 843 HH21 ARG A 112 38.055 58.417 20.365 1.00 15.00 A H -ATOM 844 HH22 ARG A 112 38.492 56.794 19.719 1.00 15.00 A H -ATOM 845 C ARG A 112 35.998 54.363 26.183 1.00 15.00 A C -ATOM 846 O ARG A 112 35.928 54.792 27.322 1.00 15.00 A O -ATOM 847 N VAL A 113 37.042 53.689 25.755 1.00 15.00 A N -ATOM 848 HN VAL A 113 37.091 53.358 24.834 1.00 15.00 A H -ATOM 849 CA VAL A 113 38.113 53.455 26.693 1.00 15.00 A C -ATOM 850 CB VAL A 113 38.091 52.029 27.244 1.00 15.00 A C -ATOM 851 CG1 VAL A 113 36.789 51.764 27.999 1.00 15.00 A C -ATOM 852 CG2 VAL A 113 38.256 51.019 26.111 1.00 15.00 A C -ATOM 853 C VAL A 113 39.448 53.595 26.089 1.00 15.00 A C -ATOM 854 O VAL A 113 39.660 53.456 24.897 1.00 15.00 A O -ATOM 855 N LYS A 114 40.358 53.787 26.977 1.00 15.00 A N -ATOM 856 HN LYS A 114 40.094 53.901 27.914 1.00 15.00 A H -ATOM 857 CA LYS A 114 41.739 53.839 26.635 1.00 15.00 A C -ATOM 858 CB LYS A 114 42.454 55.038 27.227 1.00 15.00 A C -ATOM 859 CG LYS A 114 41.910 56.369 26.670 1.00 15.00 A C -ATOM 860 CD LYS A 114 41.487 57.340 27.796 1.00 15.00 A C -ATOM 861 CE LYS A 114 40.492 56.687 28.779 1.00 15.00 A C -ATOM 862 NZ LYS A 114 40.461 57.426 30.075 1.00 15.00 A N -ATOM 863 HZ1 LYS A 114 41.405 57.422 30.512 1.00 15.00 A H -ATOM 864 HZ2 LYS A 114 39.788 56.976 30.727 1.00 15.00 A H -ATOM 865 HZ3 LYS A 114 40.168 58.412 29.918 1.00 15.00 A H -ATOM 866 C LYS A 114 42.414 52.614 27.195 1.00 15.00 A C -ATOM 867 O LYS A 114 41.971 52.030 28.169 1.00 15.00 A O -ATOM 868 N VAL A 115 43.507 52.259 26.616 1.00 15.00 A N -ATOM 869 HN VAL A 115 43.821 52.752 25.835 1.00 15.00 A H -ATOM 870 CA VAL A 115 44.274 51.158 27.108 1.00 15.00 A C -ATOM 871 CB VAL A 115 45.653 51.216 26.494 1.00 15.00 A C -ATOM 872 CG1 VAL A 115 46.467 49.992 26.928 1.00 15.00 A C -ATOM 873 CG2 VAL A 115 45.512 51.219 24.954 1.00 15.00 A C -ATOM 874 C VAL A 115 44.437 51.218 28.626 1.00 15.00 A C -ATOM 875 O VAL A 115 44.738 52.250 29.194 1.00 15.00 A O -ATOM 876 N GLY A 116 44.263 50.094 29.283 1.00 15.00 A N -ATOM 877 HN GLY A 116 44.012 49.284 28.791 1.00 15.00 A H -ATOM 878 CA GLY A 116 44.437 50.039 30.711 1.00 15.00 A C -ATOM 879 C GLY A 116 43.170 50.347 31.516 1.00 15.00 A C -ATOM 880 O GLY A 116 43.124 50.096 32.703 1.00 15.00 A O -ATOM 881 N ASP A 117 42.155 50.866 30.907 1.00 15.00 A N -ATOM 882 HN ASP A 117 42.215 51.065 29.949 1.00 15.00 A H -ATOM 883 CA ASP A 117 40.906 51.163 31.638 1.00 15.00 A C -ATOM 884 CB ASP A 117 39.916 51.977 30.757 1.00 15.00 A C -ATOM 885 CG ASP A 117 40.290 53.445 30.606 1.00 15.00 A C -ATOM 886 OD1 ASP A 117 41.131 53.929 31.350 1.00 15.00 A O -ATOM 887 OD2 ASP A 117 39.689 54.066 29.741 1.00 15.00 A O -ATOM 888 C ASP A 117 40.301 49.874 32.169 1.00 15.00 A C -ATOM 889 O ASP A 117 40.273 48.866 31.494 1.00 15.00 A O -ATOM 890 N THR A 118 39.840 49.898 33.418 1.00 15.00 A N -ATOM 891 HN THR A 118 39.870 50.728 33.938 1.00 15.00 A H -ATOM 892 CA THR A 118 39.283 48.667 34.016 1.00 15.00 A C -ATOM 893 CB THR A 118 39.280 48.644 35.577 1.00 15.00 A C -ATOM 894 OG1 THR A 118 40.573 48.983 36.052 1.00 15.00 A O -ATOM 895 HG1 THR A 118 40.503 49.350 36.936 1.00 15.00 A H -ATOM 896 CG2 THR A 118 38.881 47.270 36.127 1.00 15.00 A C -ATOM 897 C THR A 118 37.904 48.393 33.499 1.00 15.00 A C -ATOM 898 O THR A 118 37.035 49.247 33.442 1.00 15.00 A O -ATOM 899 N VAL A 119 37.729 47.154 33.115 1.00 15.00 A N -ATOM 900 HN VAL A 119 38.476 46.524 33.188 1.00 15.00 A H -ATOM 901 CA VAL A 119 36.503 46.699 32.601 1.00 15.00 A C -ATOM 902 CB VAL A 119 36.746 45.897 31.302 1.00 15.00 A C -ATOM 903 CG1 VAL A 119 35.407 45.478 30.686 1.00 15.00 A C -ATOM 904 CG2 VAL A 119 37.548 46.716 30.287 1.00 15.00 A C -ATOM 905 C VAL A 119 35.812 45.846 33.639 1.00 15.00 A C -ATOM 906 O VAL A 119 34.637 46.013 33.916 1.00 15.00 A O -ATOM 907 N ILE A 120 36.539 44.928 34.199 1.00 15.00 A N -ATOM 908 HN ILE A 120 37.487 44.859 33.959 1.00 15.00 A H -ATOM 909 CA ILE A 120 35.997 44.014 35.157 1.00 15.00 A C -ATOM 910 CB ILE A 120 35.564 42.765 34.443 1.00 15.00 A C -ATOM 911 CG1 ILE A 120 34.228 42.991 33.688 1.00 15.00 A C -ATOM 912 CG2 ILE A 120 35.419 41.584 35.433 1.00 15.00 A C -ATOM 913 CD1 ILE A 120 34.138 42.129 32.422 1.00 15.00 A C -ATOM 914 C ILE A 120 36.964 43.577 36.189 1.00 15.00 A C -ATOM 915 O ILE A 120 38.118 43.318 35.893 1.00 15.00 A O -ATOM 916 N GLU A 121 36.480 43.404 37.412 1.00 15.00 A N -ATOM 917 HN GLU A 121 35.548 43.614 37.631 1.00 15.00 A H -ATOM 918 CA GLU A 121 37.392 42.893 38.402 1.00 15.00 A C -ATOM 919 CB GLU A 121 37.539 43.810 39.621 1.00 15.00 A C -ATOM 920 CG GLU A 121 37.782 45.230 39.136 1.00 15.00 A C -ATOM 921 CD GLU A 121 37.721 46.193 40.316 1.00 15.00 A C -ATOM 922 OE1 GLU A 121 37.022 45.874 41.268 1.00 15.00 A O -ATOM 923 OE2 GLU A 121 38.371 47.225 40.255 1.00 15.00 A O -ATOM 924 C GLU A 121 36.933 41.529 38.763 1.00 15.00 A C -ATOM 925 O GLU A 121 35.761 41.230 38.715 1.00 15.00 A O -ATOM 926 N PHE A 122 37.864 40.682 39.079 1.00 15.00 A N -ATOM 927 HN PHE A 122 38.802 40.967 39.079 1.00 15.00 A H -ATOM 928 CA PHE A 122 37.530 39.336 39.427 1.00 15.00 A C -ATOM 929 CB PHE A 122 37.927 38.408 38.240 1.00 15.00 A C -ATOM 930 CG PHE A 122 39.362 38.595 37.783 1.00 15.00 A C -ATOM 931 CD1 PHE A 122 40.398 37.866 38.379 1.00 15.00 A C -ATOM 932 CD2 PHE A 122 39.645 39.440 36.703 1.00 15.00 A C -ATOM 933 CE1 PHE A 122 41.710 37.983 37.898 1.00 15.00 A C -ATOM 934 CE2 PHE A 122 40.956 39.562 36.229 1.00 15.00 A C -ATOM 935 CZ PHE A 122 41.988 38.832 36.823 1.00 15.00 A C -ATOM 936 C PHE A 122 38.257 38.884 40.709 1.00 15.00 A C -ATOM 937 O PHE A 122 39.232 39.469 41.138 1.00 15.00 A O -ATOM 938 N ASP A 123 37.753 37.805 41.274 1.00 15.00 A N -ATOM 939 HN ASP A 123 36.949 37.415 40.872 1.00 15.00 A H -ATOM 940 CA ASP A 123 38.306 37.148 42.458 1.00 15.00 A C -ATOM 941 CB ASP A 123 37.167 36.627 43.320 1.00 15.00 A C -ATOM 942 CG ASP A 123 37.636 36.259 44.727 1.00 15.00 A C -ATOM 943 OD1 ASP A 123 38.572 35.494 44.837 1.00 15.00 A O -ATOM 944 OD2 ASP A 123 37.024 36.726 45.676 1.00 15.00 A O -ATOM 945 C ASP A 123 39.124 35.922 42.037 1.00 15.00 A C -ATOM 946 O ASP A 123 38.567 34.873 41.780 1.00 15.00 A O -ATOM 947 N LEU A 124 40.408 36.025 41.937 1.00 15.00 A N -ATOM 948 HN LEU A 124 40.858 36.860 42.183 1.00 15.00 A H -ATOM 949 CA LEU A 124 41.177 34.891 41.456 1.00 15.00 A C -ATOM 950 CB LEU A 124 42.671 35.275 41.319 1.00 15.00 A C -ATOM 951 CG LEU A 124 43.506 34.374 40.342 1.00 15.00 A C -ATOM 952 CD1 LEU A 124 42.709 33.855 39.142 1.00 15.00 A C -ATOM 953 CD2 LEU A 124 44.698 35.182 39.800 1.00 15.00 A C -ATOM 954 C LEU A 124 41.061 33.622 42.262 1.00 15.00 A C -ATOM 955 O LEU A 124 40.787 32.556 41.727 1.00 15.00 A O -ATOM 956 N PRO A 125 41.317 33.692 43.480 1.00 15.00 A N -ATOM 957 CA PRO A 125 41.324 32.514 44.319 1.00 15.00 A C -ATOM 958 CB PRO A 125 41.611 33.060 45.712 1.00 15.00 A C -ATOM 959 CG PRO A 125 42.125 34.455 45.560 1.00 15.00 A C -ATOM 960 CD PRO A 125 41.571 34.943 44.249 1.00 15.00 A C -ATOM 961 C PRO A 125 39.962 31.809 44.233 1.00 15.00 A C -ATOM 962 O PRO A 125 39.886 30.604 44.076 1.00 15.00 A O -ATOM 963 N LEU A 126 38.891 32.568 44.304 1.00 15.00 A N -ATOM 964 HN LEU A 126 38.991 33.533 44.440 1.00 15.00 A H -ATOM 965 CA LEU A 126 37.557 31.995 44.183 1.00 15.00 A C -ATOM 966 CB LEU A 126 36.423 33.047 44.393 1.00 15.00 A C -ATOM 967 CG LEU A 126 35.045 32.742 43.758 1.00 15.00 A C -ATOM 968 CD1 LEU A 126 34.663 31.304 43.892 1.00 15.00 A C -ATOM 969 CD2 LEU A 126 33.954 33.569 44.457 1.00 15.00 A C -ATOM 970 C LEU A 126 37.449 31.246 42.841 1.00 15.00 A C -ATOM 971 O LEU A 126 37.058 30.091 42.795 1.00 15.00 A O -ATOM 972 N LEU A 127 37.800 31.870 41.779 1.00 15.00 A N -ATOM 973 HN LEU A 127 38.141 32.785 41.857 1.00 15.00 A H -ATOM 974 CA LEU A 127 37.708 31.261 40.455 1.00 15.00 A C -ATOM 975 CB LEU A 127 38.013 32.319 39.392 1.00 15.00 A C -ATOM 976 CG LEU A 127 37.016 33.458 39.454 1.00 15.00 A C -ATOM 977 CD1 LEU A 127 37.561 34.632 38.642 1.00 15.00 A C -ATOM 978 CD2 LEU A 127 35.699 32.990 38.839 1.00 15.00 A C -ATOM 979 C LEU A 127 38.689 30.140 40.281 1.00 15.00 A C -ATOM 980 O LEU A 127 38.451 29.195 39.551 1.00 15.00 A O -ATOM 981 N GLU A 128 39.796 30.230 40.913 1.00 15.00 A N -ATOM 982 HN GLU A 128 39.986 31.004 41.483 1.00 15.00 A H -ATOM 983 CA GLU A 128 40.757 29.171 40.770 1.00 15.00 A C -ATOM 984 CB GLU A 128 42.055 29.531 41.454 1.00 15.00 A C -ATOM 985 CG GLU A 128 43.001 30.188 40.444 1.00 15.00 A C -ATOM 986 CD GLU A 128 44.366 30.420 41.068 1.00 15.00 A C -ATOM 987 OE1 GLU A 128 44.452 30.421 42.286 1.00 15.00 A O -ATOM 988 OE2 GLU A 128 45.311 30.582 40.306 1.00 15.00 A O -ATOM 989 C GLU A 128 40.135 27.936 41.376 1.00 15.00 A C -ATOM 990 O GLU A 128 40.266 26.837 40.872 1.00 15.00 A O -ATOM 991 N GLU A 129 39.423 28.142 42.446 1.00 15.00 A N -ATOM 992 HN GLU A 129 39.354 29.048 42.814 1.00 15.00 A H -ATOM 993 CA GLU A 129 38.732 27.050 43.099 1.00 15.00 A C -ATOM 994 CB GLU A 129 38.267 27.444 44.497 1.00 15.00 A C -ATOM 995 CG GLU A 129 37.519 26.265 45.158 1.00 15.00 A C -ATOM 996 CD GLU A 129 37.663 26.311 46.681 1.00 15.00 A C -ATOM 997 OE1 GLU A 129 38.697 25.888 47.180 1.00 15.00 A O -ATOM 998 OE2 GLU A 129 36.720 26.756 47.321 1.00 15.00 A O -ATOM 999 C GLU A 129 37.481 26.600 42.359 1.00 15.00 A C -ATOM 1000 O GLU A 129 37.204 25.416 42.284 1.00 15.00 A O -ATOM 1001 N LYS A 130 36.688 27.514 41.863 1.00 15.00 A N -ATOM 1002 HN LYS A 130 36.932 28.462 41.916 1.00 15.00 A H -ATOM 1003 CA LYS A 130 35.447 27.115 41.235 1.00 15.00 A C -ATOM 1004 CB LYS A 130 34.311 28.041 41.596 1.00 15.00 A C -ATOM 1005 CG LYS A 130 34.255 28.297 43.102 1.00 15.00 A C -ATOM 1006 CD LYS A 130 32.902 27.866 43.741 1.00 15.00 A C -ATOM 1007 CE LYS A 130 33.114 26.771 44.808 1.00 15.00 A C -ATOM 1008 NZ LYS A 130 32.239 25.609 44.524 1.00 15.00 A N -ATOM 1009 HZ1 LYS A 130 31.241 25.902 44.536 1.00 15.00 A H -ATOM 1010 HZ2 LYS A 130 32.381 24.871 45.242 1.00 15.00 A H -ATOM 1011 HZ3 LYS A 130 32.462 25.214 43.588 1.00 15.00 A H -ATOM 1012 C LYS A 130 35.480 26.941 39.729 1.00 15.00 A C -ATOM 1013 O LYS A 130 34.707 26.168 39.194 1.00 15.00 A O -ATOM 1014 N ALA A 131 36.285 27.625 39.039 1.00 15.00 A N -ATOM 1015 HN ALA A 131 36.918 28.228 39.482 1.00 15.00 A H -ATOM 1016 CA ALA A 131 36.276 27.522 37.604 1.00 15.00 A C -ATOM 1017 CB ALA A 131 36.850 28.805 37.039 1.00 15.00 A C -ATOM 1018 C ALA A 131 36.974 26.294 37.033 1.00 15.00 A C -ATOM 1019 O ALA A 131 37.992 25.851 37.521 1.00 15.00 A O -ATOM 1020 N LYS A 132 36.390 25.746 35.944 1.00 15.00 A N -ATOM 1021 HN LYS A 132 35.565 26.135 35.586 1.00 15.00 A H -ATOM 1022 CA LYS A 132 36.988 24.567 35.292 1.00 15.00 A C -ATOM 1023 CB LYS A 132 36.184 24.095 34.078 1.00 15.00 A C -ATOM 1024 CG LYS A 132 36.069 22.541 33.942 1.00 15.00 A C -ATOM 1025 CD LYS A 132 36.634 21.736 35.167 1.00 15.00 A C -ATOM 1026 CE LYS A 132 37.474 20.526 34.743 1.00 15.00 A C -ATOM 1027 NZ LYS A 132 38.781 20.535 35.478 1.00 15.00 A N -ATOM 1028 HZ1 LYS A 132 39.356 19.716 35.195 1.00 15.00 A H -ATOM 1029 HZ2 LYS A 132 38.615 20.489 36.503 1.00 15.00 A H -ATOM 1030 HZ3 LYS A 132 39.307 21.406 35.262 1.00 15.00 A H -ATOM 1031 C LYS A 132 38.448 24.904 34.918 1.00 15.00 A C -ATOM 1032 O LYS A 132 39.345 24.091 35.030 1.00 15.00 A O -ATOM 1033 N SER A 133 38.647 26.115 34.502 1.00 15.00 A N -ATOM 1034 HN SER A 133 37.867 26.704 34.433 1.00 15.00 A H -ATOM 1035 CA SER A 133 39.931 26.663 34.132 1.00 15.00 A C -ATOM 1036 CB SER A 133 40.509 26.060 32.859 1.00 15.00 A C -ATOM 1037 OG SER A 133 41.475 26.946 32.315 1.00 15.00 A O -ATOM 1038 HG SER A 133 42.142 26.442 31.843 1.00 15.00 A H -ATOM 1039 C SER A 133 39.870 28.195 34.077 1.00 15.00 A C -ATOM 1040 O SER A 133 38.878 28.786 33.696 1.00 15.00 A O -ATOM 1041 N THR A 134 40.979 28.815 34.491 1.00 15.00 A N -ATOM 1042 HN THR A 134 41.726 28.260 34.798 1.00 15.00 A H -ATOM 1043 CA THR A 134 41.150 30.260 34.516 1.00 15.00 A C -ATOM 1044 CB THR A 134 41.874 30.775 35.794 1.00 15.00 A C -ATOM 1045 OG1 THR A 134 43.184 30.245 35.892 1.00 15.00 A O -ATOM 1046 HG1 THR A 134 43.805 30.955 36.070 1.00 15.00 A H -ATOM 1047 CG2 THR A 134 41.063 30.398 37.029 1.00 15.00 A C -ATOM 1048 C THR A 134 41.865 30.736 33.256 1.00 15.00 A C -ATOM 1049 O THR A 134 42.072 31.925 33.054 1.00 15.00 A O -ATOM 1050 N LEU A 135 42.206 29.818 32.401 1.00 15.00 A N -ATOM 1051 HN LEU A 135 42.034 28.876 32.611 1.00 15.00 A H -ATOM 1052 CA LEU A 135 42.851 30.172 31.114 1.00 15.00 A C -ATOM 1053 CB LEU A 135 43.095 28.940 30.251 1.00 15.00 A C -ATOM 1054 CG LEU A 135 44.416 28.300 30.651 1.00 15.00 A C -ATOM 1055 CD1 LEU A 135 44.591 26.988 29.885 1.00 15.00 A C -ATOM 1056 CD2 LEU A 135 45.557 29.279 30.307 1.00 15.00 A C -ATOM 1057 C LEU A 135 41.913 31.153 30.389 1.00 15.00 A C -ATOM 1058 O LEU A 135 40.726 30.939 30.301 1.00 15.00 A O -ATOM 1059 N THR A 136 42.473 32.242 29.937 1.00 15.00 A N -ATOM 1060 HN THR A 136 43.448 32.309 30.010 1.00 15.00 A H -ATOM 1061 CA THR A 136 41.782 33.346 29.344 1.00 15.00 A C -ATOM 1062 CB THR A 136 41.979 34.564 30.264 1.00 15.00 A C -ATOM 1063 OG1 THR A 136 41.442 34.245 31.535 1.00 15.00 A O -ATOM 1064 HG1 THR A 136 41.550 33.306 31.702 1.00 15.00 A H -ATOM 1065 CG2 THR A 136 41.284 35.808 29.710 1.00 15.00 A C -ATOM 1066 C THR A 136 42.107 33.703 27.925 1.00 15.00 A C -ATOM 1067 O THR A 136 43.071 34.393 27.654 1.00 15.00 A O -ATOM 1068 N PRO A 137 41.300 33.226 26.972 1.00 15.00 A N -ATOM 1069 CA PRO A 137 41.627 33.557 25.602 1.00 15.00 A C -ATOM 1070 CB PRO A 137 40.575 32.831 24.752 1.00 15.00 A C -ATOM 1071 CG PRO A 137 39.806 31.908 25.652 1.00 15.00 A C -ATOM 1072 CD PRO A 137 40.193 32.244 27.090 1.00 15.00 A C -ATOM 1073 C PRO A 137 41.482 35.037 25.259 1.00 15.00 A C -ATOM 1074 O PRO A 137 40.543 35.699 25.661 1.00 15.00 A O -ATOM 1075 N VAL A 138 42.378 35.502 24.445 1.00 15.00 A N -ATOM 1076 HN VAL A 138 43.122 34.923 24.188 1.00 15.00 A H -ATOM 1077 CA VAL A 138 42.320 36.835 23.901 1.00 15.00 A C -ATOM 1078 CB VAL A 138 43.214 37.878 24.539 1.00 15.00 A C -ATOM 1079 CG1 VAL A 138 43.769 37.357 25.865 1.00 15.00 A C -ATOM 1080 CG2 VAL A 138 44.313 38.336 23.583 1.00 15.00 A C -ATOM 1081 C VAL A 138 42.399 36.658 22.428 1.00 15.00 A C -ATOM 1082 O VAL A 138 43.421 36.318 21.880 1.00 15.00 A O -ATOM 1083 N VAL A 139 41.243 36.821 21.765 1.00 15.00 A N -ATOM 1084 HN VAL A 139 40.425 37.090 22.233 1.00 15.00 A H -ATOM 1085 CA VAL A 139 41.244 36.590 20.358 1.00 15.00 A C -ATOM 1086 CB VAL A 139 40.539 35.280 19.995 1.00 15.00 A C -ATOM 1087 CG1 VAL A 139 41.143 34.120 20.758 1.00 15.00 A C -ATOM 1088 CG2 VAL A 139 39.051 35.382 20.312 1.00 15.00 A C -ATOM 1089 C VAL A 139 40.768 37.743 19.486 1.00 15.00 A C -ATOM 1090 O VAL A 139 40.067 38.649 19.901 1.00 15.00 A O -ATOM 1091 N ILE A 140 41.200 37.661 18.208 1.00 15.00 A N -ATOM 1092 HN ILE A 140 41.777 36.912 17.949 1.00 15.00 A H -ATOM 1093 CA ILE A 140 40.839 38.640 17.215 1.00 15.00 A C -ATOM 1094 CB ILE A 140 41.989 39.038 16.255 1.00 15.00 A C -ATOM 1095 CG1 ILE A 140 42.891 40.102 16.887 1.00 15.00 A C -ATOM 1096 CG2 ILE A 140 41.420 39.645 14.972 1.00 15.00 A C -ATOM 1097 CD1 ILE A 140 43.617 39.570 18.119 1.00 15.00 A C -ATOM 1098 C ILE A 140 39.691 38.029 16.485 1.00 15.00 A C -ATOM 1099 O ILE A 140 39.773 36.909 16.028 1.00 15.00 A O -ATOM 1100 N SER A 141 38.606 38.735 16.420 1.00 15.00 A N -ATOM 1101 HN SER A 141 38.596 39.645 16.784 1.00 15.00 A H -ATOM 1102 CA SER A 141 37.412 38.192 15.816 1.00 15.00 A C -ATOM 1103 CB SER A 141 36.167 38.436 16.665 1.00 15.00 A C -ATOM 1104 OG SER A 141 35.786 39.801 16.558 1.00 15.00 A O -ATOM 1105 HG SER A 141 34.888 39.858 16.225 1.00 15.00 A H -ATOM 1106 C SER A 141 37.215 38.653 14.333 1.00 15.00 A C -ATOM 1107 O SER A 141 36.312 38.250 13.626 1.00 15.00 A O -ATOM 1108 N ASN A 142 38.075 39.484 13.944 1.00 15.00 A N -ATOM 1109 HN ASN A 142 38.749 39.725 14.613 1.00 15.00 A H -ATOM 1110 CA ASN A 142 38.226 40.144 12.655 1.00 15.00 A C -ATOM 1111 CB ASN A 142 39.006 41.423 13.072 1.00 15.00 A C -ATOM 1112 CG ASN A 142 38.203 42.661 12.706 1.00 15.00 A C -ATOM 1113 OD1 ASN A 142 38.670 43.768 12.863 1.00 15.00 A O -ATOM 1114 ND2 ASN A 142 36.997 42.519 12.235 1.00 15.00 A N -ATOM 1115 HD21 ASN A 142 36.645 41.610 12.131 1.00 15.00 A H -ATOM 1116 HD22 ASN A 142 36.492 43.327 12.004 1.00 15.00 A H -ATOM 1117 C ASN A 142 39.261 39.480 11.712 1.00 15.00 A C -ATOM 1118 O ASN A 142 39.740 40.123 10.795 1.00 15.00 A O -ATOM 1119 N MET A 143 39.670 38.294 11.973 1.00 15.00 A N -ATOM 1120 HN MET A 143 39.261 37.796 12.712 1.00 15.00 A H -ATOM 1121 CA MET A 143 40.724 37.675 11.198 1.00 15.00 A C -ATOM 1122 CB MET A 143 40.833 36.159 11.443 1.00 15.00 A C -ATOM 1123 CG MET A 143 41.387 35.772 12.829 1.00 15.00 A C -ATOM 1124 SD MET A 143 42.837 36.758 13.309 1.00 15.00 A S -ATOM 1125 CE MET A 143 44.113 35.861 12.380 1.00 15.00 A C -ATOM 1126 C MET A 143 40.762 38.056 9.693 1.00 15.00 A C -ATOM 1127 O MET A 143 41.817 38.359 9.160 1.00 15.00 A O -ATOM 1128 N ASP A 144 39.701 38.073 9.029 1.00 15.00 A N -ATOM 1129 HN ASP A 144 38.859 37.837 9.471 1.00 15.00 A H -ATOM 1130 CA ASP A 144 39.682 38.433 7.618 1.00 15.00 A C -ATOM 1131 CB ASP A 144 38.320 38.115 6.946 1.00 15.00 A C -ATOM 1132 CG ASP A 144 38.117 36.599 6.895 1.00 15.00 A C -ATOM 1133 OD1 ASP A 144 39.075 35.885 7.142 1.00 15.00 A O -ATOM 1134 OD2 ASP A 144 37.008 36.179 6.609 1.00 15.00 A O -ATOM 1135 C ASP A 144 40.100 39.857 7.366 1.00 15.00 A C -ATOM 1136 O ASP A 144 40.334 40.192 6.221 1.00 15.00 A O -ATOM 1137 N GLU A 145 40.218 40.717 8.354 1.00 15.00 A N -ATOM 1138 HN GLU A 145 40.035 40.458 9.278 1.00 15.00 A H -ATOM 1139 CA GLU A 145 40.632 42.069 8.015 1.00 15.00 A C -ATOM 1140 CB GLU A 145 39.708 43.156 8.624 1.00 15.00 A C -ATOM 1141 CG GLU A 145 38.232 42.752 8.480 1.00 15.00 A C -ATOM 1142 CD GLU A 145 37.345 43.689 9.311 1.00 15.00 A C -ATOM 1143 OE1 GLU A 145 37.840 44.728 9.730 1.00 15.00 A O -ATOM 1144 OE2 GLU A 145 36.188 43.349 9.521 1.00 15.00 A O -ATOM 1145 C GLU A 145 42.035 42.322 8.408 1.00 15.00 A C -ATOM 1146 O GLU A 145 42.451 43.469 8.423 1.00 15.00 A O -ATOM 1147 N ILE A 146 42.798 41.309 8.750 1.00 15.00 A N -ATOM 1148 HN ILE A 146 42.479 40.383 8.714 1.00 15.00 A H -ATOM 1149 CA ILE A 146 44.132 41.641 9.181 1.00 15.00 A C -ATOM 1150 CB ILE A 146 44.322 41.388 10.685 1.00 15.00 A C -ATOM 1151 CG1 ILE A 146 44.518 39.888 10.947 1.00 15.00 A C -ATOM 1152 CG2 ILE A 146 43.131 41.888 11.516 1.00 15.00 A C -ATOM 1153 CD1 ILE A 146 45.441 39.715 12.134 1.00 15.00 A C -ATOM 1154 C ILE A 146 45.224 41.015 8.339 1.00 15.00 A C -ATOM 1155 O ILE A 146 45.151 39.886 7.894 1.00 15.00 A O -ATOM 1156 N LYS A 147 46.267 41.806 8.113 1.00 15.00 A N -ATOM 1157 HN LYS A 147 46.284 42.713 8.484 1.00 15.00 A H -ATOM 1158 CA LYS A 147 47.392 41.323 7.309 1.00 15.00 A C -ATOM 1159 CB LYS A 147 48.194 42.424 6.592 1.00 15.00 A C -ATOM 1160 CG LYS A 147 48.813 41.956 5.239 1.00 15.00 A C -ATOM 1161 CD LYS A 147 47.756 41.372 4.248 1.00 15.00 A C -ATOM 1162 CE LYS A 147 48.376 41.134 2.853 1.00 15.00 A C -ATOM 1163 NZ LYS A 147 47.694 39.996 2.150 1.00 15.00 A N -ATOM 1164 HZ1 LYS A 147 46.682 40.206 2.029 1.00 15.00 A H -ATOM 1165 HZ2 LYS A 147 47.791 39.123 2.706 1.00 15.00 A H -ATOM 1166 HZ3 LYS A 147 48.122 39.847 1.214 1.00 15.00 A H -ATOM 1167 C LYS A 147 48.220 40.338 8.121 1.00 15.00 A C -ATOM 1168 O LYS A 147 48.397 39.207 7.693 1.00 15.00 A O -ATOM 1169 N GLU A 148 48.692 40.671 9.274 1.00 15.00 A N -ATOM 1170 HN GLU A 148 48.563 41.575 9.629 1.00 15.00 A H -ATOM 1171 CA GLU A 148 49.415 39.676 10.028 1.00 15.00 A C -ATOM 1172 CB GLU A 148 50.905 39.513 9.649 1.00 15.00 A C -ATOM 1173 CG GLU A 148 51.255 38.040 9.229 1.00 15.00 A C -ATOM 1174 CD GLU A 148 51.972 37.967 7.866 1.00 15.00 A C -ATOM 1175 OE1 GLU A 148 52.606 38.936 7.475 1.00 15.00 A O -ATOM 1176 OE2 GLU A 148 51.868 36.915 7.238 1.00 15.00 A O -ATOM 1177 C GLU A 148 49.258 39.805 11.526 1.00 15.00 A C -ATOM 1178 O GLU A 148 49.166 40.857 12.099 1.00 15.00 A O -ATOM 1179 N LEU A 149 49.258 38.620 12.107 1.00 15.00 A N -ATOM 1180 HN LEU A 149 49.315 37.836 11.521 1.00 15.00 A H -ATOM 1181 CA LEU A 149 49.183 38.379 13.500 1.00 15.00 A C -ATOM 1182 CB LEU A 149 47.959 37.504 13.799 1.00 15.00 A C -ATOM 1183 CG LEU A 149 47.313 37.817 15.166 1.00 15.00 A C -ATOM 1184 CD1 LEU A 149 45.790 37.715 15.048 1.00 15.00 A C -ATOM 1185 CD2 LEU A 149 47.794 36.801 16.198 1.00 15.00 A C -ATOM 1186 C LEU A 149 50.482 37.710 13.986 1.00 15.00 A C -ATOM 1187 O LEU A 149 50.785 36.571 13.679 1.00 15.00 A O -ATOM 1188 N ILE A 150 51.214 38.454 14.774 1.00 15.00 A N -ATOM 1189 HN ILE A 150 50.905 39.365 14.961 1.00 15.00 A H -ATOM 1190 CA ILE A 150 52.468 38.014 15.396 1.00 15.00 A C -ATOM 1191 CB ILE A 150 53.556 39.060 15.182 1.00 15.00 A C -ATOM 1192 CG1 ILE A 150 53.688 39.309 13.671 1.00 15.00 A C -ATOM 1193 CG2 ILE A 150 54.891 38.628 15.810 1.00 15.00 A C -ATOM 1194 CD1 ILE A 150 54.722 40.399 13.371 1.00 15.00 A C -ATOM 1195 C ILE A 150 52.210 37.832 16.902 1.00 15.00 A C -ATOM 1196 O ILE A 150 51.965 38.778 17.624 1.00 15.00 A O -ATOM 1197 N LYS A 151 52.260 36.604 17.342 1.00 15.00 A N -ATOM 1198 HN LYS A 151 52.467 35.896 16.697 1.00 15.00 A H -ATOM 1199 CA LYS A 151 52.029 36.215 18.723 1.00 15.00 A C -ATOM 1200 CB LYS A 151 51.425 34.806 18.827 1.00 15.00 A C -ATOM 1201 CG LYS A 151 50.160 34.638 17.970 1.00 15.00 A C -ATOM 1202 CD LYS A 151 49.438 33.319 18.349 1.00 15.00 A C -ATOM 1203 CE LYS A 151 48.354 32.961 17.303 1.00 15.00 A C -ATOM 1204 NZ LYS A 151 48.243 31.478 17.148 1.00 15.00 A N -ATOM 1205 HZ1 LYS A 151 47.513 31.246 16.444 1.00 15.00 A H -ATOM 1206 HZ2 LYS A 151 47.984 31.042 18.056 1.00 15.00 A H -ATOM 1207 HZ3 LYS A 151 49.152 31.083 16.833 1.00 15.00 A H -ATOM 1208 C LYS A 151 53.252 36.322 19.582 1.00 15.00 A C -ATOM 1209 O LYS A 151 54.316 35.829 19.253 1.00 15.00 A O -ATOM 1210 N LEU A 152 53.085 36.989 20.730 1.00 15.00 A N -ATOM 1211 HN LEU A 152 52.208 37.358 20.965 1.00 15.00 A H -ATOM 1212 CA LEU A 152 54.188 37.156 21.603 1.00 15.00 A C -ATOM 1213 CB LEU A 152 54.404 38.574 22.119 1.00 15.00 A C -ATOM 1214 CG LEU A 152 54.400 39.558 20.974 1.00 15.00 A C -ATOM 1215 CD1 LEU A 152 54.413 40.975 21.550 1.00 15.00 A C -ATOM 1216 CD2 LEU A 152 55.651 39.314 20.125 1.00 15.00 A C -ATOM 1217 C LEU A 152 54.241 36.105 22.653 1.00 15.00 A C -ATOM 1218 O LEU A 152 53.429 35.204 22.721 1.00 15.00 A O -ATOM 1219 N SER A 153 55.289 36.184 23.411 1.00 15.00 A N -ATOM 1220 HN SER A 153 55.899 36.943 23.303 1.00 15.00 A H -ATOM 1221 CA SER A 153 55.585 35.175 24.419 1.00 15.00 A C -ATOM 1222 CB SER A 153 56.882 34.538 23.944 1.00 15.00 A C -ATOM 1223 OG SER A 153 56.605 33.262 23.391 1.00 15.00 A O -ATOM 1224 HG SER A 153 56.961 32.580 23.965 1.00 15.00 A H -ATOM 1225 C SER A 153 55.921 35.736 25.815 1.00 15.00 A C -ATOM 1226 O SER A 153 56.357 36.865 25.956 1.00 15.00 A O -ATOM 1227 N GLY A 154 55.803 34.890 26.850 1.00 15.00 A N -ATOM 1228 HN GLY A 154 55.438 33.992 26.704 1.00 15.00 A H -ATOM 1229 CA GLY A 154 56.217 35.305 28.186 1.00 15.00 A C -ATOM 1230 C GLY A 154 55.149 35.758 29.183 1.00 15.00 A C -ATOM 1231 O GLY A 154 53.973 35.453 29.106 1.00 15.00 A O -ATOM 1232 N SER A 155 55.657 36.509 30.152 1.00 15.00 A N -ATOM 1233 HN SER A 155 56.617 36.703 30.125 1.00 15.00 A H -ATOM 1234 CA SER A 155 54.883 37.062 31.250 1.00 15.00 A C -ATOM 1235 CB SER A 155 55.730 37.023 32.509 1.00 15.00 A C -ATOM 1236 OG SER A 155 56.849 36.179 32.280 1.00 15.00 A O -ATOM 1237 HG SER A 155 57.439 36.594 31.647 1.00 15.00 A H -ATOM 1238 C SER A 155 54.448 38.474 30.916 1.00 15.00 A C -ATOM 1239 O SER A 155 55.174 39.219 30.291 1.00 15.00 A O -ATOM 1240 N VAL A 156 53.244 38.841 31.305 1.00 15.00 A N -ATOM 1241 HN VAL A 156 52.683 38.224 31.819 1.00 15.00 A H -ATOM 1242 CA VAL A 156 52.757 40.152 30.971 1.00 15.00 A C -ATOM 1243 CB VAL A 156 51.662 40.111 29.908 1.00 15.00 A C -ATOM 1244 CG1 VAL A 156 52.306 39.681 28.564 1.00 15.00 A C -ATOM 1245 CG2 VAL A 156 50.615 39.061 30.319 1.00 15.00 A C -ATOM 1246 C VAL A 156 52.195 40.793 32.155 1.00 15.00 A C -ATOM 1247 O VAL A 156 51.825 40.167 33.132 1.00 15.00 A O -ATOM 1248 N THR A 157 52.128 42.060 32.043 1.00 15.00 A N -ATOM 1249 HN THR A 157 52.435 42.488 31.217 1.00 15.00 A H -ATOM 1250 CA THR A 157 51.621 42.854 33.086 1.00 15.00 A C -ATOM 1251 CB THR A 157 52.814 43.687 33.679 1.00 15.00 A C -ATOM 1252 OG1 THR A 157 53.704 42.823 34.376 1.00 15.00 A O -ATOM 1253 HG1 THR A 157 53.735 43.075 35.302 1.00 15.00 A H -ATOM 1254 CG2 THR A 157 52.306 44.782 34.617 1.00 15.00 A C -ATOM 1255 C THR A 157 50.437 43.677 32.535 1.00 15.00 A C -ATOM 1256 O THR A 157 50.551 44.402 31.568 1.00 15.00 A O -ATOM 1257 N VAL A 158 49.287 43.519 33.190 1.00 15.00 A N -ATOM 1258 HN VAL A 158 49.267 42.899 33.949 1.00 15.00 A H -ATOM 1259 CA VAL A 158 48.065 44.213 32.842 1.00 15.00 A C -ATOM 1260 CB VAL A 158 47.008 44.118 33.989 1.00 15.00 A C -ATOM 1261 CG1 VAL A 158 47.440 44.858 35.261 1.00 15.00 A C -ATOM 1262 CG2 VAL A 158 45.663 44.681 33.534 1.00 15.00 A C -ATOM 1263 C VAL A 158 48.280 45.658 32.379 1.00 15.00 A C -ATOM 1264 O VAL A 158 48.818 46.512 33.059 1.00 15.00 A O -ATOM 1265 N GLY A 159 47.774 45.894 31.171 1.00 15.00 A N -ATOM 1266 HN GLY A 159 47.382 45.143 30.679 1.00 15.00 A H -ATOM 1267 CA GLY A 159 47.775 47.199 30.555 1.00 15.00 A C -ATOM 1268 C GLY A 159 49.132 47.767 30.333 1.00 15.00 A C -ATOM 1269 O GLY A 159 49.292 48.974 30.246 1.00 15.00 A O -ATOM 1270 N GLU A 160 50.102 46.930 30.208 1.00 15.00 A N -ATOM 1271 HN GLU A 160 49.934 45.967 30.277 1.00 15.00 A H -ATOM 1272 CA GLU A 160 51.429 47.415 29.968 1.00 15.00 A C -ATOM 1273 CB GLU A 160 52.248 47.340 31.282 1.00 15.00 A C -ATOM 1274 CG GLU A 160 53.327 48.453 31.361 1.00 15.00 A C -ATOM 1275 CD GLU A 160 52.979 49.457 32.467 1.00 15.00 A C -ATOM 1276 OE1 GLU A 160 53.191 49.135 33.627 1.00 15.00 A O -ATOM 1277 OE2 GLU A 160 52.500 50.530 32.126 1.00 15.00 A O -ATOM 1278 C GLU A 160 52.148 46.603 28.893 1.00 15.00 A C -ATOM 1279 O GLU A 160 52.697 47.132 27.949 1.00 15.00 A O -ATOM 1280 N THR A 161 52.183 45.334 29.072 1.00 15.00 A N -ATOM 1281 HN THR A 161 51.705 44.947 29.835 1.00 15.00 A H -ATOM 1282 CA THR A 161 52.912 44.455 28.174 1.00 15.00 A C -ATOM 1283 CB THR A 161 53.310 43.175 28.940 1.00 15.00 A C -ATOM 1284 OG1 THR A 161 53.855 43.524 30.205 1.00 15.00 A O -ATOM 1285 HG1 THR A 161 54.408 44.303 30.112 1.00 15.00 A H -ATOM 1286 CG2 THR A 161 54.362 42.425 28.121 1.00 15.00 A C -ATOM 1287 C THR A 161 52.121 44.024 26.943 1.00 15.00 A C -ATOM 1288 O THR A 161 51.070 43.422 27.059 1.00 15.00 A O -ATOM 1289 N PRO A 162 52.667 44.304 25.759 1.00 15.00 A N -ATOM 1290 CA PRO A 162 52.054 43.911 24.481 1.00 15.00 A C -ATOM 1291 CB PRO A 162 52.967 44.464 23.369 1.00 15.00 A C -ATOM 1292 CG PRO A 162 54.053 45.268 24.027 1.00 15.00 A C -ATOM 1293 CD PRO A 162 53.914 45.097 25.539 1.00 15.00 A C -ATOM 1294 C PRO A 162 51.973 42.376 24.394 1.00 15.00 A C -ATOM 1295 O PRO A 162 52.879 41.690 24.826 1.00 15.00 A O -ATOM 1296 N VAL A 163 50.898 41.839 23.845 1.00 15.00 A N -ATOM 1297 HN VAL A 163 50.188 42.426 23.512 1.00 15.00 A H -ATOM 1298 CA VAL A 163 50.741 40.376 23.721 1.00 15.00 A C -ATOM 1299 CB VAL A 163 49.513 39.870 24.450 1.00 15.00 A C -ATOM 1300 CG1 VAL A 163 49.604 40.237 25.923 1.00 15.00 A C -ATOM 1301 CG2 VAL A 163 48.247 40.480 23.839 1.00 15.00 A C -ATOM 1302 C VAL A 163 50.675 39.921 22.255 1.00 15.00 A C -ATOM 1303 O VAL A 163 51.040 38.807 21.920 1.00 15.00 A O -ATOM 1304 N ILE A 164 50.212 40.773 21.405 1.00 15.00 A N -ATOM 1305 HN ILE A 164 49.924 41.648 21.739 1.00 15.00 A H -ATOM 1306 CA ILE A 164 50.093 40.513 19.989 1.00 15.00 A C -ATOM 1307 CB ILE A 164 48.668 40.084 19.615 1.00 15.00 A C -ATOM 1308 CG1 ILE A 164 48.288 38.723 20.251 1.00 15.00 A C -ATOM 1309 CG2 ILE A 164 48.507 39.982 18.100 1.00 15.00 A C -ATOM 1310 CD1 ILE A 164 46.759 38.615 20.451 1.00 15.00 A C -ATOM 1311 C ILE A 164 50.470 41.796 19.222 1.00 15.00 A C -ATOM 1312 O ILE A 164 50.278 42.899 19.692 1.00 15.00 A O -ATOM 1313 N ARG A 165 50.980 41.619 18.033 1.00 15.00 A N -ATOM 1314 HN ARG A 165 51.130 40.698 17.735 1.00 15.00 A H -ATOM 1315 CA ARG A 165 51.338 42.683 17.127 1.00 15.00 A C -ATOM 1316 CB ARG A 165 52.843 42.705 16.939 1.00 15.00 A C -ATOM 1317 CG ARG A 165 53.457 43.926 17.644 1.00 15.00 A C -ATOM 1318 CD ARG A 165 54.977 43.775 17.826 1.00 15.00 A C -ATOM 1319 NE ARG A 165 55.430 44.678 18.923 1.00 15.00 A N -ATOM 1320 HE ARG A 165 55.093 45.598 18.935 1.00 15.00 A H -ATOM 1321 CZ ARG A 165 56.251 44.285 19.856 1.00 15.00 A C -ATOM 1322 NH1 ARG A 165 56.703 43.062 19.885 1.00 15.00 A N -ATOM 1323 HH11 ARG A 165 57.357 42.767 20.638 1.00 15.00 A H -ATOM 1324 HH12 ARG A 165 56.409 42.382 19.156 1.00 15.00 A H -ATOM 1325 NH2 ARG A 165 56.599 45.114 20.801 1.00 15.00 A N -ATOM 1326 HH21 ARG A 165 57.254 44.806 21.548 1.00 15.00 A H -ATOM 1327 HH22 ARG A 165 56.222 46.083 20.807 1.00 15.00 A H -ATOM 1328 C ARG A 165 50.615 42.385 15.841 1.00 15.00 A C -ATOM 1329 O ARG A 165 50.642 41.263 15.363 1.00 15.00 A O -ATOM 1330 N ILE A 166 49.937 43.347 15.290 1.00 15.00 A N -ATOM 1331 HN ILE A 166 49.927 44.241 15.690 1.00 15.00 A H -ATOM 1332 CA ILE A 166 49.193 43.076 14.070 1.00 15.00 A C -ATOM 1333 CB ILE A 166 47.658 43.137 14.227 1.00 15.00 A C -ATOM 1334 CG1 ILE A 166 47.271 44.427 14.763 1.00 15.00 A C -ATOM 1335 CG2 ILE A 166 47.108 42.037 15.148 1.00 15.00 A C -ATOM 1336 CD1 ILE A 166 45.762 44.553 14.734 1.00 15.00 A C -ATOM 1337 C ILE A 166 49.545 44.092 13.025 1.00 15.00 A C -ATOM 1338 O ILE A 166 49.914 45.199 13.332 1.00 15.00 A O -ATOM 1339 N LYS A 167 49.368 43.722 11.796 1.00 15.00 A N -ATOM 1340 HN LYS A 167 49.072 42.806 11.614 1.00 15.00 A H -ATOM 1341 CA LYS A 167 49.594 44.620 10.682 1.00 15.00 A C -ATOM 1342 CB LYS A 167 50.776 44.251 9.778 1.00 15.00 A C -ATOM 1343 CG LYS A 167 51.482 45.521 9.247 1.00 15.00 A C -ATOM 1344 CD LYS A 167 52.981 45.240 8.945 1.00 15.00 A C -ATOM 1345 CE LYS A 167 53.361 45.731 7.539 1.00 15.00 A C -ATOM 1346 NZ LYS A 167 54.487 44.919 7.009 1.00 15.00 A N -ATOM 1347 HZ1 LYS A 167 55.315 45.006 7.633 1.00 15.00 A H -ATOM 1348 HZ2 LYS A 167 54.748 45.247 6.058 1.00 15.00 A H -ATOM 1349 HZ3 LYS A 167 54.211 43.918 6.954 1.00 15.00 A H -ATOM 1350 C LYS A 167 48.302 44.763 9.890 1.00 15.00 A C -ATOM 1351 O LYS A 167 47.442 43.904 9.923 1.00 15.00 A O -ATOM 1352 N LYS A 168 48.170 45.888 9.208 1.00 15.00 A N -ATOM 1353 HN LYS A 168 48.909 46.532 9.218 1.00 15.00 A H -ATOM 1354 CA LYS A 168 46.969 46.212 8.440 1.00 15.00 A C -ATOM 1355 CB LYS A 168 47.014 45.719 6.995 1.00 15.00 A C -ATOM 1356 CG LYS A 168 45.594 45.584 6.346 1.00 15.00 A C -ATOM 1357 CD LYS A 168 45.496 44.324 5.461 1.00 15.00 A C -ATOM 1358 CE LYS A 168 44.107 44.222 4.824 1.00 15.00 A C -ATOM 1359 NZ LYS A 168 43.803 42.803 4.459 1.00 15.00 A N -ATOM 1360 HZ1 LYS A 168 42.859 42.740 4.027 1.00 15.00 A H -ATOM 1361 HZ2 LYS A 168 43.824 42.203 5.308 1.00 15.00 A H -ATOM 1362 HZ3 LYS A 168 44.508 42.450 3.781 1.00 15.00 A H -ATOM 1363 C LYS A 168 45.738 45.676 9.191 1.00 15.00 A C -ATOM 1364 O LYS A 168 45.202 46.340 10.079 1.00 15.00 A O -ATOM 1365 N MET B 1 13.639 37.821 -0.846 1.00 15.00 B N -ATOM 1366 HN MET B 1 13.367 38.711 -1.154 1.00 15.00 B H -ATOM 1367 CA MET B 1 14.123 37.656 0.530 1.00 15.00 B C -ATOM 1368 CB MET B 1 14.116 39.022 1.227 1.00 15.00 B C -ATOM 1369 CG MET B 1 13.755 38.872 2.711 1.00 15.00 B C -ATOM 1370 SD MET B 1 13.906 40.480 3.509 1.00 15.00 B S -ATOM 1371 CE MET B 1 15.668 40.712 3.151 1.00 15.00 B C -ATOM 1372 C MET B 1 13.201 36.682 1.252 1.00 15.00 B C -ATOM 1373 O MET B 1 12.049 36.500 0.900 1.00 15.00 B O -ATOM 1374 N PHE B 2 13.709 36.079 2.279 1.00 15.00 B N -ATOM 1375 HN PHE B 2 14.639 36.254 2.533 1.00 15.00 B H -ATOM 1376 CA PHE B 2 12.907 35.138 3.066 1.00 15.00 B C -ATOM 1377 CB PHE B 2 13.200 33.779 2.434 1.00 15.00 B C -ATOM 1378 CG PHE B 2 12.433 32.720 3.155 1.00 15.00 B C -ATOM 1379 CD1 PHE B 2 11.049 32.687 3.040 1.00 15.00 B C -ATOM 1380 CD2 PHE B 2 13.098 31.779 3.926 1.00 15.00 B C -ATOM 1381 CE1 PHE B 2 10.319 31.700 3.699 1.00 15.00 B C -ATOM 1382 CE2 PHE B 2 12.381 30.780 4.586 1.00 15.00 B C -ATOM 1383 CZ PHE B 2 10.989 30.741 4.471 1.00 15.00 B C -ATOM 1384 C PHE B 2 13.306 35.323 4.540 1.00 15.00 B C -ATOM 1385 O PHE B 2 14.460 35.552 4.851 1.00 15.00 B O -ATOM 1386 N GLN B 3 12.352 35.266 5.454 1.00 15.00 B N -ATOM 1387 HN GLN B 3 11.426 35.095 5.181 1.00 15.00 B H -ATOM 1388 CA GLN B 3 12.674 35.459 6.891 1.00 15.00 B C -ATOM 1389 CB GLN B 3 12.681 36.930 7.295 1.00 15.00 B C -ATOM 1390 CG GLN B 3 11.407 37.762 7.085 1.00 15.00 B C -ATOM 1391 CD GLN B 3 11.836 39.239 7.246 1.00 15.00 B C -ATOM 1392 OE1 GLN B 3 11.476 39.903 8.199 1.00 15.00 B O -ATOM 1393 NE2 GLN B 3 12.552 39.790 6.309 1.00 15.00 B N -ATOM 1394 HE21 GLN B 3 12.795 39.245 5.531 1.00 15.00 B H -ATOM 1395 HE22 GLN B 3 12.819 40.726 6.421 1.00 15.00 B H -ATOM 1396 C GLN B 3 11.679 34.676 7.745 1.00 15.00 B C -ATOM 1397 O GLN B 3 10.579 34.357 7.327 1.00 15.00 B O -ATOM 1398 N GLN B 4 12.076 34.372 8.937 1.00 15.00 B N -ATOM 1399 HN GLN B 4 12.969 34.655 9.225 1.00 15.00 B H -ATOM 1400 CA GLN B 4 11.223 33.607 9.889 1.00 15.00 B C -ATOM 1401 CB GLN B 4 11.427 32.077 9.744 1.00 15.00 B C -ATOM 1402 CG GLN B 4 10.982 31.455 8.393 1.00 15.00 B C -ATOM 1403 CD GLN B 4 9.480 31.254 8.482 1.00 15.00 B C -ATOM 1404 OE1 GLN B 4 9.028 30.209 8.927 1.00 15.00 B O -ATOM 1405 NE2 GLN B 4 8.689 32.120 7.931 1.00 15.00 B N -ATOM 1406 HE21 GLN B 4 9.090 32.886 7.469 1.00 15.00 B H -ATOM 1407 HE22 GLN B 4 7.722 31.973 7.999 1.00 15.00 B H -ATOM 1408 C GLN B 4 11.665 34.006 11.311 1.00 15.00 B C -ATOM 1409 O GLN B 4 12.827 34.277 11.539 1.00 15.00 B O -ATOM 1410 N GLU B 5 10.758 34.025 12.256 1.00 15.00 B N -ATOM 1411 HN GLU B 5 9.829 33.812 12.028 1.00 15.00 B H -ATOM 1412 CA GLU B 5 11.095 34.358 13.653 1.00 15.00 B C -ATOM 1413 CB GLU B 5 9.874 34.978 14.380 1.00 15.00 B C -ATOM 1414 CG GLU B 5 9.987 36.511 14.541 1.00 15.00 B C -ATOM 1415 CD GLU B 5 8.615 37.199 14.486 1.00 15.00 B C -ATOM 1416 OE1 GLU B 5 7.900 37.012 13.513 1.00 15.00 B O -ATOM 1417 OE2 GLU B 5 8.314 37.926 15.424 1.00 15.00 B O -ATOM 1418 C GLU B 5 11.365 33.050 14.409 1.00 15.00 B C -ATOM 1419 O GLU B 5 10.768 32.028 14.115 1.00 15.00 B O -ATOM 1420 N VAL B 6 12.181 33.091 15.425 1.00 15.00 B N -ATOM 1421 HN VAL B 6 12.656 33.922 15.636 1.00 15.00 B H -ATOM 1422 CA VAL B 6 12.393 31.890 16.260 1.00 15.00 B C -ATOM 1423 CB VAL B 6 13.500 30.972 15.693 1.00 15.00 B C -ATOM 1424 CG1 VAL B 6 14.831 31.704 15.578 1.00 15.00 B C -ATOM 1425 CG2 VAL B 6 13.694 29.733 16.589 1.00 15.00 B C -ATOM 1426 C VAL B 6 12.712 32.372 17.683 1.00 15.00 B C -ATOM 1427 O VAL B 6 13.353 33.391 17.872 1.00 15.00 B O -ATOM 1428 N THR B 7 12.254 31.650 18.679 1.00 15.00 B N -ATOM 1429 HN THR B 7 11.719 30.853 18.482 1.00 15.00 B H -ATOM 1430 CA THR B 7 12.522 32.005 20.094 1.00 15.00 B C -ATOM 1431 CB THR B 7 11.352 31.602 20.995 1.00 15.00 B C -ATOM 1432 OG1 THR B 7 10.195 32.281 20.512 1.00 15.00 B O -ATOM 1433 HG1 THR B 7 9.848 32.852 21.201 1.00 15.00 B H -ATOM 1434 CG2 THR B 7 11.634 32.021 22.451 1.00 15.00 B C -ATOM 1435 C THR B 7 13.772 31.253 20.603 1.00 15.00 B C -ATOM 1436 O THR B 7 13.934 30.061 20.388 1.00 15.00 B O -ATOM 1437 N ILE B 8 14.612 31.953 21.315 1.00 15.00 B N -ATOM 1438 HN ILE B 8 14.423 32.904 21.457 1.00 15.00 B H -ATOM 1439 CA ILE B 8 15.832 31.383 21.916 1.00 15.00 B C -ATOM 1440 CB ILE B 8 16.933 32.467 22.134 1.00 15.00 B C -ATOM 1441 CG1 ILE B 8 17.465 32.868 20.746 1.00 15.00 B C -ATOM 1442 CG2 ILE B 8 18.059 31.908 23.010 1.00 15.00 B C -ATOM 1443 CD1 ILE B 8 18.523 33.974 20.835 1.00 15.00 B C -ATOM 1444 C ILE B 8 15.367 30.802 23.254 1.00 15.00 B C -ATOM 1445 O ILE B 8 14.911 31.511 24.138 1.00 15.00 B O -ATOM 1446 N THR B 9 15.440 29.516 23.363 1.00 15.00 B N -ATOM 1447 HN THR B 9 15.801 29.002 22.611 1.00 15.00 B H -ATOM 1448 CA THR B 9 14.993 28.768 24.601 1.00 15.00 B C -ATOM 1449 CB THR B 9 14.055 27.572 24.219 1.00 15.00 B C -ATOM 1450 OG1 THR B 9 14.754 26.720 23.298 1.00 15.00 B O -ATOM 1451 HG1 THR B 9 15.398 26.192 23.775 1.00 15.00 B H -ATOM 1452 CG2 THR B 9 12.748 28.127 23.633 1.00 15.00 B C -ATOM 1453 C THR B 9 16.152 28.218 25.476 1.00 15.00 B C -ATOM 1454 O THR B 9 15.887 27.673 26.531 1.00 15.00 B O -ATOM 1455 N ALA B 10 17.396 28.348 25.084 1.00 15.00 B N -ATOM 1456 HN ALA B 10 17.582 28.793 24.231 1.00 15.00 B H -ATOM 1457 CA ALA B 10 18.534 27.840 25.896 1.00 15.00 B C -ATOM 1458 CB ALA B 10 19.777 27.935 25.015 1.00 15.00 B C -ATOM 1459 C ALA B 10 18.738 28.706 27.151 1.00 15.00 B C -ATOM 1460 O ALA B 10 18.656 29.907 27.052 1.00 15.00 B O -ATOM 1461 N PRO B 11 19.025 28.117 28.314 1.00 15.00 B N -ATOM 1462 CA PRO B 11 19.258 28.881 29.580 1.00 15.00 B C -ATOM 1463 CB PRO B 11 19.774 27.791 30.541 1.00 15.00 B C -ATOM 1464 CG PRO B 11 19.132 26.521 30.048 1.00 15.00 B C -ATOM 1465 CD PRO B 11 19.132 26.630 28.515 1.00 15.00 B C -ATOM 1466 C PRO B 11 20.163 30.070 29.501 1.00 15.00 B C -ATOM 1467 O PRO B 11 19.811 31.108 30.043 1.00 15.00 B O -ATOM 1468 N ASN B 12 21.283 30.019 28.867 1.00 15.00 B N -ATOM 1469 HN ASN B 12 21.592 29.203 28.420 1.00 15.00 B H -ATOM 1470 CA ASN B 12 22.086 31.288 28.855 1.00 15.00 B C -ATOM 1471 CB ASN B 12 23.556 30.981 29.187 1.00 15.00 B C -ATOM 1472 CG ASN B 12 23.659 30.470 30.625 1.00 15.00 B C -ATOM 1473 OD1 ASN B 12 22.751 30.650 31.413 1.00 15.00 B O -ATOM 1474 ND2 ASN B 12 24.735 29.836 31.004 1.00 15.00 B N -ATOM 1475 HD21 ASN B 12 25.451 29.706 30.348 1.00 15.00 B H -ATOM 1476 HD22 ASN B 12 24.782 29.516 31.929 1.00 15.00 B H -ATOM 1477 C ASN B 12 21.915 31.914 27.477 1.00 15.00 B C -ATOM 1478 O ASN B 12 22.793 32.599 26.989 1.00 15.00 B O -ATOM 1479 N GLY B 13 20.778 31.687 26.819 1.00 15.00 B N -ATOM 1480 HN GLY B 13 20.070 31.135 27.212 1.00 15.00 B H -ATOM 1481 CA GLY B 13 20.626 32.301 25.471 1.00 15.00 B C -ATOM 1482 C GLY B 13 21.721 31.822 24.526 1.00 15.00 B C -ATOM 1483 O GLY B 13 22.197 30.695 24.605 1.00 15.00 B O -ATOM 1484 N LEU B 14 22.117 32.662 23.597 1.00 15.00 B N -ATOM 1485 HN LEU B 14 21.743 33.566 23.545 1.00 15.00 B H -ATOM 1486 CA LEU B 14 23.141 32.209 22.632 1.00 15.00 B C -ATOM 1487 CB LEU B 14 22.910 32.956 21.312 1.00 15.00 B C -ATOM 1488 CG LEU B 14 23.721 32.365 20.155 1.00 15.00 B C -ATOM 1489 CD1 LEU B 14 23.130 31.034 19.682 1.00 15.00 B C -ATOM 1490 CD2 LEU B 14 23.675 33.366 18.999 1.00 15.00 B C -ATOM 1491 C LEU B 14 24.516 32.470 23.213 1.00 15.00 B C -ATOM 1492 O LEU B 14 25.190 33.391 22.800 1.00 15.00 B O -ATOM 1493 N HIS B 15 24.940 31.677 24.190 1.00 15.00 B N -ATOM 1494 HN HIS B 15 24.383 30.937 24.510 1.00 15.00 B H -ATOM 1495 CA HIS B 15 26.285 31.936 24.792 1.00 15.00 B C -ATOM 1496 CB HIS B 15 26.427 31.192 26.135 1.00 15.00 B C -ATOM 1497 CG HIS B 15 26.055 29.743 25.976 1.00 15.00 B C -ATOM 1498 ND1 HIS B 15 27.006 28.735 25.967 1.00 15.00 B N -ATOM 1499 CD2 HIS B 15 24.842 29.115 25.848 1.00 15.00 B C -ATOM 1500 CE1 HIS B 15 26.356 27.565 25.840 1.00 15.00 B C -ATOM 1501 NE2 HIS B 15 25.034 27.739 25.762 1.00 15.00 B N -ATOM 1502 HE2 HIS B 15 24.349 27.045 25.665 1.00 15.00 B H -ATOM 1503 C HIS B 15 27.427 31.625 23.834 1.00 15.00 B C -ATOM 1504 O HIS B 15 27.237 31.345 22.669 1.00 15.00 B O -ATOM 1505 N THR B 16 28.623 31.796 24.323 1.00 15.00 B N -ATOM 1506 HN THR B 16 28.725 32.025 25.270 1.00 15.00 B H -ATOM 1507 CA THR B 16 29.847 31.650 23.470 1.00 15.00 B C -ATOM 1508 CB THR B 16 31.127 31.844 24.346 1.00 15.00 B C -ATOM 1509 OG1 THR B 16 30.907 32.899 25.272 1.00 15.00 B O -ATOM 1510 HG1 THR B 16 31.549 32.840 25.983 1.00 15.00 B H -ATOM 1511 CG2 THR B 16 32.318 32.197 23.452 1.00 15.00 B C -ATOM 1512 C THR B 16 29.988 30.408 22.588 1.00 15.00 B C -ATOM 1513 O THR B 16 30.137 30.563 21.388 1.00 15.00 B O -ATOM 1514 N ARG B 17 30.014 29.219 23.068 1.00 15.00 B N -ATOM 1515 HN ARG B 17 29.896 29.048 24.026 1.00 15.00 B H -ATOM 1516 CA ARG B 17 30.233 28.107 22.095 1.00 15.00 B C -ATOM 1517 CB ARG B 17 30.550 26.827 22.900 1.00 15.00 B C -ATOM 1518 CG ARG B 17 30.285 25.575 22.050 1.00 15.00 B C -ATOM 1519 CD ARG B 17 30.674 24.322 22.839 1.00 15.00 B C -ATOM 1520 NE ARG B 17 32.034 24.494 23.422 1.00 15.00 B N -ATOM 1521 HE ARG B 17 32.616 25.208 23.087 1.00 15.00 B H -ATOM 1522 CZ ARG B 17 32.439 23.695 24.372 1.00 15.00 B C -ATOM 1523 NH1 ARG B 17 31.654 22.749 24.808 1.00 15.00 B N -ATOM 1524 HH11 ARG B 17 31.977 22.113 25.565 1.00 15.00 B H -ATOM 1525 HH12 ARG B 17 30.705 22.631 24.399 1.00 15.00 B H -ATOM 1526 NH2 ARG B 17 33.630 23.843 24.884 1.00 15.00 B N -ATOM 1527 HH21 ARG B 17 33.955 23.207 25.640 1.00 15.00 B H -ATOM 1528 HH22 ARG B 17 34.248 24.597 24.539 1.00 15.00 B H -ATOM 1529 C ARG B 17 29.093 27.973 21.065 1.00 15.00 B C -ATOM 1530 O ARG B 17 29.372 27.809 19.894 1.00 15.00 B O -ATOM 1531 N PRO B 18 27.850 28.042 21.427 1.00 15.00 B N -ATOM 1532 CA PRO B 18 26.784 27.922 20.414 1.00 15.00 B C -ATOM 1533 CB PRO B 18 25.517 27.772 21.274 1.00 15.00 B C -ATOM 1534 CG PRO B 18 25.871 28.154 22.721 1.00 15.00 B C -ATOM 1535 CD PRO B 18 27.406 28.206 22.842 1.00 15.00 B C -ATOM 1536 C PRO B 18 26.758 29.130 19.461 1.00 15.00 B C -ATOM 1537 O PRO B 18 26.369 29.011 18.316 1.00 15.00 B O -ATOM 1538 N ALA B 19 27.171 30.284 19.911 1.00 15.00 B N -ATOM 1539 HN ALA B 19 27.483 30.370 20.836 1.00 15.00 B H -ATOM 1540 CA ALA B 19 27.165 31.484 18.997 1.00 15.00 B C -ATOM 1541 CB ALA B 19 27.330 32.766 19.838 1.00 15.00 B C -ATOM 1542 C ALA B 19 28.248 31.292 17.915 1.00 15.00 B C -ATOM 1543 O ALA B 19 28.065 31.651 16.766 1.00 15.00 B O -ATOM 1544 N ALA B 20 29.351 30.688 18.258 1.00 15.00 B N -ATOM 1545 HN ALA B 20 29.476 30.409 19.189 1.00 15.00 B H -ATOM 1546 CA ALA B 20 30.425 30.414 17.262 1.00 15.00 B C -ATOM 1547 CB ALA B 20 31.695 29.900 17.957 1.00 15.00 B C -ATOM 1548 C ALA B 20 29.951 29.302 16.314 1.00 15.00 B C -ATOM 1549 O ALA B 20 30.199 29.337 15.119 1.00 15.00 B O -ATOM 1550 N GLN B 21 29.265 28.295 16.836 1.00 15.00 B N -ATOM 1551 HN GLN B 21 29.079 28.257 17.797 1.00 15.00 B H -ATOM 1552 CA GLN B 21 28.781 27.215 15.913 1.00 15.00 B C -ATOM 1553 CB GLN B 21 28.198 26.016 16.676 1.00 15.00 B C -ATOM 1554 CG GLN B 21 29.303 25.378 17.521 1.00 15.00 B C -ATOM 1555 CD GLN B 21 28.721 24.242 18.364 1.00 15.00 B C -ATOM 1556 OE1 GLN B 21 27.522 24.047 18.398 1.00 15.00 B O -ATOM 1557 NE2 GLN B 21 29.527 23.482 19.054 1.00 15.00 B N -ATOM 1558 HE21 GLN B 21 30.489 23.666 19.009 1.00 15.00 B H -ATOM 1559 HE22 GLN B 21 29.137 22.759 19.588 1.00 15.00 B H -ATOM 1560 C GLN B 21 27.687 27.812 14.974 1.00 15.00 B C -ATOM 1561 O GLN B 21 27.585 27.443 13.820 1.00 15.00 B O -ATOM 1562 N PHE B 22 26.857 28.725 15.477 1.00 15.00 B N -ATOM 1563 HN PHE B 22 26.964 29.003 16.411 1.00 15.00 B H -ATOM 1564 CA PHE B 22 25.774 29.334 14.662 1.00 15.00 B C -ATOM 1565 CB PHE B 22 24.915 30.243 15.585 1.00 15.00 B C -ATOM 1566 CG PHE B 22 23.824 30.953 14.793 1.00 15.00 B C -ATOM 1567 CD1 PHE B 22 22.607 30.306 14.573 1.00 15.00 B C -ATOM 1568 CD2 PHE B 22 24.022 32.249 14.290 1.00 15.00 B C -ATOM 1569 CE1 PHE B 22 21.581 30.936 13.859 1.00 15.00 B C -ATOM 1570 CE2 PHE B 22 23.000 32.883 13.574 1.00 15.00 B C -ATOM 1571 CZ PHE B 22 21.780 32.230 13.358 1.00 15.00 B C -ATOM 1572 C PHE B 22 26.409 30.135 13.525 1.00 15.00 B C -ATOM 1573 O PHE B 22 26.008 30.066 12.374 1.00 15.00 B O -ATOM 1574 N VAL B 23 27.414 30.881 13.868 1.00 15.00 B N -ATOM 1575 HN VAL B 23 27.695 30.893 14.807 1.00 15.00 B H -ATOM 1576 CA VAL B 23 28.163 31.727 12.878 1.00 15.00 B C -ATOM 1577 CB VAL B 23 29.165 32.675 13.609 1.00 15.00 B C -ATOM 1578 CG1 VAL B 23 30.066 33.360 12.581 1.00 15.00 B C -ATOM 1579 CG2 VAL B 23 28.383 33.737 14.387 1.00 15.00 B C -ATOM 1580 C VAL B 23 28.871 30.846 11.846 1.00 15.00 B C -ATOM 1581 O VAL B 23 28.889 31.155 10.671 1.00 15.00 B O -ATOM 1582 N LYS B 24 29.442 29.760 12.254 1.00 15.00 B N -ATOM 1583 HN LYS B 24 29.421 29.522 13.204 1.00 15.00 B H -ATOM 1584 CA LYS B 24 30.128 28.876 11.284 1.00 15.00 B C -ATOM 1585 CB LYS B 24 30.816 27.705 12.019 1.00 15.00 B C -ATOM 1586 CG LYS B 24 31.759 26.971 11.064 1.00 15.00 B C -ATOM 1587 CD LYS B 24 32.338 25.741 11.767 1.00 15.00 B C -ATOM 1588 CE LYS B 24 33.397 25.092 10.873 1.00 15.00 B C -ATOM 1589 NZ LYS B 24 34.165 24.088 11.662 1.00 15.00 B N -ATOM 1590 HZ1 LYS B 24 34.634 24.549 12.467 1.00 15.00 B H -ATOM 1591 HZ2 LYS B 24 34.888 23.640 11.064 1.00 15.00 B H -ATOM 1592 HZ3 LYS B 24 33.525 23.351 12.022 1.00 15.00 B H -ATOM 1593 C LYS B 24 29.110 28.303 10.301 1.00 15.00 B C -ATOM 1594 O LYS B 24 29.356 28.205 9.115 1.00 15.00 B O -ATOM 1595 N GLU B 25 27.967 27.925 10.793 1.00 15.00 B N -ATOM 1596 HN GLU B 25 27.797 28.016 11.754 1.00 15.00 B H -ATOM 1597 CA GLU B 25 26.935 27.366 9.923 1.00 15.00 B C -ATOM 1598 CB GLU B 25 25.784 26.772 10.757 1.00 15.00 B C -ATOM 1599 CG GLU B 25 24.806 26.202 9.673 1.00 15.00 B C -ATOM 1600 CD GLU B 25 23.664 25.269 10.101 1.00 15.00 B C -ATOM 1601 OE1 GLU B 25 23.922 24.167 10.558 1.00 15.00 B O -ATOM 1602 OE2 GLU B 25 22.530 25.643 9.835 1.00 15.00 B O -ATOM 1603 C GLU B 25 26.401 28.483 8.984 1.00 15.00 B C -ATOM 1604 O GLU B 25 26.151 28.248 7.814 1.00 15.00 B O -ATOM 1605 N ALA B 26 26.220 29.697 9.489 1.00 15.00 B N -ATOM 1606 HN ALA B 26 26.410 29.860 10.437 1.00 15.00 B H -ATOM 1607 CA ALA B 26 25.732 30.817 8.634 1.00 15.00 B C -ATOM 1608 CB ALA B 26 25.578 32.038 9.553 1.00 15.00 B C -ATOM 1609 C ALA B 26 26.725 31.042 7.472 1.00 15.00 B C -ATOM 1610 O ALA B 26 26.325 31.226 6.336 1.00 15.00 B O -ATOM 1611 N LYS B 27 28.003 31.002 7.740 1.00 15.00 B N -ATOM 1612 HN LYS B 27 28.297 30.858 8.664 1.00 15.00 B H -ATOM 1613 CA LYS B 27 29.025 31.172 6.664 1.00 15.00 B C -ATOM 1614 CB LYS B 27 30.439 31.179 7.273 1.00 15.00 B C -ATOM 1615 CG LYS B 27 30.661 32.476 8.045 1.00 15.00 B C -ATOM 1616 CD LYS B 27 32.090 32.508 8.592 1.00 15.00 B C -ATOM 1617 CE LYS B 27 32.294 33.780 9.416 1.00 15.00 B C -ATOM 1618 NZ LYS B 27 33.748 33.972 9.681 1.00 15.00 B N -ATOM 1619 HZ1 LYS B 27 34.126 33.159 10.209 1.00 15.00 B H -ATOM 1620 HZ2 LYS B 27 33.899 34.835 10.241 1.00 15.00 B H -ATOM 1621 HZ3 LYS B 27 34.266 34.060 8.783 1.00 15.00 B H -ATOM 1622 C LYS B 27 28.964 30.053 5.591 1.00 15.00 B C -ATOM 1623 O LYS B 27 29.543 30.193 4.532 1.00 15.00 B O -ATOM 1624 N GLY B 28 28.298 28.954 5.833 1.00 15.00 B N -ATOM 1625 HN GLY B 28 27.833 28.847 6.689 1.00 15.00 B H -ATOM 1626 CA GLY B 28 28.247 27.878 4.820 1.00 15.00 B C -ATOM 1627 C GLY B 28 27.236 28.260 3.747 1.00 15.00 B C -ATOM 1628 O GLY B 28 27.195 27.620 2.705 1.00 15.00 B O -ATOM 1629 N PHE B 29 26.417 29.311 3.971 1.00 15.00 B N -ATOM 1630 HN PHE B 29 26.466 29.812 4.812 1.00 15.00 B H -ATOM 1631 CA PHE B 29 25.427 29.698 2.904 1.00 15.00 B C -ATOM 1632 CB PHE B 29 24.040 30.004 3.472 1.00 15.00 B C -ATOM 1633 CG PHE B 29 23.528 28.823 4.245 1.00 15.00 B C -ATOM 1634 CD1 PHE B 29 22.870 27.795 3.579 1.00 15.00 B C -ATOM 1635 CD2 PHE B 29 23.700 28.763 5.631 1.00 15.00 B C -ATOM 1636 CE1 PHE B 29 22.380 26.711 4.299 1.00 15.00 B C -ATOM 1637 CE2 PHE B 29 23.202 27.670 6.344 1.00 15.00 B C -ATOM 1638 CZ PHE B 29 22.540 26.648 5.673 1.00 15.00 B C -ATOM 1639 C PHE B 29 25.909 30.940 2.170 1.00 15.00 B C -ATOM 1640 O PHE B 29 26.508 31.824 2.751 1.00 15.00 B O -ATOM 1641 N THR B 30 25.639 31.014 0.891 1.00 15.00 B N -ATOM 1642 HN THR B 30 25.144 30.291 0.452 1.00 15.00 B H -ATOM 1643 CA THR B 30 26.088 32.208 0.095 1.00 15.00 B C -ATOM 1644 CB THR B 30 26.214 31.842 -1.408 1.00 15.00 B C -ATOM 1645 OG1 THR B 30 24.948 31.381 -1.876 1.00 15.00 B O -ATOM 1646 HG1 THR B 30 25.077 30.803 -2.632 1.00 15.00 B H -ATOM 1647 CG2 THR B 30 27.288 30.751 -1.524 1.00 15.00 B C -ATOM 1648 C THR B 30 25.208 33.435 0.335 1.00 15.00 B C -ATOM 1649 O THR B 30 25.709 34.541 0.234 1.00 15.00 B O -ATOM 1650 N SER B 31 23.938 33.295 0.663 1.00 15.00 B N -ATOM 1651 HN SER B 31 23.538 32.404 0.745 1.00 15.00 B H -ATOM 1652 CA SER B 31 23.129 34.514 0.905 1.00 15.00 B C -ATOM 1653 CB SER B 31 21.708 34.178 1.365 1.00 15.00 B C -ATOM 1654 OG SER B 31 21.088 33.306 0.448 1.00 15.00 B O -ATOM 1655 HG SER B 31 21.680 32.577 0.248 1.00 15.00 B H -ATOM 1656 C SER B 31 23.653 35.426 2.024 1.00 15.00 B C -ATOM 1657 O SER B 31 24.285 35.015 2.986 1.00 15.00 B O -ATOM 1658 N GLU B 32 23.243 36.670 1.927 1.00 15.00 B N -ATOM 1659 HN GLU B 32 22.753 36.951 1.126 1.00 15.00 B H -ATOM 1660 CA GLU B 32 23.502 37.653 2.993 1.00 15.00 B C -ATOM 1661 CB GLU B 32 23.539 39.120 2.481 1.00 15.00 B C -ATOM 1662 CG GLU B 32 22.431 40.155 2.865 1.00 15.00 B C -ATOM 1663 CD GLU B 32 21.765 40.086 4.244 1.00 15.00 B C -ATOM 1664 OE1 GLU B 32 22.335 40.606 5.194 1.00 15.00 B O -ATOM 1665 OE2 GLU B 32 20.628 39.640 4.295 1.00 15.00 B O -ATOM 1666 C GLU B 32 22.415 37.310 4.024 1.00 15.00 B C -ATOM 1667 O GLU B 32 21.256 37.149 3.681 1.00 15.00 B O -ATOM 1668 N ILE B 33 22.793 37.117 5.264 1.00 15.00 B N -ATOM 1669 HN ILE B 33 23.733 37.261 5.499 1.00 15.00 B H -ATOM 1670 CA ILE B 33 21.850 36.689 6.323 1.00 15.00 B C -ATOM 1671 CB ILE B 33 22.268 35.280 6.837 1.00 15.00 B C -ATOM 1672 CG1 ILE B 33 22.324 34.284 5.646 1.00 15.00 B C -ATOM 1673 CG2 ILE B 33 21.304 34.821 7.949 1.00 15.00 B C -ATOM 1674 CD1 ILE B 33 23.170 33.032 5.968 1.00 15.00 B C -ATOM 1675 C ILE B 33 21.944 37.682 7.472 1.00 15.00 B C -ATOM 1676 O ILE B 33 23.028 38.053 7.895 1.00 15.00 B O -ATOM 1677 N THR B 34 20.811 38.104 7.967 1.00 15.00 B N -ATOM 1678 HN THR B 34 19.972 37.768 7.588 1.00 15.00 B H -ATOM 1679 CA THR B 34 20.755 39.073 9.082 1.00 15.00 B C -ATOM 1680 CB THR B 34 20.068 40.412 8.589 1.00 15.00 B C -ATOM 1681 OG1 THR B 34 20.865 40.935 7.536 1.00 15.00 B O -ATOM 1682 HG1 THR B 34 20.402 41.663 7.115 1.00 15.00 B H -ATOM 1683 CG2 THR B 34 19.893 41.530 9.645 1.00 15.00 B C -ATOM 1684 C THR B 34 19.921 38.481 10.224 1.00 15.00 B C -ATOM 1685 O THR B 34 18.876 37.883 10.024 1.00 15.00 B O -ATOM 1686 N VAL B 35 20.395 38.735 11.402 1.00 15.00 B N -ATOM 1687 HN VAL B 35 21.261 39.191 11.452 1.00 15.00 B H -ATOM 1688 CA VAL B 35 19.728 38.389 12.685 1.00 15.00 B C -ATOM 1689 CB VAL B 35 20.701 37.672 13.672 1.00 15.00 B C -ATOM 1690 CG1 VAL B 35 19.961 37.454 15.002 1.00 15.00 B C -ATOM 1691 CG2 VAL B 35 21.183 36.334 13.078 1.00 15.00 B C -ATOM 1692 C VAL B 35 19.219 39.739 13.261 1.00 15.00 B C -ATOM 1693 O VAL B 35 19.969 40.691 13.375 1.00 15.00 B O -ATOM 1694 N THR B 36 17.938 39.821 13.605 1.00 15.00 B N -ATOM 1695 HN THR B 36 17.369 39.031 13.488 1.00 15.00 B H -ATOM 1696 CA THR B 36 17.328 41.063 14.162 1.00 15.00 B C -ATOM 1697 CB THR B 36 16.271 41.716 13.209 1.00 15.00 B C -ATOM 1698 OG1 THR B 36 16.912 42.027 11.980 1.00 15.00 B O -ATOM 1699 HG1 THR B 36 17.729 42.499 12.155 1.00 15.00 B H -ATOM 1700 CG2 THR B 36 15.664 42.990 13.824 1.00 15.00 B C -ATOM 1701 C THR B 36 16.678 40.781 15.468 1.00 15.00 B C -ATOM 1702 O THR B 36 15.761 39.976 15.574 1.00 15.00 B O -ATOM 1703 N SER B 37 17.143 41.478 16.474 1.00 15.00 B N -ATOM 1704 HN SER B 37 17.890 42.100 16.351 1.00 15.00 B H -ATOM 1705 CA SER B 37 16.506 41.302 17.816 1.00 15.00 B C -ATOM 1706 CB SER B 37 17.476 40.582 18.756 1.00 15.00 B C -ATOM 1707 OG SER B 37 16.887 40.527 20.048 1.00 15.00 B O -ATOM 1708 HG SER B 37 16.083 40.003 20.012 1.00 15.00 B H -ATOM 1709 C SER B 37 16.071 42.696 18.330 1.00 15.00 B C -ATOM 1710 O SER B 37 16.863 43.621 18.399 1.00 15.00 B O -ATOM 1711 N ASN B 38 14.785 42.848 18.651 1.00 15.00 B N -ATOM 1712 HN ASN B 38 14.180 42.081 18.573 1.00 15.00 B H -ATOM 1713 CA ASN B 38 14.236 44.174 19.133 1.00 15.00 B C -ATOM 1714 CB ASN B 38 14.700 44.416 20.584 1.00 15.00 B C -ATOM 1715 CG ASN B 38 13.935 45.567 21.247 1.00 15.00 B C -ATOM 1716 OD1 ASN B 38 14.452 46.220 22.147 1.00 15.00 B O -ATOM 1717 ND2 ASN B 38 12.781 45.925 20.769 1.00 15.00 B N -ATOM 1718 HD21 ASN B 38 12.432 45.442 19.991 1.00 15.00 B H -ATOM 1719 HD22 ASN B 38 12.307 46.663 21.207 1.00 15.00 B H -ATOM 1720 C ASN B 38 14.630 45.353 18.221 1.00 15.00 B C -ATOM 1721 O ASN B 38 14.888 46.437 18.699 1.00 15.00 B O -ATOM 1722 N GLY B 39 14.623 45.184 16.913 1.00 15.00 B N -ATOM 1723 HN GLY B 39 14.420 44.303 16.535 1.00 15.00 B H -ATOM 1724 CA GLY B 39 14.924 46.333 16.021 1.00 15.00 B C -ATOM 1725 C GLY B 39 16.408 46.601 15.868 1.00 15.00 B C -ATOM 1726 O GLY B 39 16.787 47.632 15.336 1.00 15.00 B O -ATOM 1727 N LYS B 40 17.252 45.704 16.297 1.00 15.00 B N -ATOM 1728 HN LYS B 40 16.922 44.890 16.732 1.00 15.00 B H -ATOM 1729 CA LYS B 40 18.711 45.913 16.128 1.00 15.00 B C -ATOM 1730 CB LYS B 40 19.369 46.018 17.497 1.00 15.00 B C -ATOM 1731 CG LYS B 40 18.838 47.256 18.222 1.00 15.00 B C -ATOM 1732 CD LYS B 40 19.588 47.436 19.543 1.00 15.00 B C -ATOM 1733 CE LYS B 40 18.981 48.606 20.318 1.00 15.00 B C -ATOM 1734 NZ LYS B 40 19.592 48.672 21.675 1.00 15.00 B N -ATOM 1735 HZ1 LYS B 40 19.410 47.788 22.192 1.00 15.00 B H -ATOM 1736 HZ2 LYS B 40 19.186 49.465 22.212 1.00 15.00 B H -ATOM 1737 HZ3 LYS B 40 20.620 48.811 21.598 1.00 15.00 B H -ATOM 1738 C LYS B 40 19.157 44.692 15.314 1.00 15.00 B C -ATOM 1739 O LYS B 40 18.690 43.596 15.520 1.00 15.00 B O -ATOM 1740 N SER B 41 19.978 44.913 14.348 1.00 15.00 B N -ATOM 1741 HN SER B 41 20.323 45.823 14.235 1.00 15.00 B H -ATOM 1742 CA SER B 41 20.427 43.884 13.407 1.00 15.00 B C -ATOM 1743 CB SER B 41 20.094 44.362 11.988 1.00 15.00 B C -ATOM 1744 OG SER B 41 18.688 44.467 11.857 1.00 15.00 B O -ATOM 1745 HG SER B 41 18.458 44.556 10.929 1.00 15.00 B H -ATOM 1746 C SER B 41 21.921 43.667 13.362 1.00 15.00 B C -ATOM 1747 O SER B 41 22.751 44.519 13.647 1.00 15.00 B O -ATOM 1748 N ALA B 42 22.222 42.489 12.936 1.00 15.00 B N -ATOM 1749 HN ALA B 42 21.496 41.862 12.736 1.00 15.00 B H -ATOM 1750 CA ALA B 42 23.597 42.052 12.740 1.00 15.00 B C -ATOM 1751 CB ALA B 42 24.053 41.339 14.020 1.00 15.00 B C -ATOM 1752 C ALA B 42 23.679 40.991 11.637 1.00 15.00 B C -ATOM 1753 O ALA B 42 22.814 40.139 11.500 1.00 15.00 B O -ATOM 1754 N SER B 43 24.771 40.991 10.939 1.00 15.00 B N -ATOM 1755 HN SER B 43 25.425 41.709 11.072 1.00 15.00 B H -ATOM 1756 CA SER B 43 25.050 39.940 9.955 1.00 15.00 B C -ATOM 1757 CB SER B 43 26.403 40.224 9.315 1.00 15.00 B C -ATOM 1758 OG SER B 43 26.877 39.045 8.672 1.00 15.00 B O -ATOM 1759 HG SER B 43 26.144 38.443 8.526 1.00 15.00 B H -ATOM 1760 C SER B 43 25.211 38.629 10.753 1.00 15.00 B C -ATOM 1761 O SER B 43 25.920 38.593 11.751 1.00 15.00 B O -ATOM 1762 N ALA B 44 24.595 37.562 10.350 1.00 15.00 B N -ATOM 1763 HN ALA B 44 24.019 37.591 9.558 1.00 15.00 B H -ATOM 1764 CA ALA B 44 24.773 36.299 11.103 1.00 15.00 B C -ATOM 1765 CB ALA B 44 23.723 35.328 10.588 1.00 15.00 B C -ATOM 1766 C ALA B 44 26.170 35.700 10.847 1.00 15.00 B C -ATOM 1767 O ALA B 44 26.537 34.703 11.448 1.00 15.00 B O -ATOM 1768 N LYS B 45 26.947 36.276 9.944 1.00 15.00 B N -ATOM 1769 HN LYS B 45 26.641 37.081 9.476 1.00 15.00 B H -ATOM 1770 CA LYS B 45 28.289 35.699 9.638 1.00 15.00 B C -ATOM 1771 CB LYS B 45 28.626 35.752 8.123 1.00 15.00 B C -ATOM 1772 CG LYS B 45 27.594 34.951 7.278 1.00 15.00 B C -ATOM 1773 CD LYS B 45 27.916 35.034 5.764 1.00 15.00 B C -ATOM 1774 CE LYS B 45 26.702 34.545 4.945 1.00 15.00 B C -ATOM 1775 NZ LYS B 45 27.107 34.401 3.509 1.00 15.00 B N -ATOM 1776 HZ1 LYS B 45 27.429 35.317 3.135 1.00 15.00 B H -ATOM 1777 HZ2 LYS B 45 26.301 34.072 2.941 1.00 15.00 B H -ATOM 1778 HZ3 LYS B 45 27.881 33.711 3.423 1.00 15.00 B H -ATOM 1779 C LYS B 45 29.348 36.460 10.412 1.00 15.00 B C -ATOM 1780 O LYS B 45 30.533 36.318 10.149 1.00 15.00 B O -ATOM 1781 N SER B 46 28.943 37.269 11.371 1.00 15.00 B N -ATOM 1782 HN SER B 46 27.987 37.359 11.569 1.00 15.00 B H -ATOM 1783 CA SER B 46 29.939 38.041 12.147 1.00 15.00 B C -ATOM 1784 CB SER B 46 29.932 39.490 11.614 1.00 15.00 B C -ATOM 1785 OG SER B 46 30.070 40.404 12.694 1.00 15.00 B O -ATOM 1786 HG SER B 46 29.474 41.145 12.565 1.00 15.00 B H -ATOM 1787 C SER B 46 29.634 37.961 13.638 1.00 15.00 B C -ATOM 1788 O SER B 46 28.722 38.575 14.166 1.00 15.00 B O -ATOM 1789 N LEU B 47 30.443 37.183 14.303 1.00 15.00 B N -ATOM 1790 HN LEU B 47 31.152 36.709 13.820 1.00 15.00 B H -ATOM 1791 CA LEU B 47 30.320 36.994 15.776 1.00 15.00 B C -ATOM 1792 CB LEU B 47 31.462 36.039 16.219 1.00 15.00 B C -ATOM 1793 CG LEU B 47 31.346 35.730 17.720 1.00 15.00 B C -ATOM 1794 CD1 LEU B 47 30.166 34.780 17.986 1.00 15.00 B C -ATOM 1795 CD2 LEU B 47 32.647 35.074 18.193 1.00 15.00 B C -ATOM 1796 C LEU B 47 30.421 38.366 16.477 1.00 15.00 B C -ATOM 1797 O LEU B 47 29.739 38.611 17.446 1.00 15.00 B O -ATOM 1798 N PHE B 48 31.258 39.264 16.009 1.00 15.00 B N -ATOM 1799 HN PHE B 48 31.807 39.066 15.222 1.00 15.00 B H -ATOM 1800 CA PHE B 48 31.365 40.600 16.695 1.00 15.00 B C -ATOM 1801 CB PHE B 48 32.477 41.474 16.091 1.00 15.00 B C -ATOM 1802 CG PHE B 48 32.601 42.748 16.892 1.00 15.00 B C -ATOM 1803 CD1 PHE B 48 31.889 43.896 16.499 1.00 15.00 B C -ATOM 1804 CD2 PHE B 48 33.424 42.786 18.034 1.00 15.00 B C -ATOM 1805 CE1 PHE B 48 31.999 45.084 17.247 1.00 15.00 B C -ATOM 1806 CE2 PHE B 48 33.536 43.975 18.781 1.00 15.00 B C -ATOM 1807 CZ PHE B 48 32.823 45.123 18.388 1.00 15.00 B C -ATOM 1808 C PHE B 48 30.035 41.391 16.690 1.00 15.00 B C -ATOM 1809 O PHE B 48 29.617 41.868 17.727 1.00 15.00 B O -ATOM 1810 N LYS B 49 29.362 41.569 15.577 1.00 15.00 B N -ATOM 1811 HN LYS B 49 29.688 41.190 14.734 1.00 15.00 B H -ATOM 1812 CA LYS B 49 28.107 42.347 15.610 1.00 15.00 B C -ATOM 1813 CB LYS B 49 27.634 42.521 14.170 1.00 15.00 B C -ATOM 1814 CG LYS B 49 28.723 43.192 13.319 1.00 15.00 B C -ATOM 1815 CD LYS B 49 28.863 44.672 13.696 1.00 15.00 B C -ATOM 1816 CE LYS B 49 29.721 45.383 12.648 1.00 15.00 B C -ATOM 1817 NZ LYS B 49 30.166 46.702 13.181 1.00 15.00 B N -ATOM 1818 HZ1 LYS B 49 30.727 46.567 14.047 1.00 15.00 B H -ATOM 1819 HZ2 LYS B 49 29.341 47.294 13.405 1.00 15.00 B H -ATOM 1820 HZ3 LYS B 49 30.750 47.194 12.475 1.00 15.00 B H -ATOM 1821 C LYS B 49 27.033 41.586 16.342 1.00 15.00 B C -ATOM 1822 O LYS B 49 26.141 42.152 16.942 1.00 15.00 B O -ATOM 1823 N LEU B 50 27.084 40.306 16.251 1.00 15.00 B N -ATOM 1824 HN LEU B 50 27.814 39.872 15.761 1.00 15.00 B H -ATOM 1825 CA LEU B 50 26.017 39.486 16.901 1.00 15.00 B C -ATOM 1826 CB LEU B 50 26.315 38.035 16.494 1.00 15.00 B C -ATOM 1827 CG LEU B 50 25.427 37.293 15.487 1.00 15.00 B C -ATOM 1828 CD1 LEU B 50 25.854 35.800 15.606 1.00 15.00 B C -ATOM 1829 CD2 LEU B 50 23.942 37.427 15.814 1.00 15.00 B C -ATOM 1830 C LEU B 50 26.100 39.663 18.424 1.00 15.00 B C -ATOM 1831 O LEU B 50 25.097 39.606 19.120 1.00 15.00 B O -ATOM 1832 N GLN B 51 27.283 39.866 18.934 1.00 15.00 B N -ATOM 1833 HN GLN B 51 28.063 39.919 18.343 1.00 15.00 B H -ATOM 1834 CA GLN B 51 27.460 40.018 20.397 1.00 15.00 B C -ATOM 1835 CB GLN B 51 28.951 40.092 20.735 1.00 15.00 B C -ATOM 1836 CG GLN B 51 29.567 38.696 20.612 1.00 15.00 B C -ATOM 1837 CD GLN B 51 31.091 38.798 20.693 1.00 15.00 B C -ATOM 1838 OE1 GLN B 51 31.656 39.841 20.431 1.00 15.00 B O -ATOM 1839 NE2 GLN B 51 31.786 37.752 21.047 1.00 15.00 B N -ATOM 1840 HE21 GLN B 51 31.304 36.924 21.252 1.00 15.00 B H -ATOM 1841 HE22 GLN B 51 32.761 37.838 21.093 1.00 15.00 B H -ATOM 1842 C GLN B 51 26.825 41.312 20.859 1.00 15.00 B C -ATOM 1843 O GLN B 51 26.716 41.550 22.039 1.00 15.00 B O -ATOM 1844 N THR B 52 26.431 42.181 19.956 1.00 15.00 B N -ATOM 1845 HN THR B 52 26.516 41.985 19.000 1.00 15.00 B H -ATOM 1846 CA THR B 52 25.851 43.475 20.422 1.00 15.00 B C -ATOM 1847 CB THR B 52 26.277 44.658 19.505 1.00 15.00 B C -ATOM 1848 OG1 THR B 52 26.271 44.234 18.149 1.00 15.00 B O -ATOM 1849 HG1 THR B 52 26.801 44.837 17.622 1.00 15.00 B H -ATOM 1850 CG2 THR B 52 27.681 45.137 19.901 1.00 15.00 B C -ATOM 1851 C THR B 52 24.324 43.373 20.553 1.00 15.00 B C -ATOM 1852 O THR B 52 23.665 44.294 20.994 1.00 15.00 B O -ATOM 1853 N LEU B 53 23.763 42.258 20.181 1.00 15.00 B N -ATOM 1854 HN LEU B 53 24.324 41.535 19.830 1.00 15.00 B H -ATOM 1855 CA LEU B 53 22.307 42.054 20.274 1.00 15.00 B C -ATOM 1856 CB LEU B 53 21.904 41.110 19.103 1.00 15.00 B C -ATOM 1857 CG LEU B 53 21.829 41.905 17.787 1.00 15.00 B C -ATOM 1858 CD1 LEU B 53 21.892 40.932 16.605 1.00 15.00 B C -ATOM 1859 CD2 LEU B 53 20.506 42.709 17.705 1.00 15.00 B C -ATOM 1860 C LEU B 53 21.956 41.348 21.593 1.00 15.00 B C -ATOM 1861 O LEU B 53 22.761 40.643 22.169 1.00 15.00 B O -ATOM 1862 N GLY B 54 20.735 41.502 22.042 1.00 15.00 B N -ATOM 1863 HN GLY B 54 20.108 42.077 21.556 1.00 15.00 B H -ATOM 1864 CA GLY B 54 20.301 40.802 23.293 1.00 15.00 B C -ATOM 1865 C GLY B 54 19.838 39.433 22.830 1.00 15.00 B C -ATOM 1866 O GLY B 54 18.810 39.324 22.193 1.00 15.00 B O -ATOM 1867 N LEU B 55 20.599 38.388 23.081 1.00 15.00 B N -ATOM 1868 HN LEU B 55 21.435 38.493 23.581 1.00 15.00 B H -ATOM 1869 CA LEU B 55 20.181 37.064 22.604 1.00 15.00 B C -ATOM 1870 CB LEU B 55 21.193 36.547 21.573 1.00 15.00 B C -ATOM 1871 CG LEU B 55 21.364 37.399 20.300 1.00 15.00 B C -ATOM 1872 CD1 LEU B 55 22.437 36.731 19.407 1.00 15.00 B C -ATOM 1873 CD2 LEU B 55 20.054 37.481 19.508 1.00 15.00 B C -ATOM 1874 C LEU B 55 20.097 36.177 23.838 1.00 15.00 B C -ATOM 1875 O LEU B 55 20.627 35.078 23.864 1.00 15.00 B O -ATOM 1876 N THR B 56 19.430 36.677 24.879 1.00 15.00 B N -ATOM 1877 HN THR B 56 19.035 37.572 24.821 1.00 15.00 B H -ATOM 1878 CA THR B 56 19.284 35.890 26.115 1.00 15.00 B C -ATOM 1879 CB THR B 56 19.016 36.835 27.301 1.00 15.00 B C -ATOM 1880 OG1 THR B 56 17.682 37.317 27.226 1.00 15.00 B O -ATOM 1881 HG1 THR B 56 17.532 37.956 27.927 1.00 15.00 B H -ATOM 1882 CG2 THR B 56 19.988 38.014 27.252 1.00 15.00 B C -ATOM 1883 C THR B 56 18.105 34.917 25.963 1.00 15.00 B C -ATOM 1884 O THR B 56 17.350 34.989 25.014 1.00 15.00 B O -ATOM 1885 N GLN B 57 17.939 34.013 26.893 1.00 15.00 B N -ATOM 1886 HN GLN B 57 18.560 33.972 27.650 1.00 15.00 B H -ATOM 1887 CA GLN B 57 16.813 33.048 26.806 1.00 15.00 B C -ATOM 1888 CB GLN B 57 16.823 32.168 28.075 1.00 15.00 B C -ATOM 1889 CG GLN B 57 15.698 31.138 27.979 1.00 15.00 B C -ATOM 1890 CD GLN B 57 15.840 30.191 29.157 1.00 15.00 B C -ATOM 1891 OE1 GLN B 57 15.520 29.016 29.068 1.00 15.00 B O -ATOM 1892 NE2 GLN B 57 16.331 30.681 30.266 1.00 15.00 B N -ATOM 1893 HE21 GLN B 57 16.581 31.628 30.283 1.00 15.00 B H -ATOM 1894 HE22 GLN B 57 16.428 30.080 31.034 1.00 15.00 B H -ATOM 1895 C GLN B 57 15.484 33.780 26.738 1.00 15.00 B C -ATOM 1896 O GLN B 57 15.256 34.733 27.464 1.00 15.00 B O -ATOM 1897 N GLY B 58 14.574 33.321 25.895 1.00 15.00 B N -ATOM 1898 HN GLY B 58 14.781 32.558 25.321 1.00 15.00 B H -ATOM 1899 CA GLY B 58 13.252 33.967 25.835 1.00 15.00 B C -ATOM 1900 C GLY B 58 13.184 35.068 24.781 1.00 15.00 B C -ATOM 1901 O GLY B 58 12.147 35.684 24.565 1.00 15.00 B O -ATOM 1902 N THR B 59 14.272 35.333 24.139 1.00 15.00 B N -ATOM 1903 HN THR B 59 15.088 34.828 24.337 1.00 15.00 B H -ATOM 1904 CA THR B 59 14.298 36.393 23.106 1.00 15.00 B C -ATOM 1905 CB THR B 59 15.761 36.889 22.938 1.00 15.00 B C -ATOM 1906 OG1 THR B 59 16.191 37.523 24.139 1.00 15.00 B O -ATOM 1907 HG1 THR B 59 16.347 36.858 24.814 1.00 15.00 B H -ATOM 1908 CG2 THR B 59 15.819 37.896 21.778 1.00 15.00 B C -ATOM 1909 C THR B 59 13.828 35.854 21.745 1.00 15.00 B C -ATOM 1910 O THR B 59 14.310 34.838 21.292 1.00 15.00 B O -ATOM 1911 N VAL B 60 12.938 36.561 21.059 1.00 15.00 B N -ATOM 1912 HN VAL B 60 12.570 37.381 21.450 1.00 15.00 B H -ATOM 1913 CA VAL B 60 12.492 36.133 19.716 1.00 15.00 B C -ATOM 1914 CB VAL B 60 11.020 36.566 19.486 1.00 15.00 B C -ATOM 1915 CG1 VAL B 60 10.555 36.204 18.066 1.00 15.00 B C -ATOM 1916 CG2 VAL B 60 10.107 35.952 20.545 1.00 15.00 B C -ATOM 1917 C VAL B 60 13.360 36.857 18.711 1.00 15.00 B C -ATOM 1918 O VAL B 60 13.391 38.083 18.703 1.00 15.00 B O -ATOM 1919 N VAL B 61 14.059 36.157 17.835 1.00 15.00 B N -ATOM 1920 HN VAL B 61 14.052 35.177 17.839 1.00 15.00 B H -ATOM 1921 CA VAL B 61 14.864 36.932 16.833 1.00 15.00 B C -ATOM 1922 CB VAL B 61 16.312 36.441 16.765 1.00 15.00 B C -ATOM 1923 CG1 VAL B 61 17.074 36.774 18.062 1.00 15.00 B C -ATOM 1924 CG2 VAL B 61 16.281 34.931 16.524 1.00 15.00 B C -ATOM 1925 C VAL B 61 14.293 36.732 15.446 1.00 15.00 B C -ATOM 1926 O VAL B 61 13.603 35.745 15.209 1.00 15.00 B O -ATOM 1927 N THR B 62 14.625 37.620 14.502 1.00 15.00 B N -ATOM 1928 HN THR B 62 15.167 38.407 14.720 1.00 15.00 B H -ATOM 1929 CA THR B 62 14.149 37.382 13.113 1.00 15.00 B C -ATOM 1930 CB THR B 62 13.423 38.601 12.484 1.00 15.00 B C -ATOM 1931 OG1 THR B 62 12.316 38.915 13.324 1.00 15.00 B O -ATOM 1932 HG1 THR B 62 11.511 38.563 12.938 1.00 15.00 B H -ATOM 1933 CG2 THR B 62 12.914 38.197 11.088 1.00 15.00 B C -ATOM 1934 C THR B 62 15.386 37.021 12.291 1.00 15.00 B C -ATOM 1935 O THR B 62 16.382 37.717 12.330 1.00 15.00 B O -ATOM 1936 N ILE B 63 15.323 35.952 11.540 1.00 15.00 B N -ATOM 1937 HN ILE B 63 14.505 35.413 11.548 1.00 15.00 B H -ATOM 1938 CA ILE B 63 16.459 35.529 10.672 1.00 15.00 B C -ATOM 1939 CB ILE B 63 16.865 34.022 10.831 1.00 15.00 B C -ATOM 1940 CG1 ILE B 63 17.198 33.728 12.319 1.00 15.00 B C -ATOM 1941 CG2 ILE B 63 18.059 33.733 9.891 1.00 15.00 B C -ATOM 1942 CD1 ILE B 63 17.608 32.259 12.559 1.00 15.00 B C -ATOM 1943 C ILE B 63 15.924 35.795 9.251 1.00 15.00 B C -ATOM 1944 O ILE B 63 14.906 35.258 8.877 1.00 15.00 B O -ATOM 1945 N SER B 64 16.588 36.634 8.493 1.00 15.00 B N -ATOM 1946 HN SER B 64 17.396 37.049 8.861 1.00 15.00 B H -ATOM 1947 CA SER B 64 16.183 36.994 7.099 1.00 15.00 B C -ATOM 1948 CB SER B 64 15.827 38.499 6.933 1.00 15.00 B C -ATOM 1949 OG SER B 64 15.323 39.025 8.147 1.00 15.00 B O -ATOM 1950 HG SER B 64 15.666 39.912 8.279 1.00 15.00 B H -ATOM 1951 C SER B 64 17.357 36.727 6.197 1.00 15.00 B C -ATOM 1952 O SER B 64 18.506 36.929 6.580 1.00 15.00 B O -ATOM 1953 N ALA B 65 17.104 36.323 4.990 1.00 15.00 B N -ATOM 1954 HN ALA B 65 16.184 36.173 4.687 1.00 15.00 B H -ATOM 1955 CA ALA B 65 18.265 36.095 4.081 1.00 15.00 B C -ATOM 1956 CB ALA B 65 18.665 34.633 3.955 1.00 15.00 B C -ATOM 1957 C ALA B 65 17.898 36.569 2.710 1.00 15.00 B C -ATOM 1958 O ALA B 65 16.735 36.574 2.324 1.00 15.00 B O -ATOM 1959 N GLU B 66 18.891 36.937 1.961 1.00 15.00 B N -ATOM 1960 HN GLU B 66 19.809 36.913 2.304 1.00 15.00 B H -ATOM 1961 CA GLU B 66 18.615 37.396 0.571 1.00 15.00 B C -ATOM 1962 CB GLU B 66 18.606 38.934 0.607 1.00 15.00 B C -ATOM 1963 CG GLU B 66 17.597 39.684 -0.288 1.00 15.00 B C -ATOM 1964 CD GLU B 66 17.462 39.109 -1.688 1.00 15.00 B C -ATOM 1965 OE1 GLU B 66 18.262 39.442 -2.552 1.00 15.00 B O -ATOM 1966 OE2 GLU B 66 16.512 38.377 -1.881 1.00 15.00 B O -ATOM 1967 C GLU B 66 19.730 36.869 -0.297 1.00 15.00 B C -ATOM 1968 O GLU B 66 20.875 37.281 -0.180 1.00 15.00 B O -ATOM 1969 N GLY B 67 19.425 35.957 -1.164 1.00 15.00 B N -ATOM 1970 HN GLY B 67 18.506 35.627 -1.246 1.00 15.00 B H -ATOM 1971 CA GLY B 67 20.507 35.436 -2.019 1.00 15.00 B C -ATOM 1972 C GLY B 67 20.029 34.156 -2.681 1.00 15.00 B C -ATOM 1973 O GLY B 67 18.888 33.755 -2.568 1.00 15.00 B O -ATOM 1974 N GLU B 68 20.935 33.536 -3.350 1.00 15.00 B N -ATOM 1975 HN GLU B 68 21.832 33.930 -3.383 1.00 15.00 B H -ATOM 1976 CA GLU B 68 20.711 32.275 -4.068 1.00 15.00 B C -ATOM 1977 CB GLU B 68 22.102 31.787 -4.531 1.00 15.00 B C -ATOM 1978 CG GLU B 68 22.077 31.007 -5.847 1.00 15.00 B C -ATOM 1979 CD GLU B 68 23.504 31.001 -6.399 1.00 15.00 B C -ATOM 1980 OE1 GLU B 68 24.399 30.748 -5.606 1.00 15.00 B O -ATOM 1981 OE2 GLU B 68 23.678 31.278 -7.577 1.00 15.00 B O -ATOM 1982 C GLU B 68 20.142 31.173 -3.184 1.00 15.00 B C -ATOM 1983 O GLU B 68 19.299 30.436 -3.659 1.00 15.00 B O -ATOM 1984 N ASP B 69 20.601 30.990 -1.932 1.00 15.00 B N -ATOM 1985 HN ASP B 69 21.281 31.579 -1.544 1.00 15.00 B H -ATOM 1986 CA ASP B 69 20.024 29.843 -1.157 1.00 15.00 B C -ATOM 1987 CB ASP B 69 21.163 28.906 -0.694 1.00 15.00 B C -ATOM 1988 CG ASP B 69 22.301 29.706 -0.020 1.00 15.00 B C -ATOM 1989 OD1 ASP B 69 22.058 30.827 0.412 1.00 15.00 B O -ATOM 1990 OD2 ASP B 69 23.403 29.176 0.051 1.00 15.00 B O -ATOM 1991 C ASP B 69 19.284 30.403 0.025 1.00 15.00 B C -ATOM 1992 O ASP B 69 19.334 29.849 1.109 1.00 15.00 B O -ATOM 1993 N GLU B 70 18.630 31.531 -0.149 1.00 15.00 B N -ATOM 1994 HN GLU B 70 18.576 31.952 -1.032 1.00 15.00 B H -ATOM 1995 CA GLU B 70 17.973 32.150 1.040 1.00 15.00 B C -ATOM 1996 CB GLU B 70 17.418 33.500 0.593 1.00 15.00 B C -ATOM 1997 CG GLU B 70 16.199 33.364 -0.350 1.00 15.00 B C -ATOM 1998 CD GLU B 70 15.802 34.749 -0.903 1.00 15.00 B C -ATOM 1999 OE1 GLU B 70 16.693 35.470 -1.324 1.00 15.00 B O -ATOM 2000 OE2 GLU B 70 14.618 35.063 -0.902 1.00 15.00 B O -ATOM 2001 C GLU B 70 16.915 31.349 1.803 1.00 15.00 B C -ATOM 2002 O GLU B 70 16.749 31.565 2.995 1.00 15.00 B O -ATOM 2003 N GLN B 71 16.179 30.492 1.206 1.00 15.00 B N -ATOM 2004 HN GLN B 71 16.299 30.309 0.251 1.00 15.00 B H -ATOM 2005 CA GLN B 71 15.119 29.765 2.004 1.00 15.00 B C -ATOM 2006 CB GLN B 71 13.944 29.180 1.160 1.00 15.00 B C -ATOM 2007 CG GLN B 71 13.728 29.752 -0.280 1.00 15.00 B C -ATOM 2008 CD GLN B 71 12.376 30.498 -0.366 1.00 15.00 B C -ATOM 2009 OE1 GLN B 71 12.265 31.586 0.163 1.00 15.00 B O -ATOM 2010 NE2 GLN B 71 11.427 30.084 -1.185 1.00 15.00 B N -ATOM 2011 HE21 GLN B 71 11.603 29.293 -1.735 1.00 15.00 B H -ATOM 2012 HE22 GLN B 71 10.585 30.585 -1.209 1.00 15.00 B H -ATOM 2013 C GLN B 71 15.771 28.642 2.834 1.00 15.00 B C -ATOM 2014 O GLN B 71 15.469 28.439 3.995 1.00 15.00 B O -ATOM 2015 N LYS B 72 16.656 27.934 2.225 1.00 15.00 B N -ATOM 2016 HN LYS B 72 16.854 28.136 1.287 1.00 15.00 B H -ATOM 2017 CA LYS B 72 17.375 26.846 2.870 1.00 15.00 B C -ATOM 2018 CB LYS B 72 18.355 26.160 1.898 1.00 15.00 B C -ATOM 2019 CG LYS B 72 18.606 24.736 2.440 1.00 15.00 B C -ATOM 2020 CD LYS B 72 19.641 23.986 1.580 1.00 15.00 B C -ATOM 2021 CE LYS B 72 21.014 24.023 2.246 1.00 15.00 B C -ATOM 2022 NZ LYS B 72 21.027 23.108 3.427 1.00 15.00 B N -ATOM 2023 HZ1 LYS B 72 22.005 22.846 3.665 1.00 15.00 B H -ATOM 2024 HZ2 LYS B 72 20.488 22.244 3.218 1.00 15.00 B H -ATOM 2025 HZ3 LYS B 72 20.598 23.582 4.246 1.00 15.00 B H -ATOM 2026 C LYS B 72 18.199 27.462 3.991 1.00 15.00 B C -ATOM 2027 O LYS B 72 18.319 26.898 5.057 1.00 15.00 B O -ATOM 2028 N ALA B 73 18.810 28.627 3.743 1.00 15.00 B N -ATOM 2029 HN ALA B 73 18.704 29.075 2.878 1.00 15.00 B H -ATOM 2030 CA ALA B 73 19.652 29.223 4.810 1.00 15.00 B C -ATOM 2031 CB ALA B 73 20.334 30.492 4.259 1.00 15.00 B C -ATOM 2032 C ALA B 73 18.807 29.550 6.049 1.00 15.00 B C -ATOM 2033 O ALA B 73 19.191 29.239 7.159 1.00 15.00 B O -ATOM 2034 N VAL B 74 17.676 30.170 5.873 1.00 15.00 B N -ATOM 2035 HN VAL B 74 17.386 30.398 4.965 1.00 15.00 B H -ATOM 2036 CA VAL B 74 16.807 30.541 7.045 1.00 15.00 B C -ATOM 2037 CB VAL B 74 15.705 31.532 6.593 1.00 15.00 B C -ATOM 2038 CG1 VAL B 74 14.668 31.781 7.705 1.00 15.00 B C -ATOM 2039 CG2 VAL B 74 16.361 32.865 6.167 1.00 15.00 B C -ATOM 2040 C VAL B 74 16.243 29.267 7.650 1.00 15.00 B C -ATOM 2041 O VAL B 74 16.155 29.130 8.866 1.00 15.00 B O -ATOM 2042 N GLU B 75 15.871 28.332 6.806 1.00 15.00 B N -ATOM 2043 HN GLU B 75 15.969 28.472 5.841 1.00 15.00 B H -ATOM 2044 CA GLU B 75 15.294 27.046 7.326 1.00 15.00 B C -ATOM 2045 CB GLU B 75 14.881 26.071 6.189 1.00 15.00 B C -ATOM 2046 CG GLU B 75 13.539 26.619 5.658 1.00 15.00 B C -ATOM 2047 CD GLU B 75 13.027 25.980 4.367 1.00 15.00 B C -ATOM 2048 OE1 GLU B 75 13.613 25.028 3.877 1.00 15.00 B O -ATOM 2049 OE2 GLU B 75 12.027 26.495 3.882 1.00 15.00 B O -ATOM 2050 C GLU B 75 16.283 26.387 8.243 1.00 15.00 B C -ATOM 2051 O GLU B 75 15.953 25.933 9.326 1.00 15.00 B O -ATOM 2052 N HIS B 76 17.492 26.324 7.819 1.00 15.00 B N -ATOM 2053 HN HIS B 76 17.725 26.704 6.946 1.00 15.00 B H -ATOM 2054 CA HIS B 76 18.525 25.686 8.637 1.00 15.00 B C -ATOM 2055 CB HIS B 76 19.771 25.441 7.750 1.00 15.00 B C -ATOM 2056 CG HIS B 76 19.368 24.390 6.747 1.00 15.00 B C -ATOM 2057 ND1 HIS B 76 20.129 23.266 6.459 1.00 15.00 B N -ATOM 2058 HD1 HIS B 76 21.007 23.039 6.832 1.00 15.00 B H -ATOM 2059 CD2 HIS B 76 18.234 24.270 5.991 1.00 15.00 B C -ATOM 2060 CE1 HIS B 76 19.435 22.533 5.561 1.00 15.00 B C -ATOM 2061 NE2 HIS B 76 18.278 23.105 5.247 1.00 15.00 B N -ATOM 2062 C HIS B 76 18.900 26.490 9.861 1.00 15.00 B C -ATOM 2063 O HIS B 76 19.221 25.910 10.884 1.00 15.00 B O -ATOM 2064 N LEU B 77 18.922 27.789 9.794 1.00 15.00 B N -ATOM 2065 HN LEU B 77 18.639 28.254 8.979 1.00 15.00 B H -ATOM 2066 CA LEU B 77 19.387 28.553 10.985 1.00 15.00 B C -ATOM 2067 CB LEU B 77 19.939 29.927 10.535 1.00 15.00 B C -ATOM 2068 CG LEU B 77 21.229 29.750 9.700 1.00 15.00 B C -ATOM 2069 CD1 LEU B 77 21.642 31.122 9.180 1.00 15.00 B C -ATOM 2070 CD2 LEU B 77 22.399 29.243 10.560 1.00 15.00 B C -ATOM 2071 C LEU B 77 18.312 28.674 12.023 1.00 15.00 B C -ATOM 2072 O LEU B 77 18.603 28.822 13.199 1.00 15.00 B O -ATOM 2073 N VAL B 78 17.091 28.596 11.620 1.00 15.00 B N -ATOM 2074 HN VAL B 78 16.894 28.472 10.668 1.00 15.00 B H -ATOM 2075 CA VAL B 78 16.008 28.692 12.580 1.00 15.00 B C -ATOM 2076 CB VAL B 78 14.735 28.939 11.757 1.00 15.00 B C -ATOM 2077 CG1 VAL B 78 13.539 28.310 12.469 1.00 15.00 B C -ATOM 2078 CG2 VAL B 78 14.463 30.445 11.623 1.00 15.00 B C -ATOM 2079 C VAL B 78 16.003 27.377 13.351 1.00 15.00 B C -ATOM 2080 O VAL B 78 15.791 27.343 14.554 1.00 15.00 B O -ATOM 2081 N LYS B 79 16.249 26.299 12.641 1.00 15.00 B N -ATOM 2082 HN LYS B 79 16.421 26.377 11.679 1.00 15.00 B H -ATOM 2083 CA LYS B 79 16.268 24.971 13.286 1.00 15.00 B C -ATOM 2084 CB LYS B 79 16.265 23.894 12.222 1.00 15.00 B C -ATOM 2085 CG LYS B 79 16.173 22.539 12.911 1.00 15.00 B C -ATOM 2086 CD LYS B 79 15.783 21.467 11.871 1.00 15.00 B C -ATOM 2087 CE LYS B 79 16.881 20.402 11.748 1.00 15.00 B C -ATOM 2088 NZ LYS B 79 17.160 20.233 10.304 1.00 15.00 B N -ATOM 2089 HZ1 LYS B 79 17.481 21.133 9.894 1.00 15.00 B H -ATOM 2090 HZ2 LYS B 79 16.300 19.926 9.807 1.00 15.00 B H -ATOM 2091 HZ3 LYS B 79 17.902 19.517 10.165 1.00 15.00 B H -ATOM 2092 C LYS B 79 17.490 24.920 14.197 1.00 15.00 B C -ATOM 2093 O LYS B 79 17.394 24.574 15.362 1.00 15.00 B O -ATOM 2094 N LEU B 80 18.638 25.300 13.704 1.00 15.00 B N -ATOM 2095 HN LEU B 80 18.714 25.566 12.764 1.00 15.00 B H -ATOM 2096 CA LEU B 80 19.809 25.322 14.581 1.00 15.00 B C -ATOM 2097 CB LEU B 80 20.977 25.916 13.778 1.00 15.00 B C -ATOM 2098 CG LEU B 80 22.248 25.864 14.593 1.00 15.00 B C -ATOM 2099 CD1 LEU B 80 22.514 24.445 15.113 1.00 15.00 B C -ATOM 2100 CD2 LEU B 80 23.416 26.304 13.731 1.00 15.00 B C -ATOM 2101 C LEU B 80 19.541 26.193 15.829 1.00 15.00 B C -ATOM 2102 O LEU B 80 19.814 25.796 16.949 1.00 15.00 B O -ATOM 2103 N MET B 81 19.009 27.376 15.650 1.00 15.00 B N -ATOM 2104 HN MET B 81 18.766 27.669 14.747 1.00 15.00 B H -ATOM 2105 CA MET B 81 18.772 28.275 16.803 1.00 15.00 B C -ATOM 2106 CB MET B 81 18.237 29.656 16.365 1.00 15.00 B C -ATOM 2107 CG MET B 81 18.560 30.632 17.519 1.00 15.00 B C -ATOM 2108 SD MET B 81 18.693 32.312 16.876 1.00 15.00 B S -ATOM 2109 CE MET B 81 20.484 32.566 17.066 1.00 15.00 B C -ATOM 2110 C MET B 81 17.807 27.701 17.833 1.00 15.00 B C -ATOM 2111 O MET B 81 17.933 27.941 19.021 1.00 15.00 B O -ATOM 2112 N ALA B 82 16.837 26.983 17.400 1.00 15.00 B N -ATOM 2113 HN ALA B 82 16.749 26.807 16.440 1.00 15.00 B H -ATOM 2114 CA ALA B 82 15.837 26.413 18.361 1.00 15.00 B C -ATOM 2115 CB ALA B 82 14.538 26.054 17.626 1.00 15.00 B C -ATOM 2116 C ALA B 82 16.461 25.188 19.064 1.00 15.00 B C -ATOM 2117 O ALA B 82 16.140 24.892 20.199 1.00 15.00 B O -ATOM 2118 N GLU B 83 17.366 24.497 18.390 1.00 15.00 B N -ATOM 2119 HN GLU B 83 17.590 24.783 17.480 1.00 15.00 B H -ATOM 2120 CA GLU B 83 18.059 23.308 18.950 1.00 15.00 B C -ATOM 2121 CB GLU B 83 18.873 22.627 17.841 1.00 15.00 B C -ATOM 2122 CG GLU B 83 18.067 21.572 17.098 1.00 15.00 B C -ATOM 2123 CD GLU B 83 18.747 21.236 15.761 1.00 15.00 B C -ATOM 2124 OE1 GLU B 83 19.692 21.925 15.393 1.00 15.00 B O -ATOM 2125 OE2 GLU B 83 18.303 20.297 15.124 1.00 15.00 B O -ATOM 2126 C GLU B 83 19.156 23.708 19.954 1.00 15.00 B C -ATOM 2127 O GLU B 83 19.446 23.005 20.896 1.00 15.00 B O -ATOM 2128 N LEU B 84 19.834 24.791 19.676 1.00 15.00 B N -ATOM 2129 HN LEU B 84 19.588 25.326 18.893 1.00 15.00 B H -ATOM 2130 CA LEU B 84 20.966 25.223 20.523 1.00 15.00 B C -ATOM 2131 CB LEU B 84 21.588 26.445 19.840 1.00 15.00 B C -ATOM 2132 CG LEU B 84 22.725 26.110 18.848 1.00 15.00 B C -ATOM 2133 CD1 LEU B 84 22.733 24.651 18.365 1.00 15.00 B C -ATOM 2134 CD2 LEU B 84 22.539 27.020 17.654 1.00 15.00 B C -ATOM 2135 C LEU B 84 20.582 25.387 22.015 1.00 15.00 B C -ATOM 2136 O LEU B 84 19.632 26.008 22.441 1.00 15.00 B O -ATOM 2137 N GLU B 85 21.427 24.691 22.731 1.00 15.00 B N -ATOM 2138 HN GLU B 85 22.124 24.248 22.205 1.00 15.00 B H -ATOM 2139 CA GLU B 85 21.525 24.453 24.184 1.00 15.00 B C -ATOM 2140 CB GLU B 85 22.141 23.025 24.360 1.00 15.00 B C -ATOM 2141 CG GLU B 85 22.868 22.434 23.118 1.00 15.00 B C -ATOM 2142 CD GLU B 85 24.090 23.197 22.572 1.00 15.00 B C -ATOM 2143 OE1 GLU B 85 24.772 23.914 23.293 1.00 15.00 B O -ATOM 2144 OE2 GLU B 85 24.340 22.985 21.394 1.00 15.00 B O -ATOM 2145 C GLU B 85 22.437 25.489 24.855 1.00 15.00 B C -ATOM 2146 O GLU B 85 22.762 26.544 24.297 1.00 15.00 B O -END diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.psf b/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.psf deleted file mode 100644 index 9369e3141..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/0_topoaa/prot-prot_haddock.psf +++ /dev/null @@ -1,16430 +0,0 @@ -data_cns_mtf - -_cns_mtf.title -; FILENAME="prot-prot_haddock.psf" - Patching histidine 75 to HISD - Patching histidine 90 to HISD - Patching histidine 76 to HISD - Patching histidine 15 to HISE - DATE:01-Oct-2024 16:32:30 created by user: unknown - VERSION:1.3U -; - -loop_ -_cns_mtf_atom.id -_cns_mtf_atom.segment_id -_cns_mtf_atom.residue_id -_cns_mtf_atom.residue_name -_cns_mtf_atom.atom_name -_cns_mtf_atom.chemical_type -_cns_mtf_atom.charge -_cns_mtf_atom.atom_mass -1 'A' '19' 'THR' 'N' 'NH1' -0.570000 14.0070 -2 'A' '19' 'THR' 'HN' 'H' 0.370000 1.00800 -3 'A' '19' 'THR' 'CA' 'CH1E' 0.200000 12.0110 -4 'A' '19' 'THR' 'CB' 'CH1E' 0.265000 12.0110 -5 'A' '19' 'THR' 'OG1' 'OH1' -0.700000 15.9990 -6 'A' '19' 'THR' 'HG1' 'H' 0.435000 1.00800 -7 'A' '19' 'THR' 'CG2' 'CH3E' -0.00000 12.0110 -8 'A' '19' 'THR' 'C' 'C' 0.500000 12.0110 -9 'A' '19' 'THR' 'O' 'O' -0.500000 15.9990 -10 'A' '20' 'ILE' 'N' 'NH1' -0.570000 14.0070 -11 'A' '20' 'ILE' 'HN' 'H' 0.370000 1.00800 -12 'A' '20' 'ILE' 'CA' 'CH1E' 0.200000 12.0110 -13 'A' '20' 'ILE' 'CB' 'CH1E' 0.00000 12.0110 -14 'A' '20' 'ILE' 'CG1' 'CH2E' 0.00000 12.0110 -15 'A' '20' 'ILE' 'CG2' 'CH3E' 0.00000 12.0110 -16 'A' '20' 'ILE' 'CD1' 'CH3E' 0.00000 12.0110 -17 'A' '20' 'ILE' 'C' 'C' 0.500000 12.0110 -18 'A' '20' 'ILE' 'O' 'O' -0.500000 15.9990 -19 'A' '21' 'GLU' 'N' 'NH1' -0.570000 14.0070 -20 'A' '21' 'GLU' 'HN' 'H' 0.370000 1.00800 -21 'A' '21' 'GLU' 'CA' 'CH1E' 0.200000 12.0110 -22 'A' '21' 'GLU' 'CB' 'CH2E' 0.00000 12.0110 -23 'A' '21' 'GLU' 'CG' 'CH2E' -0.100000 12.0110 -24 'A' '21' 'GLU' 'CD' 'C' 0.700000 12.0110 -25 'A' '21' 'GLU' 'OE1' 'OC' -0.800000 15.9990 -26 'A' '21' 'GLU' 'OE2' 'OC' -0.800000 15.9990 -27 'A' '21' 'GLU' 'C' 'C' 0.500000 12.0110 -28 'A' '21' 'GLU' 'O' 'O' -0.500000 15.9990 -29 'A' '22' 'ILE' 'N' 'NH1' -0.570000 14.0070 -30 'A' '22' 'ILE' 'HN' 'H' 0.370000 1.00800 -31 'A' '22' 'ILE' 'CA' 'CH1E' 0.200000 12.0110 -32 'A' '22' 'ILE' 'CB' 'CH1E' 0.00000 12.0110 -33 'A' '22' 'ILE' 'CG1' 'CH2E' 0.00000 12.0110 -34 'A' '22' 'ILE' 'CG2' 'CH3E' 0.00000 12.0110 -35 'A' '22' 'ILE' 'CD1' 'CH3E' 0.00000 12.0110 -36 'A' '22' 'ILE' 'C' 'C' 0.500000 12.0110 -37 'A' '22' 'ILE' 'O' 'O' -0.500000 15.9990 -38 'A' '23' 'ILE' 'N' 'NH1' -0.570000 14.0070 -39 'A' '23' 'ILE' 'HN' 'H' 0.370000 1.00800 -40 'A' '23' 'ILE' 'CA' 'CH1E' 0.200000 12.0110 -41 'A' '23' 'ILE' 'CB' 'CH1E' 0.00000 12.0110 -42 'A' '23' 'ILE' 'CG1' 'CH2E' 0.00000 12.0110 -43 'A' '23' 'ILE' 'CG2' 'CH3E' 0.00000 12.0110 -44 'A' '23' 'ILE' 'CD1' 'CH3E' 0.00000 12.0110 -45 'A' '23' 'ILE' 'C' 'C' 0.500000 12.0110 -46 'A' '23' 'ILE' 'O' 'O' -0.500000 15.9990 -47 'A' '24' 'ALA' 'N' 'NH1' -0.570000 14.0070 -48 'A' '24' 'ALA' 'HN' 'H' 0.370000 1.00800 -49 'A' '24' 'ALA' 'CA' 'CH1E' 0.200000 12.0110 -50 'A' '24' 'ALA' 'CB' 'CH3E' 0.00000 12.0110 -51 'A' '24' 'ALA' 'C' 'C' 0.500000 12.0110 -52 'A' '24' 'ALA' 'O' 'O' -0.500000 15.9990 -53 'A' '25' 'PRO' 'N' 'N' -0.570000 14.0070 -54 'A' '25' 'PRO' 'CA' 'CH1E' 0.285000 12.0110 -55 'A' '25' 'PRO' 'CB' 'CH2E' 0.00000 12.0110 -56 'A' '25' 'PRO' 'CG' 'CH2P' 0.00000 12.0110 -57 'A' '25' 'PRO' 'CD' 'CH2P' 0.285000 12.0110 -58 'A' '25' 'PRO' 'C' 'C' 0.500000 12.0110 -59 'A' '25' 'PRO' 'O' 'O' -0.500000 15.9990 -60 'A' '26' 'LEU' 'N' 'NH1' -0.570000 14.0070 -61 'A' '26' 'LEU' 'HN' 'H' 0.370000 1.00800 -62 'A' '26' 'LEU' 'CA' 'CH1E' 0.200000 12.0110 -63 'A' '26' 'LEU' 'CB' 'CH2E' 0.00000 12.0110 -64 'A' '26' 'LEU' 'CG' 'CH1E' 0.00000 12.0110 -65 'A' '26' 'LEU' 'CD1' 'CH3E' 0.00000 12.0110 -66 'A' '26' 'LEU' 'CD2' 'CH3E' 0.00000 12.0110 -67 'A' '26' 'LEU' 'C' 'C' 0.500000 12.0110 -68 'A' '26' 'LEU' 'O' 'O' -0.500000 15.9990 -69 'A' '27' 'SER' 'N' 'NH1' -0.570000 14.0070 -70 'A' '27' 'SER' 'HN' 'H' 0.370000 1.00800 -71 'A' '27' 'SER' 'CA' 'CH1E' 0.200000 12.0110 -72 'A' '27' 'SER' 'CB' 'CH2E' 0.265000 12.0110 -73 'A' '27' 'SER' 'OG' 'OH1' -0.700000 15.9990 -74 'A' '27' 'SER' 'HG' 'H' 0.435000 1.00800 -75 'A' '27' 'SER' 'C' 'C' 0.500000 12.0110 -76 'A' '27' 'SER' 'O' 'O' -0.500000 15.9990 -77 'A' '28' 'GLY' 'N' 'NH1' -0.570000 14.0070 -78 'A' '28' 'GLY' 'HN' 'H' 0.370000 1.00800 -79 'A' '28' 'GLY' 'CA' 'CH2G' 0.200000 12.0110 -80 'A' '28' 'GLY' 'C' 'C' 0.500000 12.0110 -81 'A' '28' 'GLY' 'O' 'O' -0.500000 15.9990 -82 'A' '29' 'GLU' 'N' 'NH1' -0.570000 14.0070 -83 'A' '29' 'GLU' 'HN' 'H' 0.370000 1.00800 -84 'A' '29' 'GLU' 'CA' 'CH1E' 0.200000 12.0110 -85 'A' '29' 'GLU' 'CB' 'CH2E' 0.00000 12.0110 -86 'A' '29' 'GLU' 'CG' 'CH2E' -0.100000 12.0110 -87 'A' '29' 'GLU' 'CD' 'C' 0.700000 12.0110 -88 'A' '29' 'GLU' 'OE1' 'OC' -0.800000 15.9990 -89 'A' '29' 'GLU' 'OE2' 'OC' -0.800000 15.9990 -90 'A' '29' 'GLU' 'C' 'C' 0.500000 12.0110 -91 'A' '29' 'GLU' 'O' 'O' -0.500000 15.9990 -92 'A' '30' 'ILE' 'N' 'NH1' -0.570000 14.0070 -93 'A' '30' 'ILE' 'HN' 'H' 0.370000 1.00800 -94 'A' '30' 'ILE' 'CA' 'CH1E' 0.200000 12.0110 -95 'A' '30' 'ILE' 'CB' 'CH1E' 0.00000 12.0110 -96 'A' '30' 'ILE' 'CG1' 'CH2E' 0.00000 12.0110 -97 'A' '30' 'ILE' 'CG2' 'CH3E' 0.00000 12.0110 -98 'A' '30' 'ILE' 'CD1' 'CH3E' 0.00000 12.0110 -99 'A' '30' 'ILE' 'C' 'C' 0.500000 12.0110 -100 'A' '30' 'ILE' 'O' 'O' -0.500000 15.9990 -101 'A' '31' 'VAL' 'N' 'NH1' -0.570000 14.0070 -102 'A' '31' 'VAL' 'HN' 'H' 0.370000 1.00800 -103 'A' '31' 'VAL' 'CA' 'CH1E' 0.200000 12.0110 -104 'A' '31' 'VAL' 'CB' 'CH1E' 0.00000 12.0110 -105 'A' '31' 'VAL' 'CG1' 'CH3E' 0.00000 12.0110 -106 'A' '31' 'VAL' 'CG2' 'CH3E' -0.00000 12.0110 -107 'A' '31' 'VAL' 'C' 'C' 0.500000 12.0110 -108 'A' '31' 'VAL' 'O' 'O' -0.500000 15.9990 -109 'A' '32' 'ASN' 'N' 'NH1' -0.570000 14.0070 -110 'A' '32' 'ASN' 'HN' 'H' 0.370000 1.00800 -111 'A' '32' 'ASN' 'CA' 'CH1E' 0.200000 12.0110 -112 'A' '32' 'ASN' 'CB' 'CH2E' -0.00000 12.0110 -113 'A' '32' 'ASN' 'CG' 'C' 0.500000 12.0110 -114 'A' '32' 'ASN' 'OD1' 'O' -0.500000 15.9990 -115 'A' '32' 'ASN' 'ND2' 'NH2' -0.850000 14.0070 -116 'A' '32' 'ASN' 'HD21' 'H' 0.425000 1.00800 -117 'A' '32' 'ASN' 'HD22' 'H' 0.425000 1.00800 -118 'A' '32' 'ASN' 'C' 'C' 0.500000 12.0110 -119 'A' '32' 'ASN' 'O' 'O' 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null, - "created": "2024-10-01 16:32:31", - "file_name": "prot-prot_haddock.pdb", - "file_type": { - "py/reduce": [ - { - "py/type": "haddock.libs.libontology.Format" - }, - { - "py/tuple": [ - "pdb" - ] - } - ] - }, - "full_name": "prot-prot_haddock.pdb", - "len": NaN, - "md5": null, - "ori_name": "prot-prot", - "path": "/Users/vreys/Desktop/HADDOCK3/haddock3-dev/examples/thirdparty/prodigy/run-prodigy-prot-prot/0_topoaa", - "py/object": "haddock.libs.libontology.PDBFile", - "rel_path": { - "py/reduce": [ - { - "py/type": "pathlib.PosixPath" - }, - { - "py/tuple": [ - "..", - "0_topoaa", - "prot-prot_haddock.pdb" - ] - } - ] - }, - "restr_fname": null, - "score": { - "py/reduce": [ - { - "py/function": "numpy.core.multiarray.scalar" - }, - { - "py/tuple": [ - { - "py/reduce": [ - { - "py/type": "numpy.dtype" - }, - { - "py/tuple": [ - "f8", - false, - true - ] - }, - { - "py/tuple": [ - 3, - "<", - null, - null, - null, - -1, - -1, - 0 - ] - } - ] - }, - { - "py/b64": "cT0K16NwGsA=" - 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- "py/id": 12 - } - ] -} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/params.cfg b/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/params.cfg deleted file mode 100644 index 71a71b803..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/params.cfg +++ /dev/null @@ -1,20 +0,0 @@ -[prodigy] -cns_exec = "" -ncores = 4 -max_cpus = true -mode = "local" -batch_type = "slurm" -queue = "" -queue_limit = 100 -concat = 1 -self_contained = false -clean = false -offline = false -scoring_mode = "protein" -chains = [ "A", "B",] -ligand_resname = "UNK" -ligand_chain = "B" -distance_cutoff = nan -accessibility_cutoff = 0.05 -temperature = 25.0 -to_pkd = true diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/prodigy.tsv b/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/prodigy.tsv deleted file mode 100644 index febe06959..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/1_prodigy/prodigy.tsv +++ /dev/null @@ -1,3 +0,0 @@ -structure original_name md5 score -prot-prot_haddock.pdb prot-prot None -6.61 -homotrimer_haddock.pdb homotrimer None None diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/homotrimer.pdb b/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/homotrimer.pdb deleted file mode 100644 index e1a9c00fd..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/homotrimer.pdb +++ /dev/null @@ -1,2842 +0,0 @@ -ATOM 1 N SER A 2 59.687 62.109 75.379 1.00 16.24 A -ATOM 2 CA SER A 2 58.545 61.990 74.424 1.00 15.30 A -ATOM 3 C SER A 2 57.256 61.682 75.199 1.00 13.90 A -ATOM 4 O SER A 2 57.298 61.094 76.306 1.00 15.02 A -ATOM 5 CB SER A 2 58.796 60.983 73.331 1.00 16.11 A -ATOM 6 OG SER A 2 58.666 59.642 73.778 1.00 18.37 A -ATOM 7 N LYS A 3 56.142 62.095 74.598 1.00 12.13 A -ATOM 8 CA LYS A 3 54.855 61.881 75.274 1.00 11.35 A -ATOM 9 C LYS A 3 53.732 61.619 74.285 1.00 8.65 A -ATOM 10 O LYS A 3 53.724 61.974 73.102 1.00 7.83 A -ATOM 11 CB LYS A 3 54.508 63.089 76.165 1.00 13.69 A -ATOM 12 CG LYS A 3 54.208 64.314 75.337 1.00 15.79 A -ATOM 13 CD LYS A 3 54.056 65.631 76.074 1.00 17.79 A -ATOM 14 CE LYS A 3 55.391 66.208 76.498 1.00 18.86 A -ATOM 15 NZ LYS A 3 55.266 67.628 76.966 1.00 20.35 A -ATOM 16 N THR A 4 52.734 60.953 74.837 1.00 7.14 A -ATOM 17 CA THR A 4 51.526 60.662 74.068 1.00 6.44 A -ATOM 18 C THR A 4 50.711 61.943 73.856 1.00 5.57 A -ATOM 19 O THR A 4 50.616 62.800 74.785 1.00 6.47 A -ATOM 20 CB THR A 4 50.619 59.713 74.950 1.00 7.10 A -ATOM 21 OG1 THR A 4 51.320 58.447 75.034 1.00 8.40 A -ATOM 22 CG2 THR A 4 49.209 59.526 74.383 1.00 7.78 A -ATOM 23 N ILE A 5 50.115 62.056 72.684 1.00 4.90 A -ATOM 24 CA ILE A 5 49.139 63.114 72.395 1.00 5.03 A -ATOM 25 C ILE A 5 47.762 62.401 72.500 1.00 5.26 A -ATOM 26 O ILE A 5 47.535 61.375 71.875 1.00 5.95 A -ATOM 27 CB ILE A 5 49.304 63.748 70.997 1.00 5.22 A -ATOM 28 CG1 ILE A 5 50.722 64.326 70.810 1.00 5.41 A -ATOM 29 CG2 ILE A 5 48.204 64.802 70.734 1.00 6.47 A -ATOM 30 CD1 ILE A 5 51.050 64.678 69.334 1.00 4.98 A -ATOM 31 N ALA A 6 46.901 62.990 73.340 1.00 5.80 A -ATOM 32 CA ALA A 6 45.548 62.428 73.548 1.00 7.32 A -ATOM 33 C ALA A 6 44.573 63.599 73.578 1.00 7.57 A -ATOM 34 O ALA A 6 44.680 64.516 74.414 1.00 10.07 A -ATOM 35 CB ALA A 6 45.481 61.583 74.808 1.00 8.24 A -ATOM 36 N THR A 7 43.666 63.612 72.613 1.00 6.19 A -ATOM 37 CA THR A 7 42.676 64.681 72.481 1.00 6.55 A -ATOM 38 C THR A 7 41.286 64.145 72.188 1.00 5.76 A -ATOM 39 O THR A 7 41.146 63.171 71.468 1.00 6.20 A -ATOM 40 CB THR A 7 43.117 65.663 71.330 1.00 7.01 A -ATOM 41 OG1 THR A 7 42.032 66.622 71.214 1.00 7.16 A -ATOM 42 CG2 THR A 7 43.363 65.012 69.980 1.00 7.30 A -ATOM 43 N GLU A 8 40.282 64.754 72.807 1.00 6.37 A -ATOM 44 CA GLU A 8 38.895 64.376 72.568 1.00 6.48 A -ATOM 45 C GLU A 8 38.497 64.803 71.162 1.00 6.14 A -ATOM 46 O GLU A 8 37.460 64.341 70.650 1.00 6.07 A -ATOM 47 CB GLU A 8 37.922 65.033 73.559 1.00 7.91 A -ATOM 48 CG GLU A 8 37.722 66.540 73.490 1.00 9.70 A -ATOM 49 CD GLU A 8 38.814 67.395 74.051 1.00 11.36 A -ATOM 50 OE1 GLU A 8 39.958 66.979 74.261 1.00 12.18 A -ATOM 51 OE2 GLU A 8 38.489 68.603 74.276 1.00 13.35 A -ATOM 52 N ASN A 9 39.286 65.675 70.529 1.00 6.75 A -ATOM 53 CA ASN A 9 38.967 66.220 69.204 1.00 7.05 A -ATOM 54 C ASN A 9 39.238 65.308 68.025 1.00 7.06 A -ATOM 55 O ASN A 9 38.959 65.680 66.872 1.00 6.95 A -ATOM 56 CB ASN A 9 39.590 67.590 69.019 1.00 7.91 A -ATOM 57 CG ASN A 9 39.030 68.573 70.034 1.00 9.05 A -ATOM 58 OD1 ASN A 9 37.816 68.514 70.332 1.00 10.43 A -ATOM 59 ND2 ASN A 9 39.902 69.410 70.545 1.00 9.59 A -ATOM 60 N ALA A 10 39.839 64.140 68.250 1.00 5.82 A -ATOM 61 CA ALA A 10 40.069 63.131 67.198 1.00 5.77 A -ATOM 62 C ALA A 10 39.464 61.835 67.795 1.00 6.13 A -ATOM 63 O ALA A 10 39.310 61.744 69.012 1.00 5.80 A -ATOM 64 CB ALA A 10 41.527 62.935 66.850 1.00 6.12 A -ATOM 65 N PRO A 11 39.127 60.887 66.939 1.00 6.62 A -ATOM 66 CA PRO A 11 38.556 59.626 67.427 1.00 6.86 A -ATOM 67 C PRO A 11 39.432 58.991 68.470 1.00 6.78 A -ATOM 68 O PRO A 11 40.681 58.925 68.299 1.00 6.19 A -ATOM 69 CB PRO A 11 38.483 58.750 66.191 1.00 7.77 A -ATOM 70 CG PRO A 11 38.512 59.680 65.012 1.00 8.11 A -ATOM 71 CD PRO A 11 39.270 60.918 65.475 1.00 7.42 A -ATOM 72 N ALA A 12 38.830 58.469 69.527 1.00 8.21 A -ATOM 73 CA ALA A 12 39.572 57.836 70.624 1.00 9.55 A -ATOM 74 C ALA A 12 40.348 56.629 70.099 1.00 10.63 A -ATOM 75 O ALA A 12 39.905 55.909 69.197 1.00 9.79 A -ATOM 76 CB ALA A 12 38.589 57.344 71.687 1.00 10.50 A -ATOM 77 N ALA A 13 41.520 56.468 70.685 1.00 11.95 A -ATOM 78 CA ALA A 13 42.435 55.363 70.356 1.00 14.35 A -ATOM 79 C ALA A 13 42.006 54.159 71.201 1.00 15.86 A -ATOM 80 O ALA A 13 42.446 54.077 72.361 1.00 17.22 A -ATOM 81 CB ALA A 13 43.882 55.728 70.640 1.00 14.52 A -ATOM 82 N ILE A 14 41.192 53.335 70.571 1.00 16.89 A -ATOM 83 CA ILE A 14 40.701 52.121 71.268 1.00 18.21 A -ATOM 84 C ILE A 14 41.712 50.983 71.151 1.00 18.11 A -ATOM 85 O ILE A 14 42.096 50.420 72.218 1.00 19.37 A -ATOM 86 CB ILE A 14 39.249 51.808 70.805 1.00 19.06 A -ATOM 87 CG1 ILE A 14 38.352 53.063 71.045 1.00 19.75 A -ATOM 88 CG2 ILE A 14 38.616 50.571 71.498 1.00 19.75 A -ATOM 89 CD1 ILE A 14 36.972 52.904 70.339 1.00 20.29 A -ATOM 90 N GLY A 15 42.164 50.671 69.955 1.00 17.28 A -ATOM 91 CA GLY A 15 43.173 49.589 69.783 1.00 15.10 A -ATOM 92 C GLY A 15 44.499 49.929 70.474 1.00 13.16 A -ATOM 93 O GLY A 15 44.655 50.901 71.233 1.00 14.07 A -ATOM 94 N PRO A 16 45.491 49.082 70.180 1.00 11.29 A -ATOM 95 CA PRO A 16 46.834 49.214 70.743 1.00 9.14 A -ATOM 96 C PRO A 16 47.663 50.263 70.025 1.00 8.00 A -ATOM 97 O PRO A 16 48.680 49.940 69.393 1.00 6.68 A -ATOM 98 CB PRO A 16 47.384 47.790 70.627 1.00 9.25 A -ATOM 99 CG PRO A 16 46.821 47.323 69.299 1.00 9.12 A -ATOM 100 CD PRO A 16 45.393 47.874 69.312 1.00 10.61 A -ATOM 101 N TYR A 17 47.238 51.512 70.158 1.00 6.92 A -ATOM 102 CA TYR A 17 47.969 52.643 69.552 1.00 6.14 A -ATOM 103 C TYR A 17 47.559 53.900 70.301 1.00 5.54 A -ATOM 104 O TYR A 17 46.568 53.863 71.069 1.00 7.15 A -ATOM 105 CB TYR A 17 47.653 52.770 68.038 1.00 6.78 A -ATOM 106 CG TYR A 17 46.184 53.035 67.760 1.00 7.73 A -ATOM 107 CD1 TYR A 17 45.725 54.354 67.570 1.00 8.18 A -ATOM 108 CD2 TYR A 17 45.220 52.031 67.736 1.00 8.87 A -ATOM 109 CE1 TYR A 17 44.386 54.645 67.316 1.00 9.51 A -ATOM 110 CE2 TYR A 17 43.868 52.309 67.498 1.00 10.50 A -ATOM 111 CZ TYR A 17 43.463 53.612 67.302 1.00 10.45 A -ATOM 112 OH TYR A 17 42.136 53.906 67.069 1.00 12.81 A -ATOM 113 N VAL A 18 48.285 54.974 70.101 1.00 5.53 A -ATOM 114 CA VAL A 18 47.936 56.302 70.616 1.00 5.01 A -ATOM 115 C VAL A 18 47.657 57.143 69.366 1.00 5.01 A -ATOM 116 O VAL A 18 48.112 56.823 68.264 1.00 5.04 A -ATOM 117 CB VAL A 18 48.995 56.929 71.510 1.00 5.59 A -ATOM 118 CG1 VAL A 18 49.086 56.116 72.797 1.00 6.33 A -ATOM 119 CG2 VAL A 18 50.342 57.091 70.825 1.00 6.00 A -ATOM 120 N GLN A 19 46.945 58.244 69.553 1.00 4.48 A -ATOM 121 CA GLN A 19 46.600 59.142 68.446 1.00 4.00 A -ATOM 122 C GLN A 19 47.834 59.775 67.805 1.00 3.80 A -ATOM 123 O GLN A 19 47.857 60.035 66.598 1.00 3.75 A -ATOM 124 CB GLN A 19 45.663 60.267 68.895 1.00 5.03 A -ATOM 125 CG GLN A 19 44.310 59.743 69.363 1.00 5.44 A -ATOM 126 CD GLN A 19 43.542 60.837 70.048 1.00 5.87 A -ATOM 127 OE1 GLN A 19 44.130 61.623 70.789 1.00 7.44 A -ATOM 128 NE2 GLN A 19 42.220 60.896 69.850 1.00 6.86 A -ATOM 129 N GLY A 20 48.826 60.101 68.629 1.00 4.08 A -ATOM 130 CA GLY A 20 50.054 60.731 68.083 1.00 3.84 A -ATOM 131 C GLY A 20 51.077 60.795 69.194 1.00 3.63 A -ATOM 132 O GLY A 20 50.763 60.515 70.366 1.00 3.92 A -ATOM 133 N VAL A 21 52.293 61.175 68.820 1.00 3.33 A -ATOM 134 CA VAL A 21 53.390 61.313 69.766 1.00 3.95 A -ATOM 135 C VAL A 21 54.047 62.676 69.576 1.00 3.79 A -ATOM 136 O VAL A 21 54.224 63.146 68.449 1.00 4.94 A -ATOM 137 CB VAL A 21 54.401 60.160 69.624 1.00 3.78 A -ATOM 138 CG1 VAL A 21 53.754 58.864 70.091 1.00 4.83 A -ATOM 139 CG2 VAL A 21 54.888 60.047 68.190 1.00 4.51 A -ATOM 140 N ASP A 22 54.402 63.260 70.702 1.00 4.14 A -ATOM 141 CA ASP A 22 55.097 64.566 70.749 1.00 4.70 A -ATOM 142 C ASP A 22 56.528 64.213 71.148 1.00 4.45 A -ATOM 143 O ASP A 22 56.763 63.839 72.315 1.00 5.58 A -ATOM 144 CB ASP A 22 54.398 65.504 71.720 1.00 6.22 A -ATOM 145 CG ASP A 22 55.106 66.810 71.968 1.00 7.08 A -ATOM 146 OD1 ASP A 22 54.461 67.693 72.601 1.00 8.97 A -ATOM 147 OD2 ASP A 22 56.249 66.976 71.563 1.00 7.76 A -ATOM 148 N LEU A 23 57.471 64.305 70.241 1.00 4.71 A -ATOM 149 CA LEU A 23 58.871 63.966 70.471 1.00 5.58 A -ATOM 150 C LEU A 23 59.745 65.149 70.823 1.00 6.38 A -ATOM 151 O LEU A 23 60.979 64.983 70.882 1.00 8.55 A -ATOM 152 CB LEU A 23 59.403 63.270 69.193 1.00 5.54 A -ATOM 153 CG LEU A 23 58.507 62.154 68.674 1.00 6.24 A -ATOM 154 CD1 LEU A 23 59.178 61.512 67.451 1.00 6.77 A -ATOM 155 CD2 LEU A 23 58.259 61.054 69.707 1.00 6.93 A -ATOM 156 N GLY A 24 59.166 66.286 71.039 1.00 6.72 A -ATOM 157 CA GLY A 24 59.920 67.523 71.338 1.00 7.67 A -ATOM 158 C GLY A 24 59.707 68.400 70.084 1.00 7.60 A -ATOM 159 O GLY A 24 58.600 68.942 69.915 1.00 8.31 A -ATOM 160 N ASN A 25 60.704 68.474 69.248 1.00 7.01 A -ATOM 161 CA ASN A 25 60.524 69.301 68.036 1.00 7.87 A -ATOM 162 C ASN A 25 59.570 68.622 67.049 1.00 7.17 A -ATOM 163 O ASN A 25 58.790 69.317 66.371 1.00 7.79 A -ATOM 164 CB ASN A 25 61.872 69.507 67.343 1.00 9.22 A -ATOM 165 CG ASN A 25 61.713 70.393 66.113 1.00 10.32 A -ATOM 166 OD1 ASN A 25 61.175 71.506 66.200 1.00 12.32 A -ATOM 167 ND2 ASN A 25 62.167 69.869 64.967 1.00 11.31 A -ATOM 168 N MET A 26 59.596 67.320 66.912 1.00 6.21 A -ATOM 169 CA MET A 26 58.766 66.599 65.949 1.00 5.60 A -ATOM 170 C MET A 26 57.556 65.937 66.583 1.00 5.14 A -ATOM 171 O MET A 26 57.663 65.301 67.653 1.00 5.60 A -ATOM 172 CB MET A 26 59.657 65.517 65.295 1.00 6.37 A -ATOM 173 CG MET A 26 58.892 64.822 64.201 1.00 7.10 A -ATOM 174 SD MET A 26 59.952 63.718 63.237 1.00 8.83 A -ATOM 175 CE MET A 26 60.817 64.935 62.195 1.00 9.98 A -ATOM 176 N ILE A 27 56.435 66.080 65.904 1.00 4.19 A -ATOM 177 CA ILE A 27 55.172 65.439 66.272 1.00 4.28 A -ATOM 178 C ILE A 27 54.845 64.446 65.142 1.00 3.82 A -ATOM 179 O ILE A 27 54.992 64.828 63.960 1.00 3.92 A -ATOM 180 CB ILE A 27 54.038 66.521 66.370 1.00 6.29 A -ATOM 181 CG1 ILE A 27 54.078 67.247 67.744 1.00 7.15 A -ATOM 182 CG2 ILE A 27 52.630 65.945 66.085 1.00 7.40 A -ATOM 183 CD1 ILE A 27 55.432 67.892 68.089 1.00 7.34 A -ATOM 184 N ILE A 28 54.416 63.256 65.496 1.00 3.50 A -ATOM 185 CA ILE A 28 54.000 62.289 64.494 1.00 3.86 A -ATOM 186 C ILE A 28 52.595 61.811 64.841 1.00 3.50 A -ATOM 187 O ILE A 28 52.349 61.387 66.009 1.00 4.39 A -ATOM 188 CB ILE A 28 54.955 61.051 64.397 1.00 4.84 A -ATOM 189 CG1 ILE A 28 56.417 61.518 64.271 1.00 5.31 A -ATOM 190 CG2 ILE A 28 54.508 60.136 63.234 1.00 5.87 A -ATOM 191 CD1 ILE A 28 57.405 60.336 64.133 1.00 5.89 A -ATOM 192 N THR A 29 51.698 61.836 63.885 1.00 3.96 A -ATOM 193 CA THR A 29 50.363 61.295 64.117 1.00 4.14 A -ATOM 194 C THR A 29 50.241 59.858 63.625 1.00 3.59 A -ATOM 195 O THR A 29 50.957 59.398 62.751 1.00 4.36 A -ATOM 196 CB THR A 29 49.229 62.148 63.402 1.00 4.08 A -ATOM 197 OG1 THR A 29 49.151 61.797 62.003 1.00 3.82 A -ATOM 198 CG2 THR A 29 49.413 63.662 63.547 1.00 4.97 A -ATOM 199 N SER A 30 49.245 59.184 64.195 1.00 3.82 A -ATOM 200 CA SER A 30 48.819 57.896 63.673 1.00 3.64 A -ATOM 201 C SER A 30 48.083 58.225 62.342 1.00 3.76 A -ATOM 202 O SER A 30 47.678 59.377 62.094 1.00 4.49 A -ATOM 203 CB SER A 30 47.782 57.269 64.615 1.00 3.92 A -ATOM 204 OG SER A 30 48.466 56.635 65.679 1.00 4.47 A -ATOM 205 N GLY A 31 47.915 57.202 61.521 1.00 3.83 A -ATOM 206 CA GLY A 31 47.176 57.299 60.254 1.00 4.29 A -ATOM 207 C GLY A 31 45.727 57.583 60.617 1.00 4.32 A -ATOM 208 O GLY A 31 45.108 56.714 61.268 1.00 6.10 A -ATOM 209 N GLN A 32 45.164 58.708 60.248 1.00 3.41 A -ATOM 210 CA GLN A 32 43.789 59.085 60.581 1.00 3.93 A -ATOM 211 C GLN A 32 42.841 58.647 59.469 1.00 3.99 A -ATOM 212 O GLN A 32 43.019 58.943 58.292 1.00 4.71 A -ATOM 213 CB GLN A 32 43.678 60.603 60.781 1.00 4.22 A -ATOM 214 CG GLN A 32 44.494 61.116 61.955 1.00 3.95 A -ATOM 215 CD GLN A 32 44.181 60.387 63.233 1.00 4.74 A -ATOM 216 OE1 GLN A 32 43.025 60.399 63.674 1.00 5.56 A -ATOM 217 NE2 GLN A 32 45.179 59.688 63.775 1.00 4.99 A -ATOM 218 N ILE A 33 41.772 58.014 59.924 1.00 5.20 A -ATOM 219 CA ILE A 33 40.684 57.594 59.037 1.00 5.52 A -ATOM 220 C ILE A 33 39.527 58.558 59.277 1.00 5.61 A -ATOM 221 O ILE A 33 39.471 59.271 60.308 1.00 5.33 A -ATOM 222 CB ILE A 33 40.335 56.109 59.247 1.00 6.50 A -ATOM 223 CG1 ILE A 33 39.958 55.811 60.720 1.00 7.36 A -ATOM 224 CG2 ILE A 33 41.489 55.181 58.775 1.00 7.63 A -ATOM 225 CD1 ILE A 33 39.290 54.422 60.854 1.00 8.30 A -ATOM 226 N PRO A 34 38.606 58.600 58.333 1.00 5.57 A -ATOM 227 CA PRO A 34 37.522 59.576 58.367 1.00 5.47 A -ATOM 228 C PRO A 34 36.371 59.282 59.321 1.00 5.79 A -ATOM 229 O PRO A 34 35.192 59.360 58.907 1.00 7.27 A -ATOM 230 CB PRO A 34 37.030 59.664 56.914 1.00 5.88 A -ATOM 231 CG PRO A 34 37.325 58.276 56.396 1.00 6.23 A -ATOM 232 CD PRO A 34 38.678 57.937 57.019 1.00 5.26 A -ATOM 233 N VAL A 35 36.721 58.985 60.555 1.00 5.68 A -ATOM 234 CA VAL A 35 35.706 58.775 61.601 1.00 6.40 A -ATOM 235 C VAL A 35 35.492 60.117 62.295 1.00 5.88 A -ATOM 236 O VAL A 35 36.425 60.824 62.677 1.00 5.93 A -ATOM 237 CB VAL A 35 36.200 57.731 62.615 1.00 7.54 A -ATOM 238 CG1 VAL A 35 35.300 57.671 63.850 1.00 7.74 A -ATOM 239 CG2 VAL A 35 36.356 56.376 61.976 1.00 7.73 A -ATOM 240 N ASN A 36 34.209 60.449 62.453 1.00 6.56 A -ATOM 241 CA ASN A 36 33.832 61.711 63.134 1.00 7.61 A -ATOM 242 C ASN A 36 34.009 61.509 64.632 1.00 7.47 A -ATOM 243 O ASN A 36 33.398 60.575 65.195 1.00 8.51 A -ATOM 244 CB ASN A 36 32.397 62.016 62.735 1.00 9.42 A -ATOM 245 CG ASN A 36 31.815 63.262 63.346 1.00 11.61 A -ATOM 246 OD1 ASN A 36 31.911 63.471 64.567 1.00 12.84 A -ATOM 247 ND2 ASN A 36 31.143 64.047 62.500 1.00 12.39 A -ATOM 248 N PRO A 37 34.757 62.330 65.329 1.00 7.10 A -ATOM 249 CA PRO A 37 34.975 62.151 66.766 1.00 8.07 A -ATOM 250 C PRO A 37 33.759 62.412 67.622 1.00 8.69 A -ATOM 251 O PRO A 37 33.731 62.001 68.790 1.00 9.39 A -ATOM 252 CB PRO A 37 36.114 63.114 67.097 1.00 8.93 A -ATOM 253 CG PRO A 37 35.942 64.190 66.064 1.00 9.33 A -ATOM 254 CD PRO A 37 35.519 63.459 64.793 1.00 8.45 A -ATOM 255 N LYS A 38 32.797 63.140 67.088 1.00 9.24 A -ATOM 256 CA LYS A 38 31.560 63.446 67.841 1.00 11.17 A -ATOM 257 C LYS A 38 30.604 62.270 67.772 1.00 11.35 A -ATOM 258 O LYS A 38 30.007 61.908 68.821 1.00 12.18 A -ATOM 259 CB LYS A 38 30.905 64.682 67.259 1.00 12.66 A -ATOM 260 CG LYS A 38 29.693 65.260 67.972 1.00 13.74 A -ATOM 261 CD LYS A 38 29.220 66.600 67.360 1.00 14.42 A -ATOM 262 CE LYS A 38 30.156 67.638 67.528 1.00 17.20 A -ATOM 263 NZ LYS A 38 30.401 67.909 68.973 1.00 18.80 A -ATOM 264 N THR A 39 30.410 61.667 66.605 1.00 11.29 A -ATOM 265 CA THR A 39 29.447 60.585 66.426 1.00 11.38 A -ATOM 266 C THR A 39 29.945 59.192 66.161 1.00 11.67 A -ATOM 267 O THR A 39 29.146 58.231 66.283 1.00 12.12 A -ATOM 268 CB THR A 39 28.498 60.967 65.202 1.00 11.46 A -ATOM 269 OG1 THR A 39 29.377 60.899 64.024 1.00 11.47 A -ATOM 270 CG2 THR A 39 27.870 62.342 65.321 1.00 12.27 A -ATOM 271 N GLY A 40 31.191 59.069 65.724 1.00 11.14 A -ATOM 272 CA GLY A 40 31.757 57.763 65.397 1.00 11.25 A -ATOM 273 C GLY A 40 31.414 57.343 63.969 1.00 11.36 A -ATOM 274 O GLY A 40 31.858 56.264 63.543 1.00 12.70 A -ATOM 275 N GLU A 41 30.667 58.149 63.248 1.00 11.11 A -ATOM 276 CA GLU A 41 30.278 57.815 61.871 1.00 11.71 A -ATOM 277 C GLU A 41 31.296 58.245 60.833 1.00 10.19 A -ATOM 278 O GLU A 41 32.099 59.139 61.111 1.00 10.11 A -ATOM 279 CB GLU A 41 28.947 58.517 61.534 1.00 13.86 A -ATOM 280 CG GLU A 41 27.808 57.967 62.414 1.00 16.75 A -ATOM 281 CD GLU A 41 26.469 58.606 62.196 1.00 18.82 A -ATOM 282 OE1 GLU A 41 26.338 59.711 61.693 1.00 19.76 A -ATOM 283 OE2 GLU A 41 25.559 57.848 62.618 1.00 20.70 A -ATOM 284 N VAL A 42 31.202 57.633 59.670 1.00 9.39 A -ATOM 285 CA VAL A 42 32.092 57.933 58.529 1.00 8.66 A -ATOM 286 C VAL A 42 31.207 58.479 57.415 1.00 8.84 A -ATOM 287 O VAL A 42 30.227 57.758 57.073 1.00 8.91 A -ATOM 288 CB VAL A 42 32.799 56.643 58.081 1.00 8.81 A -ATOM 289 CG1 VAL A 42 33.559 56.885 56.777 1.00 8.55 A -ATOM 290 CG2 VAL A 42 33.725 56.120 59.169 1.00 9.11 A -ATOM 291 N PRO A 43 31.514 59.617 56.877 1.00 8.44 A -ATOM 292 CA PRO A 43 30.715 60.210 55.791 1.00 9.28 A -ATOM 293 C PRO A 43 30.918 59.367 54.546 1.00 9.79 A -ATOM 294 O PRO A 43 32.000 58.768 54.342 1.00 9.85 A -ATOM 295 CB PRO A 43 31.207 61.650 55.701 1.00 9.38 A -ATOM 296 CG PRO A 43 32.652 61.567 56.141 1.00 9.11 A -ATOM 297 CD PRO A 43 32.661 60.480 57.216 1.00 8.87 A -ATOM 298 N ALA A 44 29.882 59.303 53.711 1.00 11.00 A -ATOM 299 CA ALA A 44 29.932 58.508 52.480 1.00 11.90 A -ATOM 300 C ALA A 44 30.874 59.042 51.404 1.00 12.03 A -ATOM 301 O ALA A 44 31.691 58.329 50.802 1.00 13.47 A -ATOM 302 CB ALA A 44 28.484 58.433 51.963 1.00 12.50 A -ATOM 303 N ASP A 45 30.762 60.303 51.148 1.00 11.52 A -ATOM 304 CA ASP A 45 31.428 61.135 50.149 1.00 11.81 A -ATOM 305 C ASP A 45 32.946 61.109 50.292 1.00 10.80 A -ATOM 306 O ASP A 45 33.415 61.365 51.424 1.00 9.73 A -ATOM 307 CB ASP A 45 30.749 62.522 50.311 1.00 12.76 A -ATOM 308 CG ASP A 45 31.268 63.505 49.304 1.00 14.25 A -ATOM 309 OD1 ASP A 45 32.157 64.292 49.667 1.00 13.77 A -ATOM 310 OD2 ASP A 45 30.805 63.527 48.132 1.00 15.41 A -ATOM 311 N VAL A 46 33.695 60.863 49.235 1.00 10.67 A -ATOM 312 CA VAL A 46 35.167 60.837 49.368 1.00 9.52 A -ATOM 313 C VAL A 46 35.756 62.188 49.754 1.00 7.84 A -ATOM 314 O VAL A 46 36.743 62.245 50.509 1.00 7.66 A -ATOM 315 CB VAL A 46 35.839 60.208 48.136 1.00 10.26 A -ATOM 316 CG1 VAL A 46 35.681 61.046 46.877 1.00 10.79 A -ATOM 317 CG2 VAL A 46 37.284 59.868 48.431 1.00 10.65 A -ATOM 318 N ALA A 47 35.185 63.265 49.237 1.00 7.55 A -ATOM 319 CA ALA A 47 35.697 64.600 49.612 1.00 7.95 A -ATOM 320 C ALA A 47 35.497 64.795 51.114 1.00 7.45 A -ATOM 321 O ALA A 47 36.408 65.283 51.831 1.00 7.40 A -ATOM 322 CB ALA A 47 35.003 65.692 48.813 1.00 8.33 A -ATOM 323 N ALA A 48 34.327 64.432 51.602 1.00 6.86 A -ATOM 324 CA ALA A 48 34.040 64.567 53.034 1.00 6.14 A -ATOM 325 C ALA A 48 34.976 63.666 53.826 1.00 5.74 A -ATOM 326 O ALA A 48 35.401 64.063 54.919 1.00 5.87 A -ATOM 327 CB ALA A 48 32.576 64.257 53.277 1.00 6.39 A -ATOM 328 N GLN A 49 35.270 62.494 53.331 1.00 5.59 A -ATOM 329 CA GLN A 49 36.209 61.597 54.043 1.00 5.03 A -ATOM 330 C GLN A 49 37.590 62.247 54.116 1.00 4.68 A -ATOM 331 O GLN A 49 38.233 62.234 55.172 1.00 5.23 A -ATOM 332 CB GLN A 49 36.255 60.225 53.385 1.00 5.71 A -ATOM 333 CG GLN A 49 34.994 59.395 53.671 1.00 6.17 A -ATOM 334 CD GLN A 49 35.202 57.921 53.381 1.00 5.93 A -ATOM 335 OE1 GLN A 49 36.340 57.420 53.335 1.00 5.99 A -ATOM 336 NE2 GLN A 49 34.110 57.175 53.220 1.00 6.38 A -ATOM 337 N ALA A 50 38.029 62.786 52.982 1.00 4.71 A -ATOM 338 CA ALA A 50 39.364 63.431 53.010 1.00 4.54 A -ATOM 339 C ALA A 50 39.396 64.554 54.046 1.00 4.94 A -ATOM 340 O ALA A 50 40.349 64.694 54.833 1.00 4.87 A -ATOM 341 CB ALA A 50 39.764 63.973 51.649 1.00 5.66 A -ATOM 342 N ARG A 51 38.327 65.338 54.078 1.00 5.38 A -ATOM 343 CA ARG A 51 38.260 66.439 55.051 1.00 5.49 A -ATOM 344 C ARG A 51 38.200 65.950 56.478 1.00 5.04 A -ATOM 345 O ARG A 51 38.845 66.565 57.349 1.00 6.12 A -ATOM 346 CB ARG A 51 37.136 67.419 54.730 1.00 6.73 A -ATOM 347 CG ARG A 51 37.074 68.640 55.631 1.00 7.56 A -ATOM 348 CD ARG A 51 36.205 69.722 55.064 1.00 8.32 A -ATOM 349 NE ARG A 51 36.735 70.418 53.902 1.00 8.95 A -ATOM 350 CZ ARG A 51 37.601 71.442 53.925 1.00 9.18 A -ATOM 351 NH1 ARG A 51 38.084 71.924 55.070 1.00 8.39 A -ATOM 352 NH2 ARG A 51 37.999 71.993 52.772 1.00 10.81 A -ATOM 353 N GLN A 52 37.460 64.896 56.762 1.00 4.75 A -ATOM 354 CA GLN A 52 37.375 64.365 58.134 1.00 4.61 A -ATOM 355 C GLN A 52 38.755 63.848 58.546 1.00 4.34 A -ATOM 356 O GLN A 52 39.161 64.060 59.715 1.00 4.87 A -ATOM 357 CB GLN A 52 36.296 63.303 58.235 1.00 5.74 A -ATOM 358 CG GLN A 52 36.148 62.806 59.657 1.00 5.80 A -ATOM 359 CD GLN A 52 35.679 63.854 60.622 1.00 6.30 A -ATOM 360 OE1 GLN A 52 34.471 64.133 60.690 1.00 7.97 A -ATOM 361 NE2 GLN A 52 36.576 64.428 61.386 1.00 7.04 A -ATOM 362 N SER A 53 39.438 63.125 57.667 1.00 4.36 A -ATOM 363 CA SER A 53 40.796 62.658 58.016 1.00 4.64 A -ATOM 364 C SER A 53 41.730 63.831 58.319 1.00 4.34 A -ATOM 365 O SER A 53 42.486 63.783 59.298 1.00 4.42 A -ATOM 366 CB SER A 53 41.346 61.801 56.895 1.00 5.03 A -ATOM 367 OG SER A 53 40.874 60.480 56.920 1.00 7.71 A -ATOM 368 N LEU A 54 41.672 64.858 57.494 1.00 4.12 A -ATOM 369 CA LEU A 54 42.501 66.053 57.715 1.00 4.70 A -ATOM 370 C LEU A 54 42.130 66.747 59.020 1.00 3.93 A -ATOM 371 O LEU A 54 43.026 67.222 59.740 1.00 4.71 A -ATOM 372 CB LEU A 54 42.407 66.961 56.508 1.00 5.03 A -ATOM 373 CG LEU A 54 43.166 66.430 55.288 1.00 5.82 A -ATOM 374 CD1 LEU A 54 42.760 67.223 54.045 1.00 5.88 A -ATOM 375 CD2 LEU A 54 44.673 66.492 55.463 1.00 6.70 A -ATOM 376 N ASP A 55 40.853 66.819 59.334 1.00 4.46 A -ATOM 377 CA ASP A 55 40.440 67.461 60.595 1.00 4.76 A -ATOM 378 C ASP A 55 40.976 66.648 61.777 1.00 5.09 A -ATOM 379 O ASP A 55 41.316 67.240 62.801 1.00 4.83 A -ATOM 380 CB ASP A 55 38.926 67.603 60.620 1.00 6.75 A -ATOM 381 CG ASP A 55 38.396 68.831 59.894 1.00 8.66 A -ATOM 382 OD1 ASP A 55 37.229 68.842 59.457 1.00 10.67 A -ATOM 383 OD2 ASP A 55 39.156 69.804 59.813 1.00 10.74 A -ATOM 384 N ASN A 56 40.966 65.338 61.607 1.00 4.45 A -ATOM 385 CA ASN A 56 41.477 64.473 62.713 1.00 3.71 A -ATOM 386 C ASN A 56 42.971 64.745 62.874 1.00 3.25 A -ATOM 387 O ASN A 56 43.473 64.821 64.018 1.00 4.24 A -ATOM 388 CB ASN A 56 41.182 62.994 62.455 1.00 4.47 A -ATOM 389 CG ASN A 56 39.696 62.707 62.655 1.00 4.53 A -ATOM 390 OD1 ASN A 56 38.956 63.521 63.249 1.00 5.62 A -ATOM 391 ND2 ASN A 56 39.213 61.580 62.124 1.00 4.94 A -ATOM 392 N VAL A 57 43.710 64.803 61.766 1.00 4.41 A -ATOM 393 CA VAL A 57 45.156 65.125 61.842 1.00 4.09 A -ATOM 394 C VAL A 57 45.322 66.462 62.535 1.00 3.73 A -ATOM 395 O VAL A 57 46.150 66.644 63.454 1.00 4.05 A -ATOM 396 CB VAL A 57 45.777 65.167 60.449 1.00 4.49 A -ATOM 397 CG1 VAL A 57 47.143 65.858 60.478 1.00 5.66 A -ATOM 398 CG2 VAL A 57 45.886 63.791 59.829 1.00 5.00 A -ATOM 399 N LYS A 58 44.563 67.461 62.121 1.00 3.78 A -ATOM 400 CA LYS A 58 44.626 68.814 62.701 1.00 4.51 A -ATOM 401 C LYS A 58 44.385 68.786 64.200 1.00 4.64 A -ATOM 402 O LYS A 58 45.078 69.453 64.970 1.00 4.91 A -ATOM 403 CB LYS A 58 43.566 69.685 62.023 1.00 5.87 A -ATOM 404 CG LYS A 58 43.368 71.037 62.715 1.00 6.61 A -ATOM 405 CD LYS A 58 42.422 71.911 61.914 1.00 8.95 A -ATOM 406 CE LYS A 58 41.827 73.036 62.736 1.00 9.79 A -ATOM 407 NZ LYS A 58 40.944 73.903 61.926 1.00 10.97 A -ATOM 408 N ALA A 59 43.393 68.027 64.648 1.00 4.57 A -ATOM 409 CA ALA A 59 43.097 67.955 66.089 1.00 4.83 A -ATOM 410 C ALA A 59 44.313 67.483 66.884 1.00 4.63 A -ATOM 411 O ALA A 59 44.584 67.996 67.993 1.00 4.41 A -ATOM 412 CB ALA A 59 41.941 67.000 66.337 1.00 5.64 A -ATOM 413 N ILE A 60 45.015 66.485 66.365 1.00 4.27 A -ATOM 414 CA ILE A 60 46.183 65.916 67.056 1.00 4.66 A -ATOM 415 C ILE A 60 47.337 66.898 67.056 1.00 3.81 A -ATOM 416 O ILE A 60 48.023 67.079 68.071 1.00 4.20 A -ATOM 417 CB ILE A 60 46.509 64.546 66.403 1.00 4.36 A -ATOM 418 CG1 ILE A 60 45.317 63.588 66.623 1.00 4.56 A -ATOM 419 CG2 ILE A 60 47.835 63.966 66.941 1.00 4.23 A -ATOM 420 CD1 ILE A 60 45.375 62.373 65.655 1.00 5.34 A -ATOM 421 N VAL A 61 47.603 67.504 65.896 1.00 3.65 A -ATOM 422 CA VAL A 61 48.677 68.511 65.787 1.00 4.56 A -ATOM 423 C VAL A 61 48.400 69.698 66.702 1.00 4.22 A -ATOM 424 O VAL A 61 49.299 70.160 67.411 1.00 4.43 A -ATOM 425 CB VAL A 61 48.830 68.907 64.309 1.00 4.74 A -ATOM 426 CG1 VAL A 61 49.722 70.122 64.101 1.00 5.69 A -ATOM 427 CG2 VAL A 61 49.318 67.725 63.493 1.00 5.47 A -ATOM 428 N GLU A 62 47.153 70.151 66.723 1.00 4.43 A -ATOM 429 CA GLU A 62 46.812 71.288 67.592 1.00 4.95 A -ATOM 430 C GLU A 62 46.887 70.885 69.052 1.00 5.30 A -ATOM 431 O GLU A 62 47.256 71.723 69.907 1.00 5.38 A -ATOM 432 CB GLU A 62 45.453 71.893 67.274 1.00 5.58 A -ATOM 433 CG GLU A 62 45.458 72.586 65.906 1.00 7.08 A -ATOM 434 CD GLU A 62 44.237 73.352 65.533 1.00 8.46 A -ATOM 435 OE1 GLU A 62 44.288 74.252 64.697 1.00 10.06 A -ATOM 436 OE2 GLU A 62 43.157 73.067 66.109 1.00 10.50 A -ATOM 437 N ALA A 63 46.584 69.650 69.401 1.00 5.02 A -ATOM 438 CA ALA A 63 46.655 69.190 70.802 1.00 4.80 A -ATOM 439 C ALA A 63 48.101 69.229 71.281 1.00 4.67 A -ATOM 440 O ALA A 63 48.351 69.284 72.498 1.00 5.23 A -ATOM 441 CB ALA A 63 46.025 67.832 70.900 1.00 4.87 A -ATOM 442 N ALA A 64 49.063 69.195 70.374 1.00 4.95 A -ATOM 443 CA ALA A 64 50.469 69.277 70.725 1.00 5.12 A -ATOM 444 C ALA A 64 50.966 70.720 70.686 1.00 5.56 A -ATOM 445 O ALA A 64 52.193 70.916 70.844 1.00 6.36 A -ATOM 446 CB ALA A 64 51.305 68.378 69.816 1.00 6.01 A -ATOM 447 N GLY A 65 50.111 71.682 70.458 1.00 5.32 A -ATOM 448 CA GLY A 65 50.514 73.092 70.438 1.00 5.69 A -ATOM 449 C GLY A 65 50.980 73.563 69.073 1.00 5.00 A -ATOM 450 O GLY A 65 51.580 74.662 69.029 1.00 6.60 A -ATOM 451 N LEU A 66 50.731 72.813 68.006 1.00 4.89 A -ATOM 452 CA LEU A 66 51.180 73.201 66.660 1.00 5.10 A -ATOM 453 C LEU A 66 49.989 73.579 65.820 1.00 5.52 A -ATOM 454 O LEU A 66 48.832 73.428 66.215 1.00 6.12 A -ATOM 455 CB LEU A 66 52.009 72.059 66.064 1.00 5.47 A -ATOM 456 CG LEU A 66 53.366 71.886 66.729 1.00 7.05 A -ATOM 457 CD1 LEU A 66 54.150 70.805 65.995 1.00 7.79 A -ATOM 458 CD2 LEU A 66 54.124 73.209 66.813 1.00 8.50 A -ATOM 459 N LYS A 67 50.268 74.007 64.601 1.00 5.84 A -ATOM 460 CA LYS A 67 49.228 74.408 63.637 1.00 6.22 A -ATOM 461 C LYS A 67 49.343 73.532 62.402 1.00 5.40 A -ATOM 462 O LYS A 67 50.377 72.892 62.130 1.00 5.50 A -ATOM 463 CB LYS A 67 49.489 75.855 63.194 1.00 8.08 A -ATOM 464 CG LYS A 67 49.479 76.860 64.348 1.00 10.38 A -ATOM 465 CD LYS A 67 49.838 78.259 63.839 1.00 13.10 A -ATOM 466 CE LYS A 67 49.778 79.272 64.978 1.00 14.74 A -ATOM 467 NZ LYS A 67 49.892 80.648 64.415 1.00 16.76 A -ATOM 468 N VAL A 68 48.260 73.571 61.611 1.00 5.45 A -ATOM 469 CA VAL A 68 48.274 72.874 60.318 1.00 5.05 A -ATOM 470 C VAL A 68 49.501 73.341 59.513 1.00 5.56 A -ATOM 471 O VAL A 68 50.091 72.512 58.804 1.00 5.83 A -ATOM 472 CB VAL A 68 46.958 73.124 59.566 1.00 5.97 A -ATOM 473 CG1 VAL A 68 47.047 72.733 58.097 1.00 6.44 A -ATOM 474 CG2 VAL A 68 45.781 72.484 60.292 1.00 7.15 A -ATOM 475 N GLY A 69 49.861 74.607 59.620 1.00 5.71 A -ATOM 476 CA GLY A 69 51.014 75.148 58.890 1.00 6.22 A -ATOM 477 C GLY A 69 52.347 74.533 59.314 1.00 5.67 A -ATOM 478 O GLY A 69 53.347 74.754 58.601 1.00 6.75 A -ATOM 479 N ASP A 70 52.380 73.824 60.435 1.00 4.83 A -ATOM 480 CA ASP A 70 53.599 73.148 60.912 1.00 5.11 A -ATOM 481 C ASP A 70 53.725 71.723 60.358 1.00 4.14 A -ATOM 482 O ASP A 70 54.733 71.075 60.662 1.00 4.50 A -ATOM 483 CB ASP A 70 53.647 73.177 62.438 1.00 5.29 A -ATOM 484 CG ASP A 70 53.641 74.595 63.006 1.00 6.10 A -ATOM 485 OD1 ASP A 70 52.875 74.820 63.965 1.00 6.91 A -ATOM 486 OD2 ASP A 70 54.367 75.421 62.444 1.00 6.71 A -ATOM 487 N ILE A 71 52.727 71.273 59.653 1.00 4.31 A -ATOM 488 CA ILE A 71 52.803 69.910 59.080 1.00 4.32 A -ATOM 489 C ILE A 71 53.793 69.964 57.903 1.00 3.98 A -ATOM 490 O ILE A 71 53.583 70.796 57.004 1.00 5.01 A -ATOM 491 CB ILE A 71 51.394 69.417 58.633 1.00 4.70 A -ATOM 492 CG1 ILE A 71 50.449 69.260 59.861 1.00 4.36 A -ATOM 493 CG2 ILE A 71 51.552 68.095 57.847 1.00 4.30 A -ATOM 494 CD1 ILE A 71 48.952 69.090 59.494 1.00 4.71 A -ATOM 495 N VAL A 72 54.776 69.082 57.918 1.00 3.47 A -ATOM 496 CA VAL A 72 55.822 69.101 56.889 1.00 3.99 A -ATOM 497 C VAL A 72 55.826 67.872 56.023 1.00 3.90 A -ATOM 498 O VAL A 72 56.434 67.929 54.930 1.00 4.27 A -ATOM 499 CB VAL A 72 57.201 69.355 57.550 1.00 4.41 A -ATOM 500 CG1 VAL A 72 57.263 70.752 58.134 1.00 5.07 A -ATOM 501 CG2 VAL A 72 57.520 68.283 58.575 1.00 5.77 A -ATOM 502 N LYS A 73 55.155 66.779 56.414 1.00 3.52 A -ATOM 503 CA LYS A 73 55.125 65.579 55.571 1.00 4.16 A -ATOM 504 C LYS A 73 53.841 64.797 55.868 1.00 4.31 A -ATOM 505 O LYS A 73 53.541 64.631 57.077 1.00 4.84 A -ATOM 506 CB LYS A 73 56.294 64.647 55.893 1.00 5.02 A -ATOM 507 CG LYS A 73 56.361 63.285 55.194 1.00 5.28 A -ATOM 508 CD LYS A 73 56.411 63.319 53.682 1.00 5.37 A -ATOM 509 CE LYS A 73 56.630 61.976 53.030 1.00 6.08 A -ATOM 510 NZ LYS A 73 55.657 60.916 53.409 1.00 6.35 A -ATOM 511 N THR A 74 53.193 64.350 54.825 1.00 3.73 A -ATOM 512 CA THR A 74 52.052 63.456 55.013 1.00 3.85 A -ATOM 513 C THR A 74 52.262 62.249 54.103 1.00 3.84 A -ATOM 514 O THR A 74 53.017 62.260 53.119 1.00 3.85 A -ATOM 515 CB THR A 74 50.705 64.155 54.626 1.00 4.06 A -ATOM 516 OG1 THR A 74 50.782 64.451 53.208 1.00 4.62 A -ATOM 517 CG2 THR A 74 50.387 65.381 55.461 1.00 4.69 A -ATOM 518 N THR A 75 51.537 61.192 54.460 1.00 3.73 A -ATOM 519 CA THR A 75 51.389 60.053 53.559 1.00 4.09 A -ATOM 520 C THR A 75 49.849 59.881 53.439 1.00 4.02 A -ATOM 521 O THR A 75 49.180 59.787 54.483 1.00 4.60 A -ATOM 522 CB THR A 75 52.052 58.716 53.947 1.00 5.33 A -ATOM 523 OG1 THR A 75 53.481 59.053 53.995 1.00 6.90 A -ATOM 524 CG2 THR A 75 51.782 57.597 52.938 1.00 6.26 A -ATOM 525 N VAL A 76 49.388 59.859 52.221 1.00 3.79 A -ATOM 526 CA VAL A 76 47.970 59.705 51.923 1.00 4.37 A -ATOM 527 C VAL A 76 47.772 58.362 51.232 1.00 4.23 A -ATOM 528 O VAL A 76 48.259 58.120 50.109 1.00 5.09 A -ATOM 529 CB VAL A 76 47.518 60.873 51.017 1.00 5.09 A -ATOM 530 CG1 VAL A 76 46.034 60.718 50.674 1.00 6.10 A -ATOM 531 CG2 VAL A 76 47.745 62.256 51.642 1.00 5.44 A -ATOM 532 N PHE A 77 47.079 57.500 51.943 1.00 3.73 A -ATOM 533 CA PHE A 77 46.755 56.152 51.434 1.00 4.03 A -ATOM 534 C PHE A 77 45.307 56.221 50.948 1.00 3.31 A -ATOM 535 O PHE A 77 44.458 56.607 51.785 1.00 5.04 A -ATOM 536 CB PHE A 77 46.861 55.114 52.535 1.00 3.99 A -ATOM 537 CG PHE A 77 48.187 55.025 53.226 1.00 3.46 A -ATOM 538 CD1 PHE A 77 48.378 55.589 54.494 1.00 4.75 A -ATOM 539 CD2 PHE A 77 49.243 54.338 52.632 1.00 4.57 A -ATOM 540 CE1 PHE A 77 49.580 55.436 55.186 1.00 5.64 A -ATOM 541 CE2 PHE A 77 50.457 54.208 53.314 1.00 5.55 A -ATOM 542 CZ PHE A 77 50.626 54.721 54.585 1.00 5.75 A -ATOM 543 N VAL A 78 45.018 55.872 49.713 1.00 3.70 A -ATOM 544 CA VAL A 78 43.641 55.909 49.221 1.00 4.71 A -ATOM 545 C VAL A 78 43.220 54.528 48.751 1.00 4.55 A -ATOM 546 O VAL A 78 44.038 53.710 48.352 1.00 4.79 A -ATOM 547 CB VAL A 78 43.447 56.948 48.100 1.00 5.00 A -ATOM 548 CG1 VAL A 78 43.745 58.363 48.575 1.00 6.84 A -ATOM 549 CG2 VAL A 78 44.287 56.648 46.861 1.00 5.75 A -ATOM 550 N LYS A 79 41.906 54.334 48.753 1.00 5.21 A -ATOM 551 CA LYS A 79 41.315 53.107 48.222 1.00 5.74 A -ATOM 552 C LYS A 79 41.199 53.200 46.696 1.00 6.17 A -ATOM 553 O LYS A 79 41.240 52.134 46.034 1.00 6.76 A -ATOM 554 CB LYS A 79 39.956 52.842 48.840 1.00 6.81 A -ATOM 555 CG LYS A 79 39.231 51.634 48.264 1.00 8.82 A -ATOM 556 CD LYS A 79 39.989 50.323 48.396 1.00 10.71 A -ATOM 557 CE LYS A 79 39.447 49.209 47.516 1.00 11.66 A -ATOM 558 NZ LYS A 79 39.707 49.470 46.072 1.00 13.37 A -ATOM 559 N ASP A 80 41.078 54.376 46.123 1.00 6.31 A -ATOM 560 CA ASP A 80 40.898 54.487 44.661 1.00 6.74 A -ATOM 561 C ASP A 80 41.474 55.764 44.088 1.00 6.52 A -ATOM 562 O ASP A 80 40.896 56.841 44.340 1.00 7.52 A -ATOM 563 CB ASP A 80 39.382 54.361 44.370 1.00 7.41 A -ATOM 564 CG ASP A 80 39.052 54.297 42.895 1.00 8.15 A -ATOM 565 OD1 ASP A 80 37.864 54.054 42.544 1.00 10.21 A -ATOM 566 OD2 ASP A 80 39.923 54.466 42.034 1.00 8.03 A -ATOM 567 N LEU A 81 42.574 55.668 43.364 1.00 6.91 A -ATOM 568 CA LEU A 81 43.190 56.846 42.760 1.00 8.19 A -ATOM 569 C LEU A 81 42.250 57.501 41.754 1.00 8.43 A -ATOM 570 O LEU A 81 42.540 58.657 41.386 1.00 9.36 A -ATOM 571 CB LEU A 81 44.569 56.573 42.188 1.00 8.43 A -ATOM 572 CG LEU A 81 45.680 56.623 43.238 1.00 8.40 A -ATOM 573 CD1 LEU A 81 46.935 56.024 42.606 1.00 9.27 A -ATOM 574 CD2 LEU A 81 45.909 58.050 43.682 1.00 9.04 A -ATOM 575 N ASN A 82 41.191 56.839 41.326 1.00 8.67 A -ATOM 576 CA ASN A 82 40.271 57.540 40.394 1.00 9.87 A -ATOM 577 C ASN A 82 39.557 58.691 41.113 1.00 10.44 A -ATOM 578 O ASN A 82 39.033 59.592 40.434 1.00 11.63 A -ATOM 579 CB ASN A 82 39.283 56.608 39.715 1.00 10.51 A -ATOM 580 CG ASN A 82 39.992 55.772 38.642 1.00 10.87 A -ATOM 581 OD1 ASN A 82 40.917 56.248 38.003 1.00 11.41 A -ATOM 582 ND2 ASN A 82 39.530 54.538 38.505 1.00 11.83 A -ATOM 583 N ASP A 83 39.542 58.688 42.430 1.00 10.73 A -ATOM 584 CA ASP A 83 38.901 59.787 43.195 1.00 11.58 A -ATOM 585 C ASP A 83 39.956 60.809 43.606 1.00 11.57 A -ATOM 586 O ASP A 83 39.650 61.760 44.366 1.00 11.86 A -ATOM 587 CB ASP A 83 38.174 59.225 44.409 1.00 12.86 A -ATOM 588 CG ASP A 83 36.833 58.600 44.116 1.00 13.31 A -ATOM 589 OD1 ASP A 83 36.447 57.683 44.833 1.00 14.31 A -ATOM 590 OD2 ASP A 83 36.124 59.090 43.183 1.00 15.40 A -ATOM 591 N PHE A 84 41.173 60.688 43.112 1.00 11.64 A -ATOM 592 CA PHE A 84 42.211 61.630 43.566 1.00 12.27 A -ATOM 593 C PHE A 84 42.034 63.088 43.200 1.00 11.14 A -ATOM 594 O PHE A 84 42.522 63.933 43.995 1.00 10.67 A -ATOM 595 CB PHE A 84 43.608 61.082 43.296 1.00 13.85 A -ATOM 596 CG PHE A 84 44.516 61.435 44.457 1.00 15.36 A -ATOM 597 CD1 PHE A 84 45.490 62.419 44.313 1.00 16.41 A -ATOM 598 CD2 PHE A 84 44.347 60.771 45.675 1.00 15.95 A -ATOM 599 CE1 PHE A 84 46.316 62.724 45.396 1.00 17.08 A -ATOM 600 CE2 PHE A 84 45.182 61.074 46.757 1.00 16.89 A -ATOM 601 CZ PHE A 84 46.170 62.051 46.612 1.00 16.95 A -ATOM 602 N ALA A 85 41.392 63.448 42.102 1.00 10.77 A -ATOM 603 CA ALA A 85 41.220 64.879 41.794 1.00 10.60 A -ATOM 604 C ALA A 85 40.407 65.535 42.914 1.00 9.89 A -ATOM 605 O ALA A 85 40.689 66.653 43.346 1.00 9.55 A -ATOM 606 CB ALA A 85 40.575 65.072 40.425 1.00 11.44 A -ATOM 607 N THR A 86 39.403 64.784 43.359 1.00 10.27 A -ATOM 608 CA THR A 86 38.507 65.263 44.420 1.00 10.82 A -ATOM 609 C THR A 86 39.247 65.418 45.740 1.00 9.25 A -ATOM 610 O THR A 86 39.123 66.418 46.473 1.00 8.54 A -ATOM 611 CB THR A 86 37.245 64.317 44.584 1.00 12.16 A -ATOM 612 OG1 THR A 86 36.607 64.271 43.272 1.00 13.99 A -ATOM 613 CG2 THR A 86 36.315 64.815 45.690 1.00 12.79 A -ATOM 614 N VAL A 87 40.011 64.392 46.057 1.00 8.71 A -ATOM 615 CA VAL A 87 40.822 64.395 47.289 1.00 8.40 A -ATOM 616 C VAL A 87 41.809 65.555 47.232 1.00 7.98 A -ATOM 617 O VAL A 87 41.965 66.265 48.236 1.00 8.35 A -ATOM 618 CB VAL A 87 41.540 63.043 47.470 1.00 8.84 A -ATOM 619 CG1 VAL A 87 42.621 63.167 48.539 1.00 9.19 A -ATOM 620 CG2 VAL A 87 40.533 61.950 47.778 1.00 9.80 A -ATOM 621 N ASN A 88 42.472 65.711 46.109 1.00 7.83 A -ATOM 622 CA ASN A 88 43.463 66.775 45.933 1.00 9.07 A -ATOM 623 C ASN A 88 42.851 68.144 46.146 1.00 8.46 A -ATOM 624 O ASN A 88 43.450 69.026 46.768 1.00 7.86 A -ATOM 625 CB ASN A 88 44.145 66.740 44.572 1.00 10.40 A -ATOM 626 CG ASN A 88 45.540 66.169 44.610 1.00 11.76 A -ATOM 627 OD1 ASN A 88 46.210 66.239 45.662 1.00 12.61 A -ATOM 628 ND2 ASN A 88 45.921 65.615 43.454 1.00 13.35 A -ATOM 629 N ALA A 89 41.664 68.340 45.587 1.00 7.67 A -ATOM 630 CA ALA A 89 40.975 69.637 45.742 1.00 7.58 A -ATOM 631 C ALA A 89 40.678 69.934 47.212 1.00 6.88 A -ATOM 632 O ALA A 89 40.867 71.066 47.682 1.00 7.11 A -ATOM 633 CB ALA A 89 39.713 69.635 44.884 1.00 8.02 A -ATOM 634 N THR A 90 40.173 68.916 47.898 1.00 7.04 A -ATOM 635 CA THR A 90 39.858 69.089 49.326 1.00 7.07 A -ATOM 636 C THR A 90 41.132 69.328 50.133 1.00 6.37 A -ATOM 637 O THR A 90 41.163 70.183 51.031 1.00 6.22 A -ATOM 638 CB THR A 90 39.083 67.823 49.853 1.00 7.91 A -ATOM 639 OG1 THR A 90 37.752 67.848 49.254 1.00 10.49 A -ATOM 640 CG2 THR A 90 39.020 67.792 51.378 1.00 9.07 A -ATOM 641 N TYR A 91 42.164 68.549 49.837 1.00 6.16 A -ATOM 642 CA TYR A 91 43.451 68.653 50.539 1.00 5.79 A -ATOM 643 C TYR A 91 44.026 70.048 50.341 1.00 5.81 A -ATOM 644 O TYR A 91 44.488 70.724 51.278 1.00 6.66 A -ATOM 645 CB TYR A 91 44.344 67.546 50.008 1.00 5.88 A -ATOM 646 CG TYR A 91 45.698 67.369 50.645 1.00 5.59 A -ATOM 647 CD1 TYR A 91 45.958 66.295 51.497 1.00 5.96 A -ATOM 648 CD2 TYR A 91 46.730 68.267 50.394 1.00 6.04 A -ATOM 649 CE1 TYR A 91 47.210 66.067 52.070 1.00 5.47 A -ATOM 650 CE2 TYR A 91 47.994 68.093 50.940 1.00 6.05 A -ATOM 651 CZ TYR A 91 48.210 66.985 51.768 1.00 5.90 A -ATOM 652 OH TYR A 91 49.467 66.804 52.315 1.00 5.93 A -ATOM 653 N GLU A 92 44.002 70.502 49.095 1.00 6.05 A -ATOM 654 CA GLU A 92 44.514 71.841 48.771 1.00 6.75 A -ATOM 655 C GLU A 92 43.765 72.917 49.548 1.00 6.71 A -ATOM 656 O GLU A 92 44.350 73.846 50.151 1.00 7.08 A -ATOM 657 CB GLU A 92 44.437 72.138 47.269 1.00 8.59 A -ATOM 658 CG GLU A 92 44.989 73.518 46.875 1.00 11.80 A -ATOM 659 CD GLU A 92 45.544 73.634 45.500 1.00 15.28 A -ATOM 660 OE1 GLU A 92 46.349 74.486 45.106 1.00 18.01 A -ATOM 661 OE2 GLU A 92 45.182 72.757 44.704 1.00 17.25 A -ATOM 662 N ALA A 93 42.434 72.824 49.534 1.00 6.56 A -ATOM 663 CA ALA A 93 41.573 73.786 50.239 1.00 7.09 A -ATOM 664 C ALA A 93 41.900 73.817 51.726 1.00 6.90 A -ATOM 665 O ALA A 93 42.030 74.895 52.313 1.00 7.00 A -ATOM 666 CB ALA A 93 40.092 73.460 50.036 1.00 7.57 A -ATOM 667 N PHE A 94 42.042 72.618 52.302 1.00 6.67 A -ATOM 668 CA PHE A 94 42.332 72.516 53.752 1.00 6.61 A -ATOM 669 C PHE A 94 43.597 73.288 54.131 1.00 5.97 A -ATOM 670 O PHE A 94 43.607 74.054 55.105 1.00 6.59 A -ATOM 671 CB PHE A 94 42.401 71.034 54.101 1.00 7.02 A -ATOM 672 CG PHE A 94 42.599 70.771 55.555 1.00 7.23 A -ATOM 673 CD1 PHE A 94 41.464 70.713 56.358 1.00 8.12 A -ATOM 674 CD2 PHE A 94 43.862 70.605 56.098 1.00 8.71 A -ATOM 675 CE1 PHE A 94 41.545 70.478 57.717 1.00 9.74 A -ATOM 676 CE2 PHE A 94 43.979 70.367 57.485 1.00 9.96 A -ATOM 677 CZ PHE A 94 42.813 70.332 58.243 1.00 9.82 A -ATOM 678 N PHE A 95 44.675 73.086 53.389 1.00 5.98 A -ATOM 679 CA PHE A 95 45.951 73.781 53.651 1.00 6.00 A -ATOM 680 C PHE A 95 45.784 75.281 53.417 1.00 6.18 A -ATOM 681 O PHE A 95 46.266 76.101 54.226 1.00 6.81 A -ATOM 682 CB PHE A 95 47.140 73.124 52.962 1.00 6.51 A -ATOM 683 CG PHE A 95 47.524 71.874 53.714 1.00 6.57 A -ATOM 684 CD1 PHE A 95 47.028 70.622 53.373 1.00 7.43 A -ATOM 685 CD2 PHE A 95 48.341 71.976 54.850 1.00 6.79 A -ATOM 686 CE1 PHE A 95 47.329 69.479 54.111 1.00 7.20 A -ATOM 687 CE2 PHE A 95 48.669 70.841 55.584 1.00 7.08 A -ATOM 688 CZ PHE A 95 48.145 69.594 55.238 1.00 7.03 A -ATOM 689 N THR A 96 45.112 75.622 52.319 1.00 6.49 A -ATOM 690 CA THR A 96 44.897 77.053 52.019 1.00 8.11 A -ATOM 691 C THR A 96 44.112 77.732 53.131 1.00 7.33 A -ATOM 692 O THR A 96 44.429 78.891 53.504 1.00 7.70 A -ATOM 693 CB THR A 96 44.186 77.231 50.627 1.00 9.27 A -ATOM 694 OG1 THR A 96 45.085 76.633 49.670 1.00 11.25 A -ATOM 695 CG2 THR A 96 43.881 78.696 50.311 1.00 9.94 A -ATOM 696 N GLU A 97 43.106 77.060 53.665 1.00 7.31 A -ATOM 697 CA GLU A 97 42.266 77.615 54.743 1.00 8.29 A -ATOM 698 C GLU A 97 43.102 77.942 55.957 1.00 7.86 A -ATOM 699 O GLU A 97 42.748 78.850 56.745 1.00 9.08 A -ATOM 700 CB GLU A 97 41.175 76.606 55.168 1.00 8.63 A -ATOM 701 CG GLU A 97 40.094 76.405 54.068 1.00 9.19 A -ATOM 702 CD GLU A 97 39.441 75.045 54.140 1.00 9.70 A -ATOM 703 OE1 GLU A 97 39.587 74.338 55.128 1.00 10.55 A -ATOM 704 OE2 GLU A 97 38.781 74.714 53.131 1.00 11.38 A -ATOM 705 N HIS A 98 44.220 77.252 56.159 1.00 7.67 A -ATOM 706 CA HIS A 98 45.097 77.458 57.305 1.00 7.40 A -ATOM 707 C HIS A 98 46.321 78.282 56.958 1.00 7.94 A -ATOM 708 O HIS A 98 47.288 78.280 57.751 1.00 8.19 A -ATOM 709 CB HIS A 98 45.506 76.069 57.908 1.00 7.48 A -ATOM 710 CG HIS A 98 44.303 75.377 58.471 1.00 7.83 A -ATOM 711 ND1 HIS A 98 43.472 74.517 57.790 1.00 7.93 A -ATOM 712 CD2 HIS A 98 43.815 75.452 59.750 1.00 8.60 A -ATOM 713 CE1 HIS A 98 42.522 74.117 58.614 1.00 8.30 A -ATOM 714 NE2 HIS A 98 42.697 74.649 59.801 1.00 9.30 A -ATOM 715 N ASN A 99 46.291 78.931 55.806 1.00 8.01 A -ATOM 716 CA ASN A 99 47.423 79.752 55.341 1.00 8.93 A -ATOM 717 C ASN A 99 48.728 78.974 55.499 1.00 7.82 A -ATOM 718 O ASN A 99 49.777 79.517 55.928 1.00 8.81 A -ATOM 719 CB ASN A 99 47.463 81.061 56.144 1.00 10.58 A -ATOM 720 CG ASN A 99 48.447 82.056 55.546 1.00 11.86 A -ATOM 721 OD1 ASN A 99 48.653 82.042 54.320 1.00 13.08 A -ATOM 722 ND2 ASN A 99 49.031 82.877 56.417 1.00 13.49 A -ATOM 723 N ALA A 100 48.690 77.711 55.106 1.00 7.10 A -ATOM 724 CA ALA A 100 49.808 76.792 55.270 1.00 7.43 A -ATOM 725 C ALA A 100 50.563 76.441 54.005 1.00 8.24 A -ATOM 726 O ALA A 100 49.904 76.191 52.988 1.00 9.53 A -ATOM 727 CB ALA A 100 49.262 75.483 55.884 1.00 7.38 A -ATOM 728 N THR A 101 51.880 76.411 54.110 1.00 7.83 A -ATOM 729 CA THR A 101 52.694 75.927 52.985 1.00 8.26 A -ATOM 730 C THR A 101 52.331 74.436 52.883 1.00 7.07 A -ATOM 731 O THR A 101 52.184 73.774 53.936 1.00 7.16 A -ATOM 732 CB THR A 101 54.229 76.107 53.292 1.00 9.39 A -ATOM 733 OG1 THR A 101 54.419 77.548 53.397 1.00 10.96 A -ATOM 734 CG2 THR A 101 55.144 75.476 52.244 1.00 10.68 A -ATOM 735 N PHE A 102 52.245 73.911 51.687 1.00 6.83 A -ATOM 736 CA PHE A 102 51.894 72.488 51.556 1.00 6.82 A -ATOM 737 C PHE A 102 53.025 71.584 52.049 1.00 6.10 A -ATOM 738 O PHE A 102 54.203 71.847 51.781 1.00 6.28 A -ATOM 739 CB PHE A 102 51.600 72.146 50.095 1.00 7.29 A -ATOM 740 CG PHE A 102 50.546 72.979 49.431 1.00 7.87 A -ATOM 741 CD1 PHE A 102 50.799 73.681 48.256 1.00 8.98 A -ATOM 742 CD2 PHE A 102 49.264 73.053 49.997 1.00 7.94 A -ATOM 743 CE1 PHE A 102 49.822 74.451 47.641 1.00 10.13 A -ATOM 744 CE2 PHE A 102 48.256 73.816 49.401 1.00 8.74 A -ATOM 745 CZ PHE A 102 48.548 74.523 48.219 1.00 9.67 A -ATOM 746 N PRO A 103 52.655 70.515 52.750 1.00 6.23 A -ATOM 747 CA PRO A 103 53.723 69.588 53.188 1.00 6.02 A -ATOM 748 C PRO A 103 54.299 68.798 52.008 1.00 4.53 A -ATOM 749 O PRO A 103 53.729 68.719 50.898 1.00 4.36 A -ATOM 750 CB PRO A 103 52.895 68.557 54.011 1.00 7.30 A -ATOM 751 CG PRO A 103 51.613 69.236 54.398 1.00 7.26 A -ATOM 752 CD PRO A 103 51.314 70.155 53.207 1.00 6.81 A -ATOM 753 N ALA A 104 55.432 68.152 52.268 1.00 4.08 A -ATOM 754 CA ALA A 104 55.928 67.093 51.379 1.00 3.99 A -ATOM 755 C ALA A 104 54.866 65.961 51.514 1.00 3.68 A -ATOM 756 O ALA A 104 54.135 65.862 52.531 1.00 4.10 A -ATOM 757 CB ALA A 104 57.278 66.624 51.799 1.00 4.60 A -ATOM 758 N ARG A 105 54.754 65.116 50.488 1.00 4.14 A -ATOM 759 CA ARG A 105 53.701 64.091 50.483 1.00 4.07 A -ATOM 760 C ARG A 105 54.037 62.865 49.676 1.00 3.75 A -ATOM 761 O ARG A 105 54.784 62.974 48.671 1.00 3.67 A -ATOM 762 CB ARG A 105 52.439 64.776 49.844 1.00 5.04 A -ATOM 763 CG ARG A 105 51.168 63.932 49.901 1.00 6.68 A -ATOM 764 CD ARG A 105 49.920 64.669 49.471 1.00 7.36 A -ATOM 765 NE ARG A 105 49.942 64.950 48.059 1.00 9.16 A -ATOM 766 CZ ARG A 105 48.872 65.406 47.372 1.00 9.60 A -ATOM 767 NH1 ARG A 105 48.897 65.570 46.061 1.00 10.15 A -ATOM 768 NH2 ARG A 105 47.767 65.757 48.029 1.00 9.57 A -ATOM 769 N SER A 106 53.519 61.735 50.143 1.00 3.97 A -ATOM 770 CA SER A 106 53.565 60.496 49.356 1.00 4.51 A -ATOM 771 C SER A 106 52.082 60.072 49.212 1.00 4.12 A -ATOM 772 O SER A 106 51.289 60.266 50.144 1.00 4.73 A -ATOM 773 CB SER A 106 54.353 59.374 49.959 1.00 5.49 A -ATOM 774 OG SER A 106 55.710 59.796 49.957 1.00 6.48 A -HETATM 775 N CSP A 107 51.758 59.505 48.054 1.00 4.52 A -HETATM 776 CA CSP A 107 50.378 59.129 47.760 1.00 5.72 A -HETATM 777 CB CSP A 107 49.700 60.089 46.804 0.67 8.42 A -HETATM 779 SG CSP A 107 49.776 61.809 47.227 0.67 12.80 A -HETATM 780 P CSP A 107 51.167 62.354 45.759 0.67 14.01 A -HETATM 781 O1P CSP A 107 52.330 61.495 45.839 0.67 15.06 A -HETATM 782 O2P CSP A 107 50.515 62.084 44.369 0.67 15.90 A -HETATM 783 O3P CSP A 107 51.332 63.867 45.931 0.67 14.77 A -HETATM 784 C CSP A 107 50.355 57.779 47.046 1.00 4.97 A -HETATM 785 O CSP A 107 51.024 57.644 45.986 1.00 4.62 A -ATOM 787 N VAL A 108 49.572 56.859 47.551 1.00 4.59 A -ATOM 788 CA VAL A 108 49.485 55.529 46.918 1.00 4.55 A -ATOM 789 C VAL A 108 48.074 55.005 47.075 1.00 4.55 A -ATOM 790 O VAL A 108 47.373 55.353 48.046 1.00 4.69 A -ATOM 791 CB VAL A 108 50.491 54.549 47.594 1.00 4.96 A -ATOM 792 CG1 VAL A 108 51.949 54.998 47.484 1.00 5.33 A -ATOM 793 CG2 VAL A 108 50.132 54.200 49.027 1.00 6.15 A -ATOM 794 N GLU A 109 47.680 54.097 46.183 1.00 4.88 A -ATOM 795 CA GLU A 109 46.413 53.393 46.293 1.00 4.49 A -ATOM 796 C GLU A 109 46.709 52.038 46.954 1.00 4.13 A -ATOM 797 O GLU A 109 47.528 51.280 46.405 1.00 5.16 A -ATOM 798 CB GLU A 109 45.767 53.124 44.938 1.00 5.33 A -ATOM 799 CG GLU A 109 44.371 52.523 45.089 1.00 5.37 A -ATOM 800 CD GLU A 109 43.764 52.168 43.746 1.00 6.00 A -ATOM 801 OE1 GLU A 109 43.382 51.012 43.552 1.00 7.16 A -ATOM 802 OE2 GLU A 109 43.683 53.105 42.917 1.00 5.73 A -ATOM 803 N VAL A 110 46.081 51.785 48.087 1.00 4.12 A -ATOM 804 CA VAL A 110 46.266 50.496 48.778 1.00 5.16 A -ATOM 805 C VAL A 110 45.106 49.561 48.429 1.00 4.97 A -ATOM 806 O VAL A 110 44.159 49.994 47.748 1.00 5.83 A -ATOM 807 CB VAL A 110 46.324 50.727 50.295 1.00 5.61 A -ATOM 808 CG1 VAL A 110 47.521 51.594 50.678 1.00 6.03 A -ATOM 809 CG2 VAL A 110 45.036 51.320 50.844 1.00 5.94 A -ATOM 810 N ALA A 111 45.198 48.309 48.840 1.00 5.19 A -ATOM 811 CA ALA A 111 44.126 47.352 48.558 1.00 5.46 A -ATOM 812 C ALA A 111 42.900 47.562 49.429 1.00 5.34 A -ATOM 813 O ALA A 111 41.750 47.334 48.964 1.00 6.46 A -ATOM 814 CB ALA A 111 44.653 45.917 48.746 1.00 5.06 A -ATOM 815 N ARG A 112 43.091 47.959 50.685 1.00 5.42 A -ATOM 816 CA ARG A 112 41.972 48.127 51.619 1.00 5.97 A -ATOM 817 C ARG A 112 42.478 48.900 52.817 1.00 5.15 A -ATOM 818 O ARG A 112 43.687 48.874 53.130 1.00 5.33 A -ATOM 819 CB ARG A 112 41.486 46.742 52.068 1.00 5.86 A -ATOM 820 CG ARG A 112 40.113 46.714 52.715 1.00 7.01 A -ATOM 821 CD ARG A 112 39.755 45.315 53.123 1.00 7.87 A -ATOM 822 NE ARG A 112 38.438 45.315 53.754 1.00 9.03 A -ATOM 823 CZ ARG A 112 37.936 44.312 54.495 1.00 9.58 A -ATOM 824 NH1 ARG A 112 36.706 44.464 55.015 1.00 10.53 A -ATOM 825 NH2 ARG A 112 38.619 43.181 54.677 1.00 10.02 A -ATOM 826 N LEU A 113 41.571 49.596 53.475 1.00 5.16 A -ATOM 827 CA LEU A 113 41.860 50.392 54.662 1.00 5.23 A -ATOM 828 C LEU A 113 40.958 49.961 55.800 1.00 5.70 A -ATOM 829 O LEU A 113 39.890 49.350 55.580 1.00 6.10 A -ATOM 830 CB LEU A 113 41.632 51.873 54.335 1.00 5.50 A -ATOM 831 CG LEU A 113 42.649 52.474 53.370 1.00 5.34 A -ATOM 832 CD1 LEU A 113 42.176 53.859 52.921 1.00 5.70 A -ATOM 833 CD2 LEU A 113 44.032 52.557 54.010 1.00 4.99 A -ATOM 834 N PRO A 114 41.361 50.268 57.024 1.00 6.67 A -ATOM 835 CA PRO A 114 40.539 49.934 58.195 1.00 7.38 A -ATOM 836 C PRO A 114 39.124 50.475 57.984 1.00 7.04 A -ATOM 837 O PRO A 114 38.861 51.586 57.489 1.00 7.08 A -ATOM 838 CB PRO A 114 41.239 50.649 59.357 1.00 7.55 A -ATOM 839 CG PRO A 114 42.679 50.756 58.922 1.00 7.89 A -ATOM 840 CD PRO A 114 42.617 50.956 57.405 1.00 7.17 A -ATOM 841 N LYS A 115 38.152 49.650 58.370 1.00 7.96 A -ATOM 842 CA LYS A 115 36.717 49.953 58.299 1.00 9.22 A -ATOM 843 C LYS A 115 36.276 50.209 56.876 1.00 9.21 A -ATOM 844 O LYS A 115 35.203 50.835 56.725 1.00 9.21 A -ATOM 845 CB LYS A 115 36.379 51.173 59.162 1.00 10.55 A -ATOM 846 CG LYS A 115 36.740 50.934 60.632 1.00 12.98 A -ATOM 847 CD LYS A 115 36.179 52.106 61.449 1.00 15.15 A -ATOM 848 CE LYS A 115 36.188 51.791 62.932 1.00 16.92 A -ATOM 849 NZ LYS A 115 34.907 52.176 63.588 1.00 18.34 A -ATOM 850 N ASP A 116 37.020 49.783 55.882 1.00 8.41 A -ATOM 851 CA ASP A 116 36.653 50.010 54.481 1.00 8.14 A -ATOM 852 C ASP A 116 36.537 51.491 54.137 1.00 7.11 A -ATOM 853 O ASP A 116 35.783 51.846 53.192 1.00 8.04 A -ATOM 854 CB ASP A 116 35.408 49.198 54.075 1.00 9.13 A -ATOM 855 CG ASP A 116 35.783 47.712 53.984 1.00 10.16 A -ATOM 856 OD1 ASP A 116 35.295 46.977 54.853 1.00 11.23 A -ATOM 857 OD2 ASP A 116 36.542 47.365 53.069 1.00 10.06 A -ATOM 858 N VAL A 117 37.303 52.340 54.811 1.00 6.39 A -ATOM 859 CA VAL A 117 37.277 53.781 54.470 1.00 5.93 A -ATOM 860 C VAL A 117 37.988 53.972 53.123 1.00 5.45 A -ATOM 861 O VAL A 117 38.671 53.077 52.615 1.00 5.92 A -ATOM 862 CB VAL A 117 37.850 54.629 55.611 1.00 5.41 A -ATOM 863 CG1 VAL A 117 37.045 54.552 56.910 1.00 6.56 A -ATOM 864 CG2 VAL A 117 39.339 54.353 55.801 1.00 4.77 A -ATOM 865 N LYS A 118 37.861 55.159 52.599 1.00 5.60 A -ATOM 866 CA LYS A 118 38.448 55.494 51.309 1.00 5.78 A -ATOM 867 C LYS A 118 39.794 56.190 51.421 1.00 5.20 A -ATOM 868 O LYS A 118 40.449 56.351 50.398 1.00 4.89 A -ATOM 869 CB LYS A 118 37.481 56.401 50.545 1.00 6.48 A -ATOM 870 CG LYS A 118 36.142 55.766 50.197 1.00 8.03 A -ATOM 871 CD LYS A 118 35.093 56.681 49.587 1.00 10.35 A -ATOM 872 CE LYS A 118 33.779 55.939 49.354 1.00 12.02 A -ATOM 873 NZ LYS A 118 32.708 56.770 48.768 1.00 13.89 A -ATOM 874 N ILE A 119 40.201 56.595 52.620 1.00 4.72 A -ATOM 875 CA ILE A 119 41.442 57.347 52.805 1.00 4.45 A -ATOM 876 C ILE A 119 41.948 57.236 54.233 1.00 4.59 A -ATOM 877 O ILE A 119 41.151 57.090 55.158 1.00 4.61 A -ATOM 878 CB ILE A 119 41.166 58.835 52.378 1.00 4.91 A -ATOM 879 CG1 ILE A 119 42.496 59.638 52.307 1.00 4.94 A -ATOM 880 CG2 ILE A 119 40.145 59.557 53.294 1.00 5.42 A -ATOM 881 CD1 ILE A 119 42.276 60.967 51.552 1.00 5.66 A -ATOM 882 N GLU A 120 43.266 57.294 54.361 1.00 4.02 A -ATOM 883 CA GLU A 120 43.938 57.295 55.668 1.00 3.81 A -ATOM 884 C GLU A 120 45.119 58.249 55.491 1.00 3.77 A -ATOM 885 O GLU A 120 45.874 58.112 54.507 1.00 4.01 A -ATOM 886 CB GLU A 120 44.417 55.919 56.069 1.00 4.09 A -ATOM 887 CG GLU A 120 45.120 55.856 57.420 1.00 4.28 A -ATOM 888 CD GLU A 120 45.637 54.500 57.808 1.00 4.49 A -ATOM 889 OE1 GLU A 120 46.641 54.356 58.514 1.00 6.49 A -ATOM 890 OE2 GLU A 120 44.960 53.518 57.364 1.00 5.06 A -ATOM 891 N ILE A 121 45.302 59.173 56.418 1.00 3.35 A -ATOM 892 CA ILE A 121 46.382 60.161 56.304 1.00 3.57 A -ATOM 893 C ILE A 121 47.173 60.255 57.596 1.00 3.38 A -ATOM 894 O ILE A 121 46.614 60.488 58.665 1.00 3.55 A -ATOM 895 CB ILE A 121 45.799 61.584 56.009 1.00 4.18 A -ATOM 896 CG1 ILE A 121 44.888 61.562 54.777 1.00 5.00 A -ATOM 897 CG2 ILE A 121 46.938 62.619 55.858 1.00 5.16 A -ATOM 898 CD1 ILE A 121 44.198 62.912 54.470 1.00 5.62 A -ATOM 899 N GLU A 122 48.487 60.086 57.456 1.00 3.62 A -ATOM 900 CA GLU A 122 49.396 60.249 58.594 1.00 3.82 A -ATOM 901 C GLU A 122 50.201 61.524 58.342 1.00 3.47 A -ATOM 902 O GLU A 122 50.402 61.924 57.176 1.00 3.81 A -ATOM 903 CB GLU A 122 50.309 59.073 58.847 1.00 6.01 A -ATOM 904 CG GLU A 122 51.237 58.774 57.680 1.00 7.17 A -ATOM 905 CD GLU A 122 52.243 57.696 57.886 1.00 8.33 A -ATOM 906 OE1 GLU A 122 53.244 57.674 57.155 1.00 10.86 A -ATOM 907 OE2 GLU A 122 52.050 56.839 58.772 1.00 7.19 A -ATOM 908 N ALA A 123 50.651 62.151 59.418 1.00 4.17 A -ATOM 909 CA ALA A 123 51.377 63.409 59.272 1.00 4.16 A -ATOM 910 C ALA A 123 52.493 63.570 60.271 1.00 3.85 A -ATOM 911 O ALA A 123 52.469 62.978 61.371 1.00 4.05 A -ATOM 912 CB ALA A 123 50.429 64.603 59.479 1.00 5.43 A -ATOM 913 N ILE A 124 53.494 64.325 59.869 1.00 3.64 A -ATOM 914 CA ILE A 124 54.631 64.724 60.674 1.00 4.00 A -ATOM 915 C ILE A 124 54.613 66.259 60.714 1.00 3.37 A -ATOM 916 O ILE A 124 54.497 66.855 59.620 1.00 3.97 A -ATOM 917 CB ILE A 124 56.000 64.242 60.087 1.00 5.41 A -ATOM 918 CG1 ILE A 124 56.068 62.705 60.117 1.00 6.98 A -ATOM 919 CG2 ILE A 124 57.183 64.859 60.874 1.00 6.64 A -ATOM 920 CD1 ILE A 124 57.288 62.159 59.337 1.00 8.60 A -ATOM 921 N ALA A 125 54.752 66.842 61.880 1.00 3.70 A -ATOM 922 CA ALA A 125 54.808 68.301 62.068 1.00 4.32 A -ATOM 923 C ALA A 125 56.028 68.635 62.930 1.00 3.88 A -ATOM 924 O ALA A 125 56.523 67.777 63.665 1.00 4.96 A -ATOM 925 CB ALA A 125 53.501 68.783 62.702 1.00 5.11 A -ATOM 926 N VAL A 126 56.521 69.872 62.787 1.00 4.73 A -ATOM 927 CA VAL A 126 57.683 70.287 63.588 1.00 5.32 A -ATOM 928 C VAL A 126 57.397 71.648 64.218 1.00 5.65 A -ATOM 929 O VAL A 126 56.687 72.479 63.670 1.00 6.01 A -ATOM 930 CB VAL A 126 58.997 70.332 62.778 1.00 6.36 A -ATOM 931 CG1 VAL A 126 59.496 68.943 62.402 1.00 7.37 A -ATOM 932 CG2 VAL A 126 58.899 71.258 61.592 1.00 7.21 A -ATOM 933 N ARG A 127 58.004 71.813 65.384 1.00 5.90 A -ATOM 934 CA ARG A 127 57.867 73.105 66.095 1.00 8.86 A -ATOM 935 C ARG A 127 58.748 74.200 65.483 1.00 10.67 A -ATOM 936 O ARG A 127 58.297 75.374 65.521 1.00 12.25 A -ATOM 937 CB ARG A 127 58.270 73.010 67.564 1.00 8.97 A -ATOM 938 CG ARG A 127 57.429 71.998 68.304 1.00 8.83 A -ATOM 939 CD ARG A 127 57.632 72.173 69.812 1.00 9.65 A -ATOM 940 NE ARG A 127 56.885 71.128 70.494 1.00 8.63 A -ATOM 941 CZ ARG A 127 55.591 71.181 70.713 1.00 8.65 A -ATOM 942 NH1 ARG A 127 54.865 72.258 70.467 1.00 8.88 A -ATOM 943 NH2 ARG A 127 54.968 70.066 71.099 1.00 8.68 A -ATOM 944 N ARG A 128 59.905 73.836 65.001 1.00 12.46 A -ATOM 945 CA ARG A 128 60.872 74.766 64.407 1.00 14.89 A -ATOM 946 C ARG A 128 61.127 74.505 62.918 1.00 16.10 A -ATOM 947 O ARG A 128 61.112 73.288 62.583 1.00 17.58 A -ATOM 948 CB ARG A 128 62.222 74.648 65.151 1.00 15.67 A -ATOM 949 OXT ARG A 128 61.959 75.293 62.395 1.00 17.72 A -ATOM 951 N SER B 2 62.109 75.379 59.687 1.00 16.24 B -ATOM 952 CA SER B 2 61.990 74.424 58.545 1.00 15.30 B -ATOM 953 C SER B 2 61.682 75.199 57.256 1.00 13.90 B -ATOM 954 O SER B 2 61.094 76.306 57.298 1.00 15.02 B -ATOM 955 CB SER B 2 60.983 73.331 58.796 1.00 16.11 B -ATOM 956 OG SER B 2 59.642 73.778 58.666 1.00 18.37 B -ATOM 957 N LYS B 3 62.095 74.598 56.142 1.00 12.13 B -ATOM 958 CA LYS B 3 61.881 75.274 54.855 1.00 11.35 B -ATOM 959 C LYS B 3 61.619 74.285 53.732 1.00 8.65 B -ATOM 960 O LYS B 3 61.974 73.102 53.724 1.00 7.83 B -ATOM 961 CB LYS B 3 63.089 76.165 54.508 1.00 13.69 B -ATOM 962 CG LYS B 3 64.314 75.337 54.208 1.00 15.79 B -ATOM 963 CD LYS B 3 65.631 76.074 54.056 1.00 17.79 B -ATOM 964 CE LYS B 3 66.208 76.498 55.391 1.00 18.86 B -ATOM 965 NZ LYS B 3 67.628 76.966 55.266 1.00 20.35 B -ATOM 966 N THR B 4 60.953 74.837 52.734 1.00 7.14 B -ATOM 967 CA THR B 4 60.662 74.068 51.526 1.00 6.44 B -ATOM 968 C THR B 4 61.943 73.856 50.711 1.00 5.57 B -ATOM 969 O THR B 4 62.800 74.785 50.616 1.00 6.47 B -ATOM 970 CB THR B 4 59.713 74.950 50.619 1.00 7.10 B -ATOM 971 OG1 THR B 4 58.447 75.034 51.320 1.00 8.40 B -ATOM 972 CG2 THR B 4 59.526 74.383 49.209 1.00 7.78 B -ATOM 973 N ILE B 5 62.056 72.684 50.115 1.00 4.90 B -ATOM 974 CA ILE B 5 63.114 72.395 49.139 1.00 5.03 B -ATOM 975 C ILE B 5 62.401 72.500 47.762 1.00 5.26 B -ATOM 976 O ILE B 5 61.375 71.875 47.535 1.00 5.95 B -ATOM 977 CB ILE B 5 63.748 70.997 49.304 1.00 5.22 B -ATOM 978 CG1 ILE B 5 64.326 70.810 50.722 1.00 5.41 B -ATOM 979 CG2 ILE B 5 64.802 70.734 48.204 1.00 6.47 B -ATOM 980 CD1 ILE B 5 64.678 69.334 51.050 1.00 4.98 B -ATOM 981 N ALA B 6 62.990 73.340 46.901 1.00 5.80 B -ATOM 982 CA ALA B 6 62.428 73.548 45.548 1.00 7.32 B -ATOM 983 C ALA B 6 63.599 73.578 44.573 1.00 7.57 B -ATOM 984 O ALA B 6 64.516 74.414 44.680 1.00 10.07 B -ATOM 985 CB ALA B 6 61.583 74.808 45.481 1.00 8.24 B -ATOM 986 N THR B 7 63.612 72.613 43.666 1.00 6.19 B -ATOM 987 CA THR B 7 64.681 72.481 42.676 1.00 6.55 B -ATOM 988 C THR B 7 64.145 72.188 41.286 1.00 5.76 B -ATOM 989 O THR B 7 63.171 71.468 41.146 1.00 6.20 B -ATOM 990 CB THR B 7 65.663 71.330 43.117 1.00 7.01 B -ATOM 991 OG1 THR B 7 66.622 71.214 42.032 1.00 7.16 B -ATOM 992 CG2 THR B 7 65.012 69.980 43.363 1.00 7.30 B -ATOM 993 N GLU B 8 64.754 72.807 40.282 1.00 6.37 B -ATOM 994 CA GLU B 8 64.376 72.568 38.895 1.00 6.48 B -ATOM 995 C GLU B 8 64.803 71.162 38.497 1.00 6.14 B -ATOM 996 O GLU B 8 64.341 70.650 37.460 1.00 6.07 B -ATOM 997 CB GLU B 8 65.033 73.559 37.922 1.00 7.91 B -ATOM 998 CG GLU B 8 66.540 73.490 37.722 1.00 9.70 B -ATOM 999 CD GLU B 8 67.395 74.051 38.814 1.00 11.36 B -ATOM 1000 OE1 GLU B 8 66.979 74.261 39.958 1.00 12.18 B -ATOM 1001 OE2 GLU B 8 68.603 74.276 38.489 1.00 13.35 B -ATOM 1002 N ASN B 9 65.675 70.529 39.286 1.00 6.75 B -ATOM 1003 CA ASN B 9 66.220 69.204 38.967 1.00 7.05 B -ATOM 1004 C ASN B 9 65.308 68.025 39.238 1.00 7.06 B -ATOM 1005 O ASN B 9 65.680 66.872 38.959 1.00 6.95 B -ATOM 1006 CB ASN B 9 67.590 69.019 39.590 1.00 7.91 B -ATOM 1007 CG ASN B 9 68.573 70.034 39.030 1.00 9.05 B -ATOM 1008 OD1 ASN B 9 68.514 70.332 37.816 1.00 10.43 B -ATOM 1009 ND2 ASN B 9 69.410 70.545 39.902 1.00 9.59 B -ATOM 1010 N ALA B 10 64.140 68.250 39.839 1.00 5.82 B -ATOM 1011 CA ALA B 10 63.131 67.198 40.069 1.00 5.77 B -ATOM 1012 C ALA B 10 61.835 67.795 39.464 1.00 6.13 B -ATOM 1013 O ALA B 10 61.744 69.012 39.310 1.00 5.80 B -ATOM 1014 CB ALA B 10 62.935 66.850 41.527 1.00 6.12 B -ATOM 1015 N PRO B 11 60.887 66.939 39.127 1.00 6.62 B -ATOM 1016 CA PRO B 11 59.626 67.427 38.556 1.00 6.86 B -ATOM 1017 C PRO B 11 58.991 68.470 39.432 1.00 6.78 B -ATOM 1018 O PRO B 11 58.925 68.299 40.681 1.00 6.19 B -ATOM 1019 CB PRO B 11 58.750 66.191 38.483 1.00 7.77 B -ATOM 1020 CG PRO B 11 59.680 65.012 38.512 1.00 8.11 B -ATOM 1021 CD PRO B 11 60.918 65.475 39.270 1.00 7.42 B -ATOM 1022 N ALA B 12 58.469 69.527 38.830 1.00 8.21 B -ATOM 1023 CA ALA B 12 57.836 70.624 39.572 1.00 9.55 B -ATOM 1024 C ALA B 12 56.629 70.099 40.348 1.00 10.63 B -ATOM 1025 O ALA B 12 55.909 69.197 39.905 1.00 9.79 B -ATOM 1026 CB ALA B 12 57.344 71.687 38.589 1.00 10.50 B -ATOM 1027 N ALA B 13 56.468 70.685 41.520 1.00 11.95 B -ATOM 1028 CA ALA B 13 55.363 70.356 42.435 1.00 14.35 B -ATOM 1029 C ALA B 13 54.159 71.201 42.006 1.00 15.86 B -ATOM 1030 O ALA B 13 54.077 72.361 42.446 1.00 17.22 B -ATOM 1031 CB ALA B 13 55.728 70.640 43.882 1.00 14.52 B -ATOM 1032 N ILE B 14 53.335 70.571 41.192 1.00 16.89 B -ATOM 1033 CA ILE B 14 52.121 71.268 40.701 1.00 18.21 B -ATOM 1034 C ILE B 14 50.983 71.151 41.712 1.00 18.11 B -ATOM 1035 O ILE B 14 50.420 72.218 42.096 1.00 19.37 B -ATOM 1036 CB ILE B 14 51.808 70.805 39.249 1.00 19.06 B -ATOM 1037 CG1 ILE B 14 53.063 71.045 38.352 1.00 19.75 B -ATOM 1038 CG2 ILE B 14 50.571 71.498 38.616 1.00 19.75 B -ATOM 1039 CD1 ILE B 14 52.904 70.339 36.972 1.00 20.29 B -ATOM 1040 N GLY B 15 50.671 69.955 42.164 1.00 17.28 B -ATOM 1041 CA GLY B 15 49.589 69.783 43.173 1.00 15.10 B -ATOM 1042 C GLY B 15 49.929 70.474 44.499 1.00 13.16 B -ATOM 1043 O GLY B 15 50.901 71.233 44.655 1.00 14.07 B -ATOM 1044 N PRO B 16 49.082 70.180 45.491 1.00 11.29 B -ATOM 1045 CA PRO B 16 49.214 70.743 46.834 1.00 9.14 B -ATOM 1046 C PRO B 16 50.263 70.025 47.663 1.00 8.00 B -ATOM 1047 O PRO B 16 49.940 69.393 48.680 1.00 6.68 B -ATOM 1048 CB PRO B 16 47.790 70.627 47.384 1.00 9.25 B -ATOM 1049 CG PRO B 16 47.323 69.299 46.821 1.00 9.12 B -ATOM 1050 CD PRO B 16 47.874 69.312 45.393 1.00 10.61 B -ATOM 1051 N TYR B 17 51.512 70.158 47.238 1.00 6.92 B -ATOM 1052 CA TYR B 17 52.643 69.552 47.969 1.00 6.14 B -ATOM 1053 C TYR B 17 53.900 70.301 47.559 1.00 5.54 B -ATOM 1054 O TYR B 17 53.863 71.069 46.568 1.00 7.15 B -ATOM 1055 CB TYR B 17 52.770 68.038 47.653 1.00 6.78 B -ATOM 1056 CG TYR B 17 53.035 67.760 46.184 1.00 7.73 B -ATOM 1057 CD1 TYR B 17 54.354 67.570 45.725 1.00 8.18 B -ATOM 1058 CD2 TYR B 17 52.031 67.736 45.220 1.00 8.87 B -ATOM 1059 CE1 TYR B 17 54.645 67.316 44.386 1.00 9.51 B -ATOM 1060 CE2 TYR B 17 52.309 67.498 43.868 1.00 10.50 B -ATOM 1061 CZ TYR B 17 53.612 67.302 43.463 1.00 10.45 B -ATOM 1062 OH TYR B 17 53.906 67.069 42.136 1.00 12.81 B -ATOM 1063 N VAL B 18 54.974 70.101 48.285 1.00 5.53 B -ATOM 1064 CA VAL B 18 56.302 70.616 47.936 1.00 5.01 B -ATOM 1065 C VAL B 18 57.143 69.366 47.657 1.00 5.01 B -ATOM 1066 O VAL B 18 56.823 68.264 48.112 1.00 5.04 B -ATOM 1067 CB VAL B 18 56.929 71.510 48.995 1.00 5.59 B -ATOM 1068 CG1 VAL B 18 56.116 72.797 49.086 1.00 6.33 B -ATOM 1069 CG2 VAL B 18 57.091 70.825 50.342 1.00 6.00 B -ATOM 1070 N GLN B 19 58.244 69.553 46.945 1.00 4.48 B -ATOM 1071 CA GLN B 19 59.142 68.446 46.600 1.00 4.00 B -ATOM 1072 C GLN B 19 59.775 67.805 47.834 1.00 3.80 B -ATOM 1073 O GLN B 19 60.035 66.598 47.857 1.00 3.75 B -ATOM 1074 CB GLN B 19 60.267 68.895 45.663 1.00 5.03 B -ATOM 1075 CG GLN B 19 59.743 69.363 44.310 1.00 5.44 B -ATOM 1076 CD GLN B 19 60.837 70.048 43.542 1.00 5.87 B -ATOM 1077 OE1 GLN B 19 61.623 70.789 44.130 1.00 7.44 B -ATOM 1078 NE2 GLN B 19 60.896 69.850 42.220 1.00 6.86 B -ATOM 1079 N GLY B 20 60.101 68.629 48.826 1.00 4.08 B -ATOM 1080 CA GLY B 20 60.731 68.083 50.054 1.00 3.84 B -ATOM 1081 C GLY B 20 60.795 69.194 51.077 1.00 3.63 B -ATOM 1082 O GLY B 20 60.515 70.366 50.763 1.00 3.92 B -ATOM 1083 N VAL B 21 61.175 68.820 52.293 1.00 3.33 B -ATOM 1084 CA VAL B 21 61.313 69.766 53.390 1.00 3.95 B -ATOM 1085 C VAL B 21 62.676 69.576 54.047 1.00 3.79 B -ATOM 1086 O VAL B 21 63.146 68.449 54.224 1.00 4.94 B -ATOM 1087 CB VAL B 21 60.160 69.624 54.401 1.00 3.78 B -ATOM 1088 CG1 VAL B 21 58.864 70.091 53.754 1.00 4.83 B -ATOM 1089 CG2 VAL B 21 60.047 68.190 54.888 1.00 4.51 B -ATOM 1090 N ASP B 22 63.260 70.702 54.402 1.00 4.14 B -ATOM 1091 CA ASP B 22 64.566 70.749 55.097 1.00 4.70 B -ATOM 1092 C ASP B 22 64.213 71.148 56.528 1.00 4.45 B -ATOM 1093 O ASP B 22 63.839 72.315 56.763 1.00 5.58 B -ATOM 1094 CB ASP B 22 65.504 71.720 54.398 1.00 6.22 B -ATOM 1095 CG ASP B 22 66.810 71.968 55.106 1.00 7.08 B -ATOM 1096 OD1 ASP B 22 67.693 72.601 54.461 1.00 8.97 B -ATOM 1097 OD2 ASP B 22 66.976 71.563 56.249 1.00 7.76 B -ATOM 1098 N LEU B 23 64.305 70.241 57.471 1.00 4.71 B -ATOM 1099 CA LEU B 23 63.966 70.471 58.871 1.00 5.58 B -ATOM 1100 C LEU B 23 65.149 70.823 59.745 1.00 6.38 B -ATOM 1101 O LEU B 23 64.983 70.882 60.979 1.00 8.55 B -ATOM 1102 CB LEU B 23 63.270 69.193 59.403 1.00 5.54 B -ATOM 1103 CG LEU B 23 62.154 68.674 58.507 1.00 6.24 B -ATOM 1104 CD1 LEU B 23 61.512 67.451 59.178 1.00 6.77 B -ATOM 1105 CD2 LEU B 23 61.054 69.707 58.259 1.00 6.93 B -ATOM 1106 N GLY B 24 66.286 71.039 59.166 1.00 6.72 B -ATOM 1107 CA GLY B 24 67.523 71.338 59.920 1.00 7.67 B -ATOM 1108 C GLY B 24 68.400 70.084 59.707 1.00 7.60 B -ATOM 1109 O GLY B 24 68.942 69.915 58.600 1.00 8.31 B -ATOM 1110 N ASN B 25 68.474 69.248 60.704 1.00 7.01 B -ATOM 1111 CA ASN B 25 69.301 68.036 60.524 1.00 7.87 B -ATOM 1112 C ASN B 25 68.622 67.049 59.570 1.00 7.17 B -ATOM 1113 O ASN B 25 69.317 66.371 58.790 1.00 7.79 B -ATOM 1114 CB ASN B 25 69.507 67.343 61.872 1.00 9.22 B -ATOM 1115 CG ASN B 25 70.393 66.113 61.713 1.00 10.32 B -ATOM 1116 OD1 ASN B 25 71.506 66.200 61.175 1.00 12.32 B -ATOM 1117 ND2 ASN B 25 69.869 64.967 62.167 1.00 11.31 B -ATOM 1118 N MET B 26 67.320 66.912 59.596 1.00 6.21 B -ATOM 1119 CA MET B 26 66.599 65.949 58.766 1.00 5.60 B -ATOM 1120 C MET B 26 65.937 66.583 57.556 1.00 5.14 B -ATOM 1121 O MET B 26 65.301 67.653 57.663 1.00 5.60 B -ATOM 1122 CB MET B 26 65.517 65.295 59.657 1.00 6.37 B -ATOM 1123 CG MET B 26 64.822 64.201 58.892 1.00 7.10 B -ATOM 1124 SD MET B 26 63.718 63.237 59.952 1.00 8.83 B -ATOM 1125 CE MET B 26 64.935 62.195 60.817 1.00 9.98 B -ATOM 1126 N ILE B 27 66.080 65.904 56.435 1.00 4.19 B -ATOM 1127 CA ILE B 27 65.439 66.272 55.172 1.00 4.28 B -ATOM 1128 C ILE B 27 64.446 65.142 54.845 1.00 3.82 B -ATOM 1129 O ILE B 27 64.828 63.960 54.992 1.00 3.92 B -ATOM 1130 CB ILE B 27 66.521 66.370 54.038 1.00 6.29 B -ATOM 1131 CG1 ILE B 27 67.247 67.744 54.078 1.00 7.15 B -ATOM 1132 CG2 ILE B 27 65.945 66.085 52.630 1.00 7.40 B -ATOM 1133 CD1 ILE B 27 67.892 68.089 55.432 1.00 7.34 B -ATOM 1134 N ILE B 28 63.256 65.496 54.416 1.00 3.50 B -ATOM 1135 CA ILE B 28 62.289 64.494 54.000 1.00 3.86 B -ATOM 1136 C ILE B 28 61.811 64.841 52.595 1.00 3.50 B -ATOM 1137 O ILE B 28 61.387 66.009 52.349 1.00 4.39 B -ATOM 1138 CB ILE B 28 61.051 64.397 54.955 1.00 4.84 B -ATOM 1139 CG1 ILE B 28 61.518 64.271 56.417 1.00 5.31 B -ATOM 1140 CG2 ILE B 28 60.136 63.234 54.508 1.00 5.87 B -ATOM 1141 CD1 ILE B 28 60.336 64.133 57.405 1.00 5.89 B -ATOM 1142 N THR B 29 61.836 63.885 51.698 1.00 3.96 B -ATOM 1143 CA THR B 29 61.295 64.117 50.363 1.00 4.14 B -ATOM 1144 C THR B 29 59.858 63.625 50.241 1.00 3.59 B -ATOM 1145 O THR B 29 59.398 62.751 50.957 1.00 4.36 B -ATOM 1146 CB THR B 29 62.148 63.402 49.229 1.00 4.08 B -ATOM 1147 OG1 THR B 29 61.797 62.003 49.151 1.00 3.82 B -ATOM 1148 CG2 THR B 29 63.662 63.547 49.413 1.00 4.97 B -ATOM 1149 N SER B 30 59.184 64.195 49.245 1.00 3.82 B -ATOM 1150 CA SER B 30 57.896 63.673 48.819 1.00 3.64 B -ATOM 1151 C SER B 30 58.225 62.342 48.083 1.00 3.76 B -ATOM 1152 O SER B 30 59.377 62.094 47.678 1.00 4.49 B -ATOM 1153 CB SER B 30 57.269 64.615 47.782 1.00 3.92 B -ATOM 1154 OG SER B 30 56.635 65.679 48.466 1.00 4.47 B -ATOM 1155 N GLY B 31 57.202 61.521 47.915 1.00 3.83 B -ATOM 1156 CA GLY B 31 57.299 60.254 47.176 1.00 4.29 B -ATOM 1157 C GLY B 31 57.583 60.617 45.727 1.00 4.32 B -ATOM 1158 O GLY B 31 56.714 61.268 45.108 1.00 6.10 B -ATOM 1159 N GLN B 32 58.708 60.248 45.164 1.00 3.41 B -ATOM 1160 CA GLN B 32 59.085 60.581 43.789 1.00 3.93 B -ATOM 1161 C GLN B 32 58.647 59.469 42.841 1.00 3.99 B -ATOM 1162 O GLN B 32 58.943 58.292 43.019 1.00 4.71 B -ATOM 1163 CB GLN B 32 60.603 60.781 43.678 1.00 4.22 B -ATOM 1164 CG GLN B 32 61.116 61.955 44.494 1.00 3.95 B -ATOM 1165 CD GLN B 32 60.387 63.233 44.181 1.00 4.74 B -ATOM 1166 OE1 GLN B 32 60.399 63.674 43.025 1.00 5.56 B -ATOM 1167 NE2 GLN B 32 59.688 63.775 45.179 1.00 4.99 B -ATOM 1168 N ILE B 33 58.014 59.924 41.772 1.00 5.20 B -ATOM 1169 CA ILE B 33 57.594 59.037 40.684 1.00 5.52 B -ATOM 1170 C ILE B 33 58.558 59.277 39.527 1.00 5.61 B -ATOM 1171 O ILE B 33 59.271 60.308 39.471 1.00 5.33 B -ATOM 1172 CB ILE B 33 56.109 59.247 40.335 1.00 6.50 B -ATOM 1173 CG1 ILE B 33 55.811 60.720 39.958 1.00 7.36 B -ATOM 1174 CG2 ILE B 33 55.181 58.775 41.489 1.00 7.63 B -ATOM 1175 CD1 ILE B 33 54.422 60.854 39.290 1.00 8.30 B -ATOM 1176 N PRO B 34 58.600 58.333 38.606 1.00 5.57 B -ATOM 1177 CA PRO B 34 59.576 58.367 37.522 1.00 5.47 B -ATOM 1178 C PRO B 34 59.282 59.321 36.371 1.00 5.79 B -ATOM 1179 O PRO B 34 59.360 58.907 35.192 1.00 7.27 B -ATOM 1180 CB PRO B 34 59.664 56.914 37.030 1.00 5.88 B -ATOM 1181 CG PRO B 34 58.276 56.396 37.325 1.00 6.23 B -ATOM 1182 CD PRO B 34 57.937 57.019 38.678 1.00 5.26 B -ATOM 1183 N VAL B 35 58.985 60.555 36.721 1.00 5.68 B -ATOM 1184 CA VAL B 35 58.775 61.601 35.706 1.00 6.40 B -ATOM 1185 C VAL B 35 60.117 62.295 35.492 1.00 5.88 B -ATOM 1186 O VAL B 35 60.824 62.677 36.425 1.00 5.93 B -ATOM 1187 CB VAL B 35 57.731 62.615 36.200 1.00 7.54 B -ATOM 1188 CG1 VAL B 35 57.671 63.850 35.300 1.00 7.74 B -ATOM 1189 CG2 VAL B 35 56.376 61.976 36.356 1.00 7.73 B -ATOM 1190 N ASN B 36 60.449 62.453 34.209 1.00 6.56 B -ATOM 1191 CA ASN B 36 61.711 63.134 33.832 1.00 7.61 B -ATOM 1192 C ASN B 36 61.509 64.632 34.009 1.00 7.47 B -ATOM 1193 O ASN B 36 60.575 65.195 33.398 1.00 8.51 B -ATOM 1194 CB ASN B 36 62.016 62.735 32.397 1.00 9.42 B -ATOM 1195 CG ASN B 36 63.262 63.346 31.815 1.00 11.61 B -ATOM 1196 OD1 ASN B 36 63.471 64.567 31.911 1.00 12.84 B -ATOM 1197 ND2 ASN B 36 64.047 62.500 31.143 1.00 12.39 B -ATOM 1198 N PRO B 37 62.330 65.329 34.757 1.00 7.10 B -ATOM 1199 CA PRO B 37 62.151 66.766 34.975 1.00 8.07 B -ATOM 1200 C PRO B 37 62.412 67.622 33.759 1.00 8.69 B -ATOM 1201 O PRO B 37 62.001 68.790 33.731 1.00 9.39 B -ATOM 1202 CB PRO B 37 63.114 67.097 36.114 1.00 8.93 B -ATOM 1203 CG PRO B 37 64.190 66.064 35.942 1.00 9.33 B -ATOM 1204 CD PRO B 37 63.459 64.793 35.519 1.00 8.45 B -ATOM 1205 N LYS B 38 63.140 67.088 32.797 1.00 9.24 B -ATOM 1206 CA LYS B 38 63.446 67.841 31.560 1.00 11.17 B -ATOM 1207 C LYS B 38 62.270 67.772 30.604 1.00 11.35 B -ATOM 1208 O LYS B 38 61.908 68.821 30.007 1.00 12.18 B -ATOM 1209 CB LYS B 38 64.682 67.259 30.905 1.00 12.66 B -ATOM 1210 CG LYS B 38 65.260 67.972 29.693 1.00 13.74 B -ATOM 1211 CD LYS B 38 66.600 67.360 29.220 1.00 14.42 B -ATOM 1212 CE LYS B 38 67.638 67.528 30.156 1.00 17.20 B -ATOM 1213 NZ LYS B 38 67.909 68.973 30.401 1.00 18.80 B -ATOM 1214 N THR B 39 61.667 66.605 30.410 1.00 11.29 B -ATOM 1215 CA THR B 39 60.585 66.426 29.447 1.00 11.38 B -ATOM 1216 C THR B 39 59.192 66.161 29.945 1.00 11.67 B -ATOM 1217 O THR B 39 58.231 66.283 29.146 1.00 12.12 B -ATOM 1218 CB THR B 39 60.967 65.202 28.498 1.00 11.46 B -ATOM 1219 OG1 THR B 39 60.899 64.024 29.377 1.00 11.47 B -ATOM 1220 CG2 THR B 39 62.342 65.321 27.870 1.00 12.27 B -ATOM 1221 N GLY B 40 59.069 65.724 31.191 1.00 11.14 B -ATOM 1222 CA GLY B 40 57.763 65.397 31.757 1.00 11.25 B -ATOM 1223 C GLY B 40 57.343 63.969 31.414 1.00 11.36 B -ATOM 1224 O GLY B 40 56.264 63.543 31.858 1.00 12.70 B -ATOM 1225 N GLU B 41 58.149 63.248 30.667 1.00 11.11 B -ATOM 1226 CA GLU B 41 57.815 61.871 30.278 1.00 11.71 B -ATOM 1227 C GLU B 41 58.245 60.833 31.296 1.00 10.19 B -ATOM 1228 O GLU B 41 59.139 61.111 32.099 1.00 10.11 B -ATOM 1229 CB GLU B 41 58.517 61.534 28.947 1.00 13.86 B -ATOM 1230 CG GLU B 41 57.967 62.414 27.808 1.00 16.75 B -ATOM 1231 CD GLU B 41 58.606 62.196 26.469 1.00 18.82 B -ATOM 1232 OE1 GLU B 41 59.711 61.693 26.338 1.00 19.76 B -ATOM 1233 OE2 GLU B 41 57.848 62.618 25.559 1.00 20.70 B -ATOM 1234 N VAL B 42 57.633 59.670 31.202 1.00 9.39 B -ATOM 1235 CA VAL B 42 57.933 58.529 32.092 1.00 8.66 B -ATOM 1236 C VAL B 42 58.479 57.415 31.207 1.00 8.84 B -ATOM 1237 O VAL B 42 57.758 57.073 30.227 1.00 8.91 B -ATOM 1238 CB VAL B 42 56.643 58.081 32.799 1.00 8.81 B -ATOM 1239 CG1 VAL B 42 56.885 56.777 33.559 1.00 8.55 B -ATOM 1240 CG2 VAL B 42 56.120 59.169 33.725 1.00 9.11 B -ATOM 1241 N PRO B 43 59.617 56.877 31.514 1.00 8.44 B -ATOM 1242 CA PRO B 43 60.210 55.791 30.715 1.00 9.28 B -ATOM 1243 C PRO B 43 59.367 54.546 30.918 1.00 9.79 B -ATOM 1244 O PRO B 43 58.768 54.342 32.000 1.00 9.85 B -ATOM 1245 CB PRO B 43 61.650 55.701 31.207 1.00 9.38 B -ATOM 1246 CG PRO B 43 61.567 56.141 32.652 1.00 9.11 B -ATOM 1247 CD PRO B 43 60.480 57.216 32.661 1.00 8.87 B -ATOM 1248 N ALA B 44 59.303 53.711 29.882 1.00 11.00 B -ATOM 1249 CA ALA B 44 58.508 52.480 29.932 1.00 11.90 B -ATOM 1250 C ALA B 44 59.042 51.404 30.874 1.00 12.03 B -ATOM 1251 O ALA B 44 58.329 50.802 31.691 1.00 13.47 B -ATOM 1252 CB ALA B 44 58.433 51.963 28.484 1.00 12.50 B -ATOM 1253 N ASP B 45 60.303 51.148 30.762 1.00 11.52 B -ATOM 1254 CA ASP B 45 61.135 50.149 31.428 1.00 11.81 B -ATOM 1255 C ASP B 45 61.109 50.292 32.946 1.00 10.80 B -ATOM 1256 O ASP B 45 61.365 51.424 33.415 1.00 9.73 B -ATOM 1257 CB ASP B 45 62.522 50.311 30.749 1.00 12.76 B -ATOM 1258 CG ASP B 45 63.505 49.304 31.268 1.00 14.25 B -ATOM 1259 OD1 ASP B 45 64.292 49.667 32.157 1.00 13.77 B -ATOM 1260 OD2 ASP B 45 63.527 48.132 30.805 1.00 15.41 B -ATOM 1261 N VAL B 46 60.863 49.235 33.695 1.00 10.67 B -ATOM 1262 CA VAL B 46 60.837 49.368 35.167 1.00 9.52 B -ATOM 1263 C VAL B 46 62.188 49.754 35.756 1.00 7.84 B -ATOM 1264 O VAL B 46 62.245 50.509 36.743 1.00 7.66 B -ATOM 1265 CB VAL B 46 60.208 48.136 35.839 1.00 10.26 B -ATOM 1266 CG1 VAL B 46 61.046 46.877 35.681 1.00 10.79 B -ATOM 1267 CG2 VAL B 46 59.868 48.431 37.284 1.00 10.65 B -ATOM 1268 N ALA B 47 63.265 49.237 35.185 1.00 7.55 B -ATOM 1269 CA ALA B 47 64.600 49.612 35.697 1.00 7.95 B -ATOM 1270 C ALA B 47 64.795 51.114 35.497 1.00 7.45 B -ATOM 1271 O ALA B 47 65.283 51.831 36.408 1.00 7.40 B -ATOM 1272 CB ALA B 47 65.692 48.813 35.003 1.00 8.33 B -ATOM 1273 N ALA B 48 64.432 51.602 34.327 1.00 6.86 B -ATOM 1274 CA ALA B 48 64.567 53.034 34.040 1.00 6.14 B -ATOM 1275 C ALA B 48 63.666 53.826 34.976 1.00 5.74 B -ATOM 1276 O ALA B 48 64.063 54.919 35.401 1.00 5.87 B -ATOM 1277 CB ALA B 48 64.257 53.277 32.576 1.00 6.39 B -ATOM 1278 N GLN B 49 62.494 53.331 35.270 1.00 5.59 B -ATOM 1279 CA GLN B 49 61.597 54.043 36.209 1.00 5.03 B -ATOM 1280 C GLN B 49 62.247 54.116 37.590 1.00 4.68 B -ATOM 1281 O GLN B 49 62.234 55.172 38.233 1.00 5.23 B -ATOM 1282 CB GLN B 49 60.225 53.385 36.255 1.00 5.71 B -ATOM 1283 CG GLN B 49 59.395 53.671 34.994 1.00 6.17 B -ATOM 1284 CD GLN B 49 57.921 53.381 35.202 1.00 5.93 B -ATOM 1285 OE1 GLN B 49 57.420 53.335 36.340 1.00 5.99 B -ATOM 1286 NE2 GLN B 49 57.175 53.220 34.110 1.00 6.38 B -ATOM 1287 N ALA B 50 62.786 52.982 38.029 1.00 4.71 B -ATOM 1288 CA ALA B 50 63.431 53.010 39.364 1.00 4.54 B -ATOM 1289 C ALA B 50 64.554 54.046 39.396 1.00 4.94 B -ATOM 1290 O ALA B 50 64.694 54.833 40.349 1.00 4.87 B -ATOM 1291 CB ALA B 50 63.973 51.649 39.764 1.00 5.66 B -ATOM 1292 N ARG B 51 65.338 54.078 38.327 1.00 5.38 B -ATOM 1293 CA ARG B 51 66.439 55.051 38.260 1.00 5.49 B -ATOM 1294 C ARG B 51 65.950 56.478 38.200 1.00 5.04 B -ATOM 1295 O ARG B 51 66.565 57.349 38.845 1.00 6.12 B -ATOM 1296 CB ARG B 51 67.419 54.730 37.136 1.00 6.73 B -ATOM 1297 CG ARG B 51 68.640 55.631 37.074 1.00 7.56 B -ATOM 1298 CD ARG B 51 69.722 55.064 36.205 1.00 8.32 B -ATOM 1299 NE ARG B 51 70.418 53.902 36.735 1.00 8.95 B -ATOM 1300 CZ ARG B 51 71.442 53.925 37.601 1.00 9.18 B -ATOM 1301 NH1 ARG B 51 71.924 55.070 38.084 1.00 8.39 B -ATOM 1302 NH2 ARG B 51 71.993 52.772 37.999 1.00 10.81 B -ATOM 1303 N GLN B 52 64.896 56.762 37.460 1.00 4.75 B -ATOM 1304 CA GLN B 52 64.365 58.134 37.375 1.00 4.61 B -ATOM 1305 C GLN B 52 63.848 58.546 38.755 1.00 4.34 B -ATOM 1306 O GLN B 52 64.060 59.715 39.161 1.00 4.87 B -ATOM 1307 CB GLN B 52 63.303 58.235 36.296 1.00 5.74 B -ATOM 1308 CG GLN B 52 62.806 59.657 36.148 1.00 5.80 B -ATOM 1309 CD GLN B 52 63.854 60.622 35.679 1.00 6.30 B -ATOM 1310 OE1 GLN B 52 64.133 60.690 34.471 1.00 7.97 B -ATOM 1311 NE2 GLN B 52 64.428 61.386 36.576 1.00 7.04 B -ATOM 1312 N SER B 53 63.125 57.667 39.438 1.00 4.36 B -ATOM 1313 CA SER B 53 62.658 58.016 40.796 1.00 4.64 B -ATOM 1314 C SER B 53 63.831 58.319 41.730 1.00 4.34 B -ATOM 1315 O SER B 53 63.783 59.298 42.486 1.00 4.42 B -ATOM 1316 CB SER B 53 61.801 56.895 41.346 1.00 5.03 B -ATOM 1317 OG SER B 53 60.480 56.920 40.874 1.00 7.71 B -ATOM 1318 N LEU B 54 64.858 57.494 41.672 1.00 4.12 B -ATOM 1319 CA LEU B 54 66.053 57.715 42.501 1.00 4.70 B -ATOM 1320 C LEU B 54 66.747 59.020 42.130 1.00 3.93 B -ATOM 1321 O LEU B 54 67.222 59.740 43.026 1.00 4.71 B -ATOM 1322 CB LEU B 54 66.961 56.508 42.407 1.00 5.03 B -ATOM 1323 CG LEU B 54 66.430 55.288 43.166 1.00 5.82 B -ATOM 1324 CD1 LEU B 54 67.223 54.045 42.760 1.00 5.88 B -ATOM 1325 CD2 LEU B 54 66.492 55.463 44.673 1.00 6.70 B -ATOM 1326 N ASP B 55 66.819 59.334 40.853 1.00 4.46 B -ATOM 1327 CA ASP B 55 67.461 60.595 40.440 1.00 4.76 B -ATOM 1328 C ASP B 55 66.648 61.777 40.976 1.00 5.09 B -ATOM 1329 O ASP B 55 67.240 62.801 41.316 1.00 4.83 B -ATOM 1330 CB ASP B 55 67.603 60.620 38.926 1.00 6.75 B -ATOM 1331 CG ASP B 55 68.831 59.894 38.396 1.00 8.66 B -ATOM 1332 OD1 ASP B 55 68.842 59.457 37.229 1.00 10.67 B -ATOM 1333 OD2 ASP B 55 69.804 59.813 39.156 1.00 10.74 B -ATOM 1334 N ASN B 56 65.338 61.607 40.966 1.00 4.45 B -ATOM 1335 CA ASN B 56 64.473 62.713 41.477 1.00 3.71 B -ATOM 1336 C ASN B 56 64.745 62.874 42.971 1.00 3.25 B -ATOM 1337 O ASN B 56 64.821 64.018 43.473 1.00 4.24 B -ATOM 1338 CB ASN B 56 62.994 62.455 41.182 1.00 4.47 B -ATOM 1339 CG ASN B 56 62.707 62.655 39.696 1.00 4.53 B -ATOM 1340 OD1 ASN B 56 63.521 63.249 38.956 1.00 5.62 B -ATOM 1341 ND2 ASN B 56 61.580 62.124 39.213 1.00 4.94 B -ATOM 1342 N VAL B 57 64.803 61.766 43.710 1.00 4.41 B -ATOM 1343 CA VAL B 57 65.125 61.842 45.156 1.00 4.09 B -ATOM 1344 C VAL B 57 66.462 62.535 45.322 1.00 3.73 B -ATOM 1345 O VAL B 57 66.644 63.454 46.150 1.00 4.05 B -ATOM 1346 CB VAL B 57 65.167 60.449 45.777 1.00 4.49 B -ATOM 1347 CG1 VAL B 57 65.858 60.478 47.143 1.00 5.66 B -ATOM 1348 CG2 VAL B 57 63.791 59.829 45.886 1.00 5.00 B -ATOM 1349 N LYS B 58 67.461 62.121 44.563 1.00 3.78 B -ATOM 1350 CA LYS B 58 68.814 62.701 44.626 1.00 4.51 B -ATOM 1351 C LYS B 58 68.786 64.200 44.385 1.00 4.64 B -ATOM 1352 O LYS B 58 69.453 64.970 45.078 1.00 4.91 B -ATOM 1353 CB LYS B 58 69.685 62.023 43.566 1.00 5.87 B -ATOM 1354 CG LYS B 58 71.037 62.715 43.368 1.00 6.61 B -ATOM 1355 CD LYS B 58 71.911 61.914 42.422 1.00 8.95 B -ATOM 1356 CE LYS B 58 73.036 62.736 41.827 1.00 9.79 B -ATOM 1357 NZ LYS B 58 73.903 61.926 40.944 1.00 10.97 B -ATOM 1358 N ALA B 59 68.027 64.648 43.393 1.00 4.57 B -ATOM 1359 CA ALA B 59 67.955 66.089 43.097 1.00 4.83 B -ATOM 1360 C ALA B 59 67.483 66.884 44.313 1.00 4.63 B -ATOM 1361 O ALA B 59 67.996 67.993 44.584 1.00 4.41 B -ATOM 1362 CB ALA B 59 67.000 66.337 41.941 1.00 5.64 B -ATOM 1363 N ILE B 60 66.485 66.365 45.015 1.00 4.27 B -ATOM 1364 CA ILE B 60 65.916 67.056 46.183 1.00 4.66 B -ATOM 1365 C ILE B 60 66.898 67.056 47.337 1.00 3.81 B -ATOM 1366 O ILE B 60 67.079 68.071 48.023 1.00 4.20 B -ATOM 1367 CB ILE B 60 64.546 66.403 46.509 1.00 4.36 B -ATOM 1368 CG1 ILE B 60 63.588 66.623 45.317 1.00 4.56 B -ATOM 1369 CG2 ILE B 60 63.966 66.941 47.835 1.00 4.23 B -ATOM 1370 CD1 ILE B 60 62.373 65.655 45.375 1.00 5.34 B -ATOM 1371 N VAL B 61 67.504 65.896 47.603 1.00 3.65 B -ATOM 1372 CA VAL B 61 68.511 65.787 48.677 1.00 4.56 B -ATOM 1373 C VAL B 61 69.698 66.702 48.400 1.00 4.22 B -ATOM 1374 O VAL B 61 70.160 67.411 49.299 1.00 4.43 B -ATOM 1375 CB VAL B 61 68.907 64.309 48.830 1.00 4.74 B -ATOM 1376 CG1 VAL B 61 70.122 64.101 49.722 1.00 5.69 B -ATOM 1377 CG2 VAL B 61 67.725 63.493 49.318 1.00 5.47 B -ATOM 1378 N GLU B 62 70.151 66.723 47.153 1.00 4.43 B -ATOM 1379 CA GLU B 62 71.288 67.592 46.812 1.00 4.95 B -ATOM 1380 C GLU B 62 70.885 69.052 46.887 1.00 5.30 B -ATOM 1381 O GLU B 62 71.723 69.907 47.256 1.00 5.38 B -ATOM 1382 CB GLU B 62 71.893 67.274 45.453 1.00 5.58 B -ATOM 1383 CG GLU B 62 72.586 65.906 45.458 1.00 7.08 B -ATOM 1384 CD GLU B 62 73.352 65.533 44.237 1.00 8.46 B -ATOM 1385 OE1 GLU B 62 74.252 64.697 44.288 1.00 10.06 B -ATOM 1386 OE2 GLU B 62 73.067 66.109 43.157 1.00 10.50 B -ATOM 1387 N ALA B 63 69.650 69.401 46.584 1.00 5.02 B -ATOM 1388 CA ALA B 63 69.190 70.802 46.655 1.00 4.80 B -ATOM 1389 C ALA B 63 69.229 71.281 48.101 1.00 4.67 B -ATOM 1390 O ALA B 63 69.284 72.498 48.351 1.00 5.23 B -ATOM 1391 CB ALA B 63 67.832 70.900 46.025 1.00 4.87 B -ATOM 1392 N ALA B 64 69.195 70.374 49.063 1.00 4.95 B -ATOM 1393 CA ALA B 64 69.277 70.725 50.469 1.00 5.12 B -ATOM 1394 C ALA B 64 70.720 70.686 50.966 1.00 5.56 B -ATOM 1395 O ALA B 64 70.916 70.844 52.193 1.00 6.36 B -ATOM 1396 CB ALA B 64 68.378 69.816 51.305 1.00 6.01 B -ATOM 1397 N GLY B 65 71.682 70.458 50.111 1.00 5.32 B -ATOM 1398 CA GLY B 65 73.092 70.438 50.514 1.00 5.69 B -ATOM 1399 C GLY B 65 73.563 69.073 50.980 1.00 5.00 B -ATOM 1400 O GLY B 65 74.662 69.029 51.580 1.00 6.60 B -ATOM 1401 N LEU B 66 72.813 68.006 50.731 1.00 4.89 B -ATOM 1402 CA LEU B 66 73.201 66.660 51.180 1.00 5.10 B -ATOM 1403 C LEU B 66 73.579 65.820 49.989 1.00 5.52 B -ATOM 1404 O LEU B 66 73.428 66.215 48.832 1.00 6.12 B -ATOM 1405 CB LEU B 66 72.059 66.064 52.009 1.00 5.47 B -ATOM 1406 CG LEU B 66 71.886 66.729 53.366 1.00 7.05 B -ATOM 1407 CD1 LEU B 66 70.805 65.995 54.150 1.00 7.79 B -ATOM 1408 CD2 LEU B 66 73.209 66.813 54.124 1.00 8.50 B -ATOM 1409 N LYS B 67 74.007 64.601 50.268 1.00 5.84 B -ATOM 1410 CA LYS B 67 74.408 63.637 49.228 1.00 6.22 B -ATOM 1411 C LYS B 67 73.532 62.402 49.343 1.00 5.40 B -ATOM 1412 O LYS B 67 72.892 62.130 50.377 1.00 5.50 B -ATOM 1413 CB LYS B 67 75.855 63.194 49.489 1.00 8.08 B -ATOM 1414 CG LYS B 67 76.860 64.348 49.479 1.00 10.38 B -ATOM 1415 CD LYS B 67 78.259 63.839 49.838 1.00 13.10 B -ATOM 1416 CE LYS B 67 79.272 64.978 49.778 1.00 14.74 B -ATOM 1417 NZ LYS B 67 80.648 64.415 49.892 1.00 16.76 B -ATOM 1418 N VAL B 68 73.571 61.611 48.260 1.00 5.45 B -ATOM 1419 CA VAL B 68 72.874 60.318 48.274 1.00 5.05 B -ATOM 1420 C VAL B 68 73.341 59.513 49.501 1.00 5.56 B -ATOM 1421 O VAL B 68 72.512 58.804 50.091 1.00 5.83 B -ATOM 1422 CB VAL B 68 73.124 59.566 46.958 1.00 5.97 B -ATOM 1423 CG1 VAL B 68 72.733 58.097 47.047 1.00 6.44 B -ATOM 1424 CG2 VAL B 68 72.484 60.292 45.781 1.00 7.15 B -ATOM 1425 N GLY B 69 74.607 59.620 49.861 1.00 5.71 B -ATOM 1426 CA GLY B 69 75.148 58.890 51.014 1.00 6.22 B -ATOM 1427 C GLY B 69 74.533 59.314 52.347 1.00 5.67 B -ATOM 1428 O GLY B 69 74.754 58.601 53.347 1.00 6.75 B -ATOM 1429 N ASP B 70 73.824 60.435 52.380 1.00 4.83 B -ATOM 1430 CA ASP B 70 73.148 60.912 53.599 1.00 5.11 B -ATOM 1431 C ASP B 70 71.723 60.358 53.725 1.00 4.14 B -ATOM 1432 O ASP B 70 71.075 60.662 54.733 1.00 4.50 B -ATOM 1433 CB ASP B 70 73.177 62.438 53.647 1.00 5.29 B -ATOM 1434 CG ASP B 70 74.595 63.006 53.641 1.00 6.10 B -ATOM 1435 OD1 ASP B 70 74.820 63.965 52.875 1.00 6.91 B -ATOM 1436 OD2 ASP B 70 75.421 62.444 54.367 1.00 6.71 B -ATOM 1437 N ILE B 71 71.273 59.653 52.727 1.00 4.31 B -ATOM 1438 CA ILE B 71 69.910 59.080 52.803 1.00 4.32 B -ATOM 1439 C ILE B 71 69.964 57.903 53.793 1.00 3.98 B -ATOM 1440 O ILE B 71 70.796 57.004 53.583 1.00 5.01 B -ATOM 1441 CB ILE B 71 69.417 58.633 51.394 1.00 4.70 B -ATOM 1442 CG1 ILE B 71 69.260 59.861 50.449 1.00 4.36 B -ATOM 1443 CG2 ILE B 71 68.095 57.847 51.552 1.00 4.30 B -ATOM 1444 CD1 ILE B 71 69.090 59.494 48.952 1.00 4.71 B -ATOM 1445 N VAL B 72 69.082 57.918 54.776 1.00 3.47 B -ATOM 1446 CA VAL B 72 69.101 56.889 55.822 1.00 3.99 B -ATOM 1447 C VAL B 72 67.872 56.023 55.826 1.00 3.90 B -ATOM 1448 O VAL B 72 67.929 54.930 56.434 1.00 4.27 B -ATOM 1449 CB VAL B 72 69.355 57.550 57.201 1.00 4.41 B -ATOM 1450 CG1 VAL B 72 70.752 58.134 57.263 1.00 5.07 B -ATOM 1451 CG2 VAL B 72 68.283 58.575 57.520 1.00 5.77 B -ATOM 1452 N LYS B 73 66.779 56.414 55.155 1.00 3.52 B -ATOM 1453 CA LYS B 73 65.579 55.571 55.125 1.00 4.16 B -ATOM 1454 C LYS B 73 64.797 55.868 53.841 1.00 4.31 B -ATOM 1455 O LYS B 73 64.631 57.077 53.541 1.00 4.84 B -ATOM 1456 CB LYS B 73 64.647 55.893 56.294 1.00 5.02 B -ATOM 1457 CG LYS B 73 63.285 55.194 56.361 1.00 5.28 B -ATOM 1458 CD LYS B 73 63.319 53.682 56.411 1.00 5.37 B -ATOM 1459 CE LYS B 73 61.976 53.030 56.630 1.00 6.08 B -ATOM 1460 NZ LYS B 73 60.916 53.409 55.657 1.00 6.35 B -ATOM 1461 N THR B 74 64.350 54.825 53.193 1.00 3.73 B -ATOM 1462 CA THR B 74 63.456 55.013 52.052 1.00 3.85 B -ATOM 1463 C THR B 74 62.249 54.103 52.262 1.00 3.84 B -ATOM 1464 O THR B 74 62.260 53.119 53.017 1.00 3.85 B -ATOM 1465 CB THR B 74 64.155 54.626 50.705 1.00 4.06 B -ATOM 1466 OG1 THR B 74 64.451 53.208 50.782 1.00 4.62 B -ATOM 1467 CG2 THR B 74 65.381 55.461 50.387 1.00 4.69 B -ATOM 1468 N THR B 75 61.192 54.460 51.537 1.00 3.73 B -ATOM 1469 CA THR B 75 60.053 53.559 51.389 1.00 4.09 B -ATOM 1470 C THR B 75 59.881 53.439 49.849 1.00 4.02 B -ATOM 1471 O THR B 75 59.787 54.483 49.180 1.00 4.60 B -ATOM 1472 CB THR B 75 58.716 53.947 52.052 1.00 5.33 B -ATOM 1473 OG1 THR B 75 59.053 53.995 53.481 1.00 6.90 B -ATOM 1474 CG2 THR B 75 57.597 52.938 51.782 1.00 6.26 B -ATOM 1475 N VAL B 76 59.859 52.221 49.388 1.00 3.79 B -ATOM 1476 CA VAL B 76 59.705 51.923 47.970 1.00 4.37 B -ATOM 1477 C VAL B 76 58.362 51.232 47.772 1.00 4.23 B -ATOM 1478 O VAL B 76 58.120 50.109 48.259 1.00 5.09 B -ATOM 1479 CB VAL B 76 60.873 51.017 47.518 1.00 5.09 B -ATOM 1480 CG1 VAL B 76 60.718 50.674 46.034 1.00 6.10 B -ATOM 1481 CG2 VAL B 76 62.256 51.642 47.745 1.00 5.44 B -ATOM 1482 N PHE B 77 57.500 51.943 47.079 1.00 3.73 B -ATOM 1483 CA PHE B 77 56.152 51.434 46.755 1.00 4.03 B -ATOM 1484 C PHE B 77 56.221 50.948 45.307 1.00 3.31 B -ATOM 1485 O PHE B 77 56.607 51.785 44.458 1.00 5.04 B -ATOM 1486 CB PHE B 77 55.114 52.535 46.861 1.00 3.99 B -ATOM 1487 CG PHE B 77 55.025 53.226 48.187 1.00 3.46 B -ATOM 1488 CD1 PHE B 77 55.589 54.494 48.378 1.00 4.75 B -ATOM 1489 CD2 PHE B 77 54.338 52.632 49.243 1.00 4.57 B -ATOM 1490 CE1 PHE B 77 55.436 55.186 49.580 1.00 5.64 B -ATOM 1491 CE2 PHE B 77 54.208 53.314 50.457 1.00 5.55 B -ATOM 1492 CZ PHE B 77 54.721 54.585 50.626 1.00 5.75 B -ATOM 1493 N VAL B 78 55.872 49.713 45.018 1.00 3.70 B -ATOM 1494 CA VAL B 78 55.909 49.221 43.641 1.00 4.71 B -ATOM 1495 C VAL B 78 54.528 48.751 43.220 1.00 4.55 B -ATOM 1496 O VAL B 78 53.710 48.352 44.038 1.00 4.79 B -ATOM 1497 CB VAL B 78 56.948 48.100 43.447 1.00 5.00 B -ATOM 1498 CG1 VAL B 78 58.363 48.575 43.745 1.00 6.84 B -ATOM 1499 CG2 VAL B 78 56.648 46.861 44.287 1.00 5.75 B -ATOM 1500 N LYS B 79 54.334 48.753 41.906 1.00 5.21 B -ATOM 1501 CA LYS B 79 53.107 48.222 41.315 1.00 5.74 B -ATOM 1502 C LYS B 79 53.200 46.696 41.199 1.00 6.17 B -ATOM 1503 O LYS B 79 52.134 46.034 41.240 1.00 6.76 B -ATOM 1504 CB LYS B 79 52.842 48.840 39.956 1.00 6.81 B -ATOM 1505 CG LYS B 79 51.634 48.264 39.231 1.00 8.82 B -ATOM 1506 CD LYS B 79 50.323 48.396 39.989 1.00 10.71 B -ATOM 1507 CE LYS B 79 49.209 47.516 39.447 1.00 11.66 B -ATOM 1508 NZ LYS B 79 49.470 46.072 39.707 1.00 13.37 B -ATOM 1509 N ASP B 80 54.376 46.123 41.078 1.00 6.31 B -ATOM 1510 CA ASP B 80 54.487 44.661 40.898 1.00 6.74 B -ATOM 1511 C ASP B 80 55.764 44.088 41.474 1.00 6.52 B -ATOM 1512 O ASP B 80 56.841 44.340 40.896 1.00 7.52 B -ATOM 1513 CB ASP B 80 54.361 44.370 39.382 1.00 7.41 B -ATOM 1514 CG ASP B 80 54.297 42.895 39.052 1.00 8.15 B -ATOM 1515 OD1 ASP B 80 54.054 42.544 37.864 1.00 10.21 B -ATOM 1516 OD2 ASP B 80 54.466 42.034 39.923 1.00 8.03 B -ATOM 1517 N LEU B 81 55.668 43.364 42.574 1.00 6.91 B -ATOM 1518 CA LEU B 81 56.846 42.760 43.190 1.00 8.19 B -ATOM 1519 C LEU B 81 57.501 41.754 42.250 1.00 8.43 B -ATOM 1520 O LEU B 81 58.657 41.386 42.540 1.00 9.36 B -ATOM 1521 CB LEU B 81 56.573 42.188 44.569 1.00 8.43 B -ATOM 1522 CG LEU B 81 56.623 43.238 45.680 1.00 8.40 B -ATOM 1523 CD1 LEU B 81 56.024 42.606 46.935 1.00 9.27 B -ATOM 1524 CD2 LEU B 81 58.050 43.682 45.909 1.00 9.04 B -ATOM 1525 N ASN B 82 56.839 41.326 41.191 1.00 8.67 B -ATOM 1526 CA ASN B 82 57.540 40.394 40.271 1.00 9.87 B -ATOM 1527 C ASN B 82 58.691 41.113 39.557 1.00 10.44 B -ATOM 1528 O ASN B 82 59.592 40.434 39.033 1.00 11.63 B -ATOM 1529 CB ASN B 82 56.608 39.715 39.283 1.00 10.51 B -ATOM 1530 CG ASN B 82 55.772 38.642 39.992 1.00 10.87 B -ATOM 1531 OD1 ASN B 82 56.248 38.003 40.917 1.00 11.41 B -ATOM 1532 ND2 ASN B 82 54.538 38.505 39.530 1.00 11.83 B -ATOM 1533 N ASP B 83 58.688 42.430 39.542 1.00 10.73 B -ATOM 1534 CA ASP B 83 59.787 43.195 38.901 1.00 11.58 B -ATOM 1535 C ASP B 83 60.809 43.606 39.956 1.00 11.57 B -ATOM 1536 O ASP B 83 61.760 44.366 39.650 1.00 11.86 B -ATOM 1537 CB ASP B 83 59.225 44.409 38.174 1.00 12.86 B -ATOM 1538 CG ASP B 83 58.600 44.116 36.833 1.00 13.31 B -ATOM 1539 OD1 ASP B 83 57.683 44.833 36.447 1.00 14.31 B -ATOM 1540 OD2 ASP B 83 59.090 43.183 36.124 1.00 15.40 B -ATOM 1541 N PHE B 84 60.688 43.112 41.173 1.00 11.64 B -ATOM 1542 CA PHE B 84 61.630 43.566 42.211 1.00 12.27 B -ATOM 1543 C PHE B 84 63.088 43.200 42.034 1.00 11.14 B -ATOM 1544 O PHE B 84 63.933 43.995 42.522 1.00 10.67 B -ATOM 1545 CB PHE B 84 61.082 43.296 43.608 1.00 13.85 B -ATOM 1546 CG PHE B 84 61.435 44.457 44.516 1.00 15.36 B -ATOM 1547 CD1 PHE B 84 62.419 44.313 45.490 1.00 16.41 B -ATOM 1548 CD2 PHE B 84 60.771 45.675 44.347 1.00 15.95 B -ATOM 1549 CE1 PHE B 84 62.724 45.396 46.316 1.00 17.08 B -ATOM 1550 CE2 PHE B 84 61.074 46.757 45.182 1.00 16.89 B -ATOM 1551 CZ PHE B 84 62.051 46.612 46.170 1.00 16.95 B -ATOM 1552 N ALA B 85 63.448 42.102 41.392 1.00 10.77 B -ATOM 1553 CA ALA B 85 64.879 41.794 41.220 1.00 10.60 B -ATOM 1554 C ALA B 85 65.535 42.914 40.407 1.00 9.89 B -ATOM 1555 O ALA B 85 66.653 43.346 40.689 1.00 9.55 B -ATOM 1556 CB ALA B 85 65.072 40.425 40.575 1.00 11.44 B -ATOM 1557 N THR B 86 64.784 43.359 39.403 1.00 10.27 B -ATOM 1558 CA THR B 86 65.263 44.420 38.507 1.00 10.82 B -ATOM 1559 C THR B 86 65.418 45.740 39.247 1.00 9.25 B -ATOM 1560 O THR B 86 66.418 46.473 39.123 1.00 8.54 B -ATOM 1561 CB THR B 86 64.317 44.584 37.245 1.00 12.16 B -ATOM 1562 OG1 THR B 86 64.271 43.272 36.607 1.00 13.99 B -ATOM 1563 CG2 THR B 86 64.815 45.690 36.315 1.00 12.79 B -ATOM 1564 N VAL B 87 64.392 46.057 40.011 1.00 8.71 B -ATOM 1565 CA VAL B 87 64.395 47.289 40.822 1.00 8.40 B -ATOM 1566 C VAL B 87 65.555 47.232 41.809 1.00 7.98 B -ATOM 1567 O VAL B 87 66.265 48.236 41.965 1.00 8.35 B -ATOM 1568 CB VAL B 87 63.043 47.470 41.540 1.00 8.84 B -ATOM 1569 CG1 VAL B 87 63.167 48.539 42.621 1.00 9.19 B -ATOM 1570 CG2 VAL B 87 61.950 47.778 40.533 1.00 9.80 B -ATOM 1571 N ASN B 88 65.711 46.109 42.472 1.00 7.83 B -ATOM 1572 CA ASN B 88 66.775 45.933 43.463 1.00 9.07 B -ATOM 1573 C ASN B 88 68.144 46.146 42.851 1.00 8.46 B -ATOM 1574 O ASN B 88 69.026 46.768 43.450 1.00 7.86 B -ATOM 1575 CB ASN B 88 66.740 44.572 44.145 1.00 10.40 B -ATOM 1576 CG ASN B 88 66.169 44.610 45.540 1.00 11.76 B -ATOM 1577 OD1 ASN B 88 66.239 45.662 46.210 1.00 12.61 B -ATOM 1578 ND2 ASN B 88 65.615 43.454 45.921 1.00 13.35 B -ATOM 1579 N ALA B 89 68.340 45.587 41.664 1.00 7.67 B -ATOM 1580 CA ALA B 89 69.637 45.742 40.975 1.00 7.58 B -ATOM 1581 C ALA B 89 69.934 47.212 40.678 1.00 6.88 B -ATOM 1582 O ALA B 89 71.066 47.682 40.867 1.00 7.11 B -ATOM 1583 CB ALA B 89 69.635 44.884 39.713 1.00 8.02 B -ATOM 1584 N THR B 90 68.916 47.898 40.173 1.00 7.04 B -ATOM 1585 CA THR B 90 69.089 49.326 39.858 1.00 7.07 B -ATOM 1586 C THR B 90 69.328 50.133 41.132 1.00 6.37 B -ATOM 1587 O THR B 90 70.183 51.031 41.163 1.00 6.22 B -ATOM 1588 CB THR B 90 67.823 49.853 39.083 1.00 7.91 B -ATOM 1589 OG1 THR B 90 67.848 49.254 37.752 1.00 10.49 B -ATOM 1590 CG2 THR B 90 67.792 51.378 39.020 1.00 9.07 B -ATOM 1591 N TYR B 91 68.549 49.837 42.164 1.00 6.16 B -ATOM 1592 CA TYR B 91 68.653 50.539 43.451 1.00 5.79 B -ATOM 1593 C TYR B 91 70.048 50.341 44.026 1.00 5.81 B -ATOM 1594 O TYR B 91 70.724 51.278 44.488 1.00 6.66 B -ATOM 1595 CB TYR B 91 67.546 50.008 44.344 1.00 5.88 B -ATOM 1596 CG TYR B 91 67.369 50.645 45.698 1.00 5.59 B -ATOM 1597 CD1 TYR B 91 66.295 51.497 45.958 1.00 5.96 B -ATOM 1598 CD2 TYR B 91 68.267 50.394 46.730 1.00 6.04 B -ATOM 1599 CE1 TYR B 91 66.067 52.070 47.210 1.00 5.47 B -ATOM 1600 CE2 TYR B 91 68.093 50.940 47.994 1.00 6.05 B -ATOM 1601 CZ TYR B 91 66.985 51.768 48.210 1.00 5.90 B -ATOM 1602 OH TYR B 91 66.804 52.315 49.467 1.00 5.93 B -ATOM 1603 N GLU B 92 70.502 49.095 44.002 1.00 6.05 B -ATOM 1604 CA GLU B 92 71.841 48.771 44.514 1.00 6.75 B -ATOM 1605 C GLU B 92 72.917 49.548 43.765 1.00 6.71 B -ATOM 1606 O GLU B 92 73.846 50.151 44.350 1.00 7.08 B -ATOM 1607 CB GLU B 92 72.138 47.269 44.437 1.00 8.59 B -ATOM 1608 CG GLU B 92 73.518 46.875 44.989 1.00 11.80 B -ATOM 1609 CD GLU B 92 73.634 45.500 45.544 1.00 15.28 B -ATOM 1610 OE1 GLU B 92 74.486 45.106 46.349 1.00 18.01 B -ATOM 1611 OE2 GLU B 92 72.757 44.704 45.182 1.00 17.25 B -ATOM 1612 N ALA B 93 72.824 49.534 42.434 1.00 6.56 B -ATOM 1613 CA ALA B 93 73.786 50.239 41.573 1.00 7.09 B -ATOM 1614 C ALA B 93 73.817 51.726 41.900 1.00 6.90 B -ATOM 1615 O ALA B 93 74.895 52.313 42.030 1.00 7.00 B -ATOM 1616 CB ALA B 93 73.460 50.036 40.092 1.00 7.57 B -ATOM 1617 N PHE B 94 72.618 52.302 42.042 1.00 6.67 B -ATOM 1618 CA PHE B 94 72.516 53.752 42.332 1.00 6.61 B -ATOM 1619 C PHE B 94 73.288 54.131 43.597 1.00 5.97 B -ATOM 1620 O PHE B 94 74.054 55.105 43.607 1.00 6.59 B -ATOM 1621 CB PHE B 94 71.034 54.101 42.401 1.00 7.02 B -ATOM 1622 CG PHE B 94 70.771 55.555 42.599 1.00 7.23 B -ATOM 1623 CD1 PHE B 94 70.713 56.358 41.464 1.00 8.12 B -ATOM 1624 CD2 PHE B 94 70.605 56.098 43.862 1.00 8.71 B -ATOM 1625 CE1 PHE B 94 70.478 57.717 41.545 1.00 9.74 B -ATOM 1626 CE2 PHE B 94 70.367 57.485 43.979 1.00 9.96 B -ATOM 1627 CZ PHE B 94 70.332 58.243 42.813 1.00 9.82 B -ATOM 1628 N PHE B 95 73.086 53.389 44.675 1.00 5.98 B -ATOM 1629 CA PHE B 95 73.781 53.651 45.951 1.00 6.00 B -ATOM 1630 C PHE B 95 75.281 53.417 45.784 1.00 6.18 B -ATOM 1631 O PHE B 95 76.101 54.226 46.266 1.00 6.81 B -ATOM 1632 CB PHE B 95 73.124 52.962 47.140 1.00 6.51 B -ATOM 1633 CG PHE B 95 71.874 53.714 47.524 1.00 6.57 B -ATOM 1634 CD1 PHE B 95 70.622 53.373 47.028 1.00 7.43 B -ATOM 1635 CD2 PHE B 95 71.976 54.850 48.341 1.00 6.79 B -ATOM 1636 CE1 PHE B 95 69.479 54.111 47.329 1.00 7.20 B -ATOM 1637 CE2 PHE B 95 70.841 55.584 48.669 1.00 7.08 B -ATOM 1638 CZ PHE B 95 69.594 55.238 48.145 1.00 7.03 B -ATOM 1639 N THR B 96 75.622 52.319 45.112 1.00 6.49 B -ATOM 1640 CA THR B 96 77.053 52.019 44.897 1.00 8.11 B -ATOM 1641 C THR B 96 77.732 53.131 44.112 1.00 7.33 B -ATOM 1642 O THR B 96 78.891 53.504 44.429 1.00 7.70 B -ATOM 1643 CB THR B 96 77.231 50.627 44.186 1.00 9.27 B -ATOM 1644 OG1 THR B 96 76.633 49.670 45.085 1.00 11.25 B -ATOM 1645 CG2 THR B 96 78.696 50.311 43.881 1.00 9.94 B -ATOM 1646 N GLU B 97 77.060 53.665 43.106 1.00 7.31 B -ATOM 1647 CA GLU B 97 77.615 54.743 42.266 1.00 8.29 B -ATOM 1648 C GLU B 97 77.942 55.957 43.102 1.00 7.86 B -ATOM 1649 O GLU B 97 78.850 56.745 42.748 1.00 9.08 B -ATOM 1650 CB GLU B 97 76.606 55.168 41.175 1.00 8.63 B -ATOM 1651 CG GLU B 97 76.405 54.068 40.094 1.00 9.19 B -ATOM 1652 CD GLU B 97 75.045 54.140 39.441 1.00 9.70 B -ATOM 1653 OE1 GLU B 97 74.338 55.128 39.587 1.00 10.55 B -ATOM 1654 OE2 GLU B 97 74.714 53.131 38.781 1.00 11.38 B -ATOM 1655 N HIS B 98 77.252 56.159 44.220 1.00 7.67 B -ATOM 1656 CA HIS B 98 77.458 57.305 45.097 1.00 7.40 B -ATOM 1657 C HIS B 98 78.282 56.958 46.321 1.00 7.94 B -ATOM 1658 O HIS B 98 78.280 57.751 47.288 1.00 8.19 B -ATOM 1659 CB HIS B 98 76.069 57.908 45.506 1.00 7.48 B -ATOM 1660 CG HIS B 98 75.377 58.471 44.303 1.00 7.83 B -ATOM 1661 ND1 HIS B 98 74.517 57.790 43.472 1.00 7.93 B -ATOM 1662 CD2 HIS B 98 75.452 59.750 43.815 1.00 8.60 B -ATOM 1663 CE1 HIS B 98 74.117 58.614 42.522 1.00 8.30 B -ATOM 1664 NE2 HIS B 98 74.649 59.801 42.697 1.00 9.30 B -ATOM 1665 N ASN B 99 78.931 55.806 46.291 1.00 8.01 B -ATOM 1666 CA ASN B 99 79.752 55.341 47.423 1.00 8.93 B -ATOM 1667 C ASN B 99 78.974 55.499 48.728 1.00 7.82 B -ATOM 1668 O ASN B 99 79.517 55.928 49.777 1.00 8.81 B -ATOM 1669 CB ASN B 99 81.061 56.144 47.463 1.00 10.58 B -ATOM 1670 CG ASN B 99 82.056 55.546 48.447 1.00 11.86 B -ATOM 1671 OD1 ASN B 99 82.042 54.320 48.653 1.00 13.08 B -ATOM 1672 ND2 ASN B 99 82.877 56.417 49.031 1.00 13.49 B -ATOM 1673 N ALA B 100 77.711 55.106 48.690 1.00 7.10 B -ATOM 1674 CA ALA B 100 76.792 55.270 49.808 1.00 7.43 B -ATOM 1675 C ALA B 100 76.441 54.005 50.563 1.00 8.24 B -ATOM 1676 O ALA B 100 76.191 52.988 49.904 1.00 9.53 B -ATOM 1677 CB ALA B 100 75.483 55.884 49.262 1.00 7.38 B -ATOM 1678 N THR B 101 76.411 54.110 51.880 1.00 7.83 B -ATOM 1679 CA THR B 101 75.927 52.985 52.694 1.00 8.26 B -ATOM 1680 C THR B 101 74.436 52.883 52.331 1.00 7.07 B -ATOM 1681 O THR B 101 73.774 53.936 52.184 1.00 7.16 B -ATOM 1682 CB THR B 101 76.107 53.292 54.229 1.00 9.39 B -ATOM 1683 OG1 THR B 101 77.548 53.397 54.419 1.00 10.96 B -ATOM 1684 CG2 THR B 101 75.476 52.244 55.144 1.00 10.68 B -ATOM 1685 N PHE B 102 73.911 51.687 52.245 1.00 6.83 B -ATOM 1686 CA PHE B 102 72.488 51.556 51.894 1.00 6.82 B -ATOM 1687 C PHE B 102 71.584 52.049 53.025 1.00 6.10 B -ATOM 1688 O PHE B 102 71.847 51.781 54.203 1.00 6.28 B -ATOM 1689 CB PHE B 102 72.146 50.095 51.600 1.00 7.29 B -ATOM 1690 CG PHE B 102 72.979 49.431 50.546 1.00 7.87 B -ATOM 1691 CD1 PHE B 102 73.681 48.256 50.799 1.00 8.98 B -ATOM 1692 CD2 PHE B 102 73.053 49.997 49.264 1.00 7.94 B -ATOM 1693 CE1 PHE B 102 74.451 47.641 49.822 1.00 10.13 B -ATOM 1694 CE2 PHE B 102 73.816 49.401 48.256 1.00 8.74 B -ATOM 1695 CZ PHE B 102 74.523 48.219 48.548 1.00 9.67 B -ATOM 1696 N PRO B 103 70.515 52.750 52.655 1.00 6.23 B -ATOM 1697 CA PRO B 103 69.588 53.188 53.723 1.00 6.02 B -ATOM 1698 C PRO B 103 68.798 52.008 54.299 1.00 4.53 B -ATOM 1699 O PRO B 103 68.719 50.898 53.729 1.00 4.36 B -ATOM 1700 CB PRO B 103 68.557 54.011 52.895 1.00 7.30 B -ATOM 1701 CG PRO B 103 69.236 54.398 51.613 1.00 7.26 B -ATOM 1702 CD PRO B 103 70.155 53.207 51.314 1.00 6.81 B -ATOM 1703 N ALA B 104 68.152 52.268 55.432 1.00 4.08 B -ATOM 1704 CA ALA B 104 67.093 51.379 55.928 1.00 3.99 B -ATOM 1705 C ALA B 104 65.961 51.514 54.866 1.00 3.68 B -ATOM 1706 O ALA B 104 65.862 52.531 54.135 1.00 4.10 B -ATOM 1707 CB ALA B 104 66.624 51.799 57.278 1.00 4.60 B -ATOM 1708 N ARG B 105 65.116 50.488 54.754 1.00 4.14 B -ATOM 1709 CA ARG B 105 64.091 50.483 53.701 1.00 4.07 B -ATOM 1710 C ARG B 105 62.865 49.676 54.037 1.00 3.75 B -ATOM 1711 O ARG B 105 62.974 48.671 54.784 1.00 3.67 B -ATOM 1712 CB ARG B 105 64.776 49.844 52.439 1.00 5.04 B -ATOM 1713 CG ARG B 105 63.932 49.901 51.168 1.00 6.68 B -ATOM 1714 CD ARG B 105 64.669 49.471 49.920 1.00 7.36 B -ATOM 1715 NE ARG B 105 64.950 48.059 49.942 1.00 9.16 B -ATOM 1716 CZ ARG B 105 65.406 47.372 48.872 1.00 9.60 B -ATOM 1717 NH1 ARG B 105 65.570 46.061 48.897 1.00 10.15 B -ATOM 1718 NH2 ARG B 105 65.757 48.029 47.767 1.00 9.57 B -ATOM 1719 N SER B 106 61.735 50.143 53.519 1.00 3.97 B -ATOM 1720 CA SER B 106 60.496 49.356 53.565 1.00 4.51 B -ATOM 1721 C SER B 106 60.072 49.212 52.082 1.00 4.12 B -ATOM 1722 O SER B 106 60.266 50.144 51.289 1.00 4.73 B -ATOM 1723 CB SER B 106 59.374 49.959 54.353 1.00 5.49 B -ATOM 1724 OG SER B 106 59.796 49.957 55.710 1.00 6.48 B -HETATM 1725 N CSP B 107 59.505 48.054 51.758 1.00 4.52 B -HETATM 1726 CA CSP B 107 59.129 47.760 50.378 1.00 5.72 B -HETATM 1727 CB CSP B 107 60.089 46.804 49.700 0.67 8.42 B -HETATM 1729 SG CSP B 107 61.809 47.227 49.776 0.67 12.80 B -HETATM 1730 P CSP B 107 62.354 45.759 51.167 0.67 14.01 B -HETATM 1731 O1P CSP B 107 61.495 45.839 52.330 0.67 15.06 B -HETATM 1732 O2P CSP B 107 62.084 44.369 50.515 0.67 15.90 B -HETATM 1733 O3P CSP B 107 63.867 45.931 51.332 0.67 14.77 B -HETATM 1734 C CSP B 107 57.779 47.046 50.355 1.00 4.97 B -HETATM 1735 O CSP B 107 57.644 45.986 51.024 1.00 4.62 B -ATOM 1737 N VAL B 108 56.859 47.551 49.572 1.00 4.59 B -ATOM 1738 CA VAL B 108 55.529 46.918 49.485 1.00 4.55 B -ATOM 1739 C VAL B 108 55.005 47.075 48.074 1.00 4.55 B -ATOM 1740 O VAL B 108 55.353 48.046 47.373 1.00 4.69 B -ATOM 1741 CB VAL B 108 54.549 47.594 50.491 1.00 4.96 B -ATOM 1742 CG1 VAL B 108 54.998 47.484 51.949 1.00 5.33 B -ATOM 1743 CG2 VAL B 108 54.200 49.027 50.132 1.00 6.15 B -ATOM 1744 N GLU B 109 54.097 46.183 47.680 1.00 4.88 B -ATOM 1745 CA GLU B 109 53.393 46.293 46.413 1.00 4.49 B -ATOM 1746 C GLU B 109 52.038 46.954 46.709 1.00 4.13 B -ATOM 1747 O GLU B 109 51.280 46.405 47.528 1.00 5.16 B -ATOM 1748 CB GLU B 109 53.124 44.938 45.767 1.00 5.33 B -ATOM 1749 CG GLU B 109 52.523 45.089 44.371 1.00 5.37 B -ATOM 1750 CD GLU B 109 52.168 43.746 43.764 1.00 6.00 B -ATOM 1751 OE1 GLU B 109 51.012 43.552 43.382 1.00 7.16 B -ATOM 1752 OE2 GLU B 109 53.105 42.917 43.683 1.00 5.73 B -ATOM 1753 N VAL B 110 51.785 48.087 46.081 1.00 4.12 B -ATOM 1754 CA VAL B 110 50.496 48.778 46.266 1.00 5.16 B -ATOM 1755 C VAL B 110 49.561 48.429 45.106 1.00 4.97 B -ATOM 1756 O VAL B 110 49.994 47.748 44.159 1.00 5.83 B -ATOM 1757 CB VAL B 110 50.727 50.295 46.324 1.00 5.61 B -ATOM 1758 CG1 VAL B 110 51.594 50.678 47.521 1.00 6.03 B -ATOM 1759 CG2 VAL B 110 51.320 50.844 45.036 1.00 5.94 B -ATOM 1760 N ALA B 111 48.309 48.840 45.198 1.00 5.19 B -ATOM 1761 CA ALA B 111 47.352 48.558 44.126 1.00 5.46 B -ATOM 1762 C ALA B 111 47.562 49.429 42.900 1.00 5.34 B -ATOM 1763 O ALA B 111 47.334 48.964 41.750 1.00 6.46 B -ATOM 1764 CB ALA B 111 45.917 48.746 44.653 1.00 5.06 B -ATOM 1765 N ARG B 112 47.959 50.685 43.091 1.00 5.42 B -ATOM 1766 CA ARG B 112 48.127 51.619 41.972 1.00 5.97 B -ATOM 1767 C ARG B 112 48.900 52.817 42.478 1.00 5.15 B -ATOM 1768 O ARG B 112 48.874 53.130 43.687 1.00 5.33 B -ATOM 1769 CB ARG B 112 46.742 52.068 41.486 1.00 5.86 B -ATOM 1770 CG ARG B 112 46.714 52.715 40.113 1.00 7.01 B -ATOM 1771 CD ARG B 112 45.315 53.123 39.755 1.00 7.87 B -ATOM 1772 NE ARG B 112 45.315 53.754 38.438 1.00 9.03 B -ATOM 1773 CZ ARG B 112 44.312 54.495 37.936 1.00 9.58 B -ATOM 1774 NH1 ARG B 112 44.464 55.015 36.706 1.00 10.53 B -ATOM 1775 NH2 ARG B 112 43.181 54.677 38.619 1.00 10.02 B -ATOM 1776 N LEU B 113 49.596 53.475 41.571 1.00 5.16 B -ATOM 1777 CA LEU B 113 50.392 54.662 41.860 1.00 5.23 B -ATOM 1778 C LEU B 113 49.961 55.800 40.958 1.00 5.70 B -ATOM 1779 O LEU B 113 49.350 55.580 39.890 1.00 6.10 B -ATOM 1780 CB LEU B 113 51.873 54.335 41.632 1.00 5.50 B -ATOM 1781 CG LEU B 113 52.474 53.370 42.649 1.00 5.34 B -ATOM 1782 CD1 LEU B 113 53.859 52.921 42.176 1.00 5.70 B -ATOM 1783 CD2 LEU B 113 52.557 54.010 44.032 1.00 4.99 B -ATOM 1784 N PRO B 114 50.268 57.024 41.361 1.00 6.67 B -ATOM 1785 CA PRO B 114 49.934 58.195 40.539 1.00 7.38 B -ATOM 1786 C PRO B 114 50.475 57.984 39.124 1.00 7.04 B -ATOM 1787 O PRO B 114 51.586 57.489 38.861 1.00 7.08 B -ATOM 1788 CB PRO B 114 50.649 59.357 41.239 1.00 7.55 B -ATOM 1789 CG PRO B 114 50.756 58.922 42.679 1.00 7.89 B -ATOM 1790 CD PRO B 114 50.956 57.405 42.617 1.00 7.17 B -ATOM 1791 N LYS B 115 49.650 58.370 38.152 1.00 7.96 B -ATOM 1792 CA LYS B 115 49.953 58.299 36.717 1.00 9.22 B -ATOM 1793 C LYS B 115 50.209 56.876 36.276 1.00 9.21 B -ATOM 1794 O LYS B 115 50.835 56.725 35.203 1.00 9.21 B -ATOM 1795 CB LYS B 115 51.173 59.162 36.379 1.00 10.55 B -ATOM 1796 CG LYS B 115 50.934 60.632 36.740 1.00 12.98 B -ATOM 1797 CD LYS B 115 52.106 61.449 36.179 1.00 15.15 B -ATOM 1798 CE LYS B 115 51.791 62.932 36.188 1.00 16.92 B -ATOM 1799 NZ LYS B 115 52.176 63.588 34.907 1.00 18.34 B -ATOM 1800 N ASP B 116 49.783 55.882 37.020 1.00 8.41 B -ATOM 1801 CA ASP B 116 50.010 54.481 36.653 1.00 8.14 B -ATOM 1802 C ASP B 116 51.491 54.137 36.537 1.00 7.11 B -ATOM 1803 O ASP B 116 51.846 53.192 35.783 1.00 8.04 B -ATOM 1804 CB ASP B 116 49.198 54.075 35.408 1.00 9.13 B -ATOM 1805 CG ASP B 116 47.712 53.984 35.783 1.00 10.16 B -ATOM 1806 OD1 ASP B 116 46.977 54.853 35.295 1.00 11.23 B -ATOM 1807 OD2 ASP B 116 47.365 53.069 36.542 1.00 10.06 B -ATOM 1808 N VAL B 117 52.340 54.811 37.303 1.00 6.39 B -ATOM 1809 CA VAL B 117 53.781 54.470 37.277 1.00 5.93 B -ATOM 1810 C VAL B 117 53.972 53.123 37.988 1.00 5.45 B -ATOM 1811 O VAL B 117 53.077 52.615 38.671 1.00 5.92 B -ATOM 1812 CB VAL B 117 54.629 55.611 37.850 1.00 5.41 B -ATOM 1813 CG1 VAL B 117 54.552 56.910 37.045 1.00 6.56 B -ATOM 1814 CG2 VAL B 117 54.353 55.801 39.339 1.00 4.77 B -ATOM 1815 N LYS B 118 55.159 52.599 37.861 1.00 5.60 B -ATOM 1816 CA LYS B 118 55.494 51.309 38.448 1.00 5.78 B -ATOM 1817 C LYS B 118 56.190 51.421 39.794 1.00 5.20 B -ATOM 1818 O LYS B 118 56.351 50.398 40.449 1.00 4.89 B -ATOM 1819 CB LYS B 118 56.401 50.545 37.481 1.00 6.48 B -ATOM 1820 CG LYS B 118 55.766 50.197 36.142 1.00 8.03 B -ATOM 1821 CD LYS B 118 56.681 49.587 35.093 1.00 10.35 B -ATOM 1822 CE LYS B 118 55.939 49.354 33.779 1.00 12.02 B -ATOM 1823 NZ LYS B 118 56.770 48.768 32.708 1.00 13.89 B -ATOM 1824 N ILE B 119 56.595 52.620 40.201 1.00 4.72 B -ATOM 1825 CA ILE B 119 57.347 52.805 41.442 1.00 4.45 B -ATOM 1826 C ILE B 119 57.236 54.233 41.948 1.00 4.59 B -ATOM 1827 O ILE B 119 57.090 55.158 41.151 1.00 4.61 B -ATOM 1828 CB ILE B 119 58.835 52.378 41.166 1.00 4.91 B -ATOM 1829 CG1 ILE B 119 59.638 52.307 42.496 1.00 4.94 B -ATOM 1830 CG2 ILE B 119 59.557 53.294 40.145 1.00 5.42 B -ATOM 1831 CD1 ILE B 119 60.967 51.552 42.276 1.00 5.66 B -ATOM 1832 N GLU B 120 57.294 54.361 43.266 1.00 4.02 B -ATOM 1833 CA GLU B 120 57.295 55.668 43.938 1.00 3.81 B -ATOM 1834 C GLU B 120 58.249 55.491 45.119 1.00 3.77 B -ATOM 1835 O GLU B 120 58.112 54.507 45.874 1.00 4.01 B -ATOM 1836 CB GLU B 120 55.919 56.069 44.417 1.00 4.09 B -ATOM 1837 CG GLU B 120 55.856 57.420 45.120 1.00 4.28 B -ATOM 1838 CD GLU B 120 54.500 57.808 45.637 1.00 4.49 B -ATOM 1839 OE1 GLU B 120 54.356 58.514 46.641 1.00 6.49 B -ATOM 1840 OE2 GLU B 120 53.518 57.364 44.960 1.00 5.06 B -ATOM 1841 N ILE B 121 59.173 56.418 45.302 1.00 3.35 B -ATOM 1842 CA ILE B 121 60.161 56.304 46.382 1.00 3.57 B -ATOM 1843 C ILE B 121 60.255 57.596 47.173 1.00 3.38 B -ATOM 1844 O ILE B 121 60.488 58.665 46.614 1.00 3.55 B -ATOM 1845 CB ILE B 121 61.584 56.009 45.799 1.00 4.18 B -ATOM 1846 CG1 ILE B 121 61.562 54.777 44.888 1.00 5.00 B -ATOM 1847 CG2 ILE B 121 62.619 55.858 46.938 1.00 5.16 B -ATOM 1848 CD1 ILE B 121 62.912 54.470 44.198 1.00 5.62 B -ATOM 1849 N GLU B 122 60.086 57.456 48.487 1.00 3.62 B -ATOM 1850 CA GLU B 122 60.249 58.594 49.396 1.00 3.82 B -ATOM 1851 C GLU B 122 61.524 58.342 50.201 1.00 3.47 B -ATOM 1852 O GLU B 122 61.924 57.176 50.402 1.00 3.81 B -ATOM 1853 CB GLU B 122 59.073 58.847 50.309 1.00 6.01 B -ATOM 1854 CG GLU B 122 58.774 57.680 51.237 1.00 7.17 B -ATOM 1855 CD GLU B 122 57.696 57.886 52.243 1.00 8.33 B -ATOM 1856 OE1 GLU B 122 57.674 57.155 53.244 1.00 10.86 B -ATOM 1857 OE2 GLU B 122 56.839 58.772 52.050 1.00 7.19 B -ATOM 1858 N ALA B 123 62.151 59.418 50.651 1.00 4.17 B -ATOM 1859 CA ALA B 123 63.409 59.272 51.377 1.00 4.16 B -ATOM 1860 C ALA B 123 63.570 60.271 52.493 1.00 3.85 B -ATOM 1861 O ALA B 123 62.978 61.371 52.469 1.00 4.05 B -ATOM 1862 CB ALA B 123 64.603 59.479 50.429 1.00 5.43 B -ATOM 1863 N ILE B 124 64.325 59.869 53.494 1.00 3.64 B -ATOM 1864 CA ILE B 124 64.724 60.674 54.631 1.00 4.00 B -ATOM 1865 C ILE B 124 66.259 60.714 54.613 1.00 3.37 B -ATOM 1866 O ILE B 124 66.855 59.620 54.497 1.00 3.97 B -ATOM 1867 CB ILE B 124 64.242 60.087 56.000 1.00 5.41 B -ATOM 1868 CG1 ILE B 124 62.705 60.117 56.068 1.00 6.98 B -ATOM 1869 CG2 ILE B 124 64.859 60.874 57.183 1.00 6.64 B -ATOM 1870 CD1 ILE B 124 62.159 59.337 57.288 1.00 8.60 B -ATOM 1871 N ALA B 125 66.842 61.880 54.752 1.00 3.70 B -ATOM 1872 CA ALA B 125 68.301 62.068 54.808 1.00 4.32 B -ATOM 1873 C ALA B 125 68.635 62.930 56.028 1.00 3.88 B -ATOM 1874 O ALA B 125 67.777 63.665 56.523 1.00 4.96 B -ATOM 1875 CB ALA B 125 68.783 62.702 53.501 1.00 5.11 B -ATOM 1876 N VAL B 126 69.872 62.787 56.521 1.00 4.73 B -ATOM 1877 CA VAL B 126 70.287 63.588 57.683 1.00 5.32 B -ATOM 1878 C VAL B 126 71.648 64.218 57.397 1.00 5.65 B -ATOM 1879 O VAL B 126 72.479 63.670 56.687 1.00 6.01 B -ATOM 1880 CB VAL B 126 70.332 62.778 58.997 1.00 6.36 B -ATOM 1881 CG1 VAL B 126 68.943 62.402 59.496 1.00 7.37 B -ATOM 1882 CG2 VAL B 126 71.258 61.592 58.899 1.00 7.21 B -ATOM 1883 N ARG B 127 71.813 65.384 58.004 1.00 5.90 B -ATOM 1884 CA ARG B 127 73.105 66.095 57.867 1.00 8.86 B -ATOM 1885 C ARG B 127 74.200 65.483 58.748 1.00 10.67 B -ATOM 1886 O ARG B 127 75.374 65.521 58.297 1.00 12.25 B -ATOM 1887 CB ARG B 127 73.010 67.564 58.270 1.00 8.97 B -ATOM 1888 CG ARG B 127 71.998 68.304 57.429 1.00 8.83 B -ATOM 1889 CD ARG B 127 72.173 69.812 57.632 1.00 9.65 B -ATOM 1890 NE ARG B 127 71.128 70.494 56.885 1.00 8.63 B -ATOM 1891 CZ ARG B 127 71.181 70.713 55.591 1.00 8.65 B -ATOM 1892 NH1 ARG B 127 72.258 70.467 54.865 1.00 8.88 B -ATOM 1893 NH2 ARG B 127 70.066 71.099 54.968 1.00 8.68 B -ATOM 1894 N ARG B 128 73.836 65.001 59.905 1.00 12.46 B -ATOM 1895 CA ARG B 128 74.766 64.407 60.872 1.00 14.89 B -ATOM 1896 C ARG B 128 74.505 62.918 61.127 1.00 16.10 B -ATOM 1897 O ARG B 128 73.288 62.583 61.112 1.00 17.58 B -ATOM 1898 CB ARG B 128 74.648 65.151 62.222 1.00 15.67 B -ATOM 1899 OXT ARG B 128 75.293 62.395 61.959 1.00 17.72 B -ATOM 1901 N SER C 2 75.379 59.687 62.109 1.00 16.24 C -ATOM 1902 CA SER C 2 74.424 58.545 61.990 1.00 15.30 C -ATOM 1903 C SER C 2 75.199 57.256 61.682 1.00 13.90 C -ATOM 1904 O SER C 2 76.306 57.298 61.094 1.00 15.02 C -ATOM 1905 CB SER C 2 73.331 58.796 60.983 1.00 16.11 C -ATOM 1906 OG SER C 2 73.778 58.666 59.642 1.00 18.37 C -ATOM 1907 N LYS C 3 74.598 56.142 62.095 1.00 12.13 C -ATOM 1908 CA LYS C 3 75.274 54.855 61.881 1.00 11.35 C -ATOM 1909 C LYS C 3 74.285 53.732 61.619 1.00 8.65 C -ATOM 1910 O LYS C 3 73.102 53.724 61.974 1.00 7.83 C -ATOM 1911 CB LYS C 3 76.165 54.508 63.089 1.00 13.69 C -ATOM 1912 CG LYS C 3 75.337 54.208 64.314 1.00 15.79 C -ATOM 1913 CD LYS C 3 76.074 54.056 65.631 1.00 17.79 C -ATOM 1914 CE LYS C 3 76.498 55.391 66.208 1.00 18.86 C -ATOM 1915 NZ LYS C 3 76.966 55.266 67.628 1.00 20.35 C -ATOM 1916 N THR C 4 74.837 52.734 60.953 1.00 7.14 C -ATOM 1917 CA THR C 4 74.068 51.526 60.662 1.00 6.44 C -ATOM 1918 C THR C 4 73.856 50.711 61.943 1.00 5.57 C -ATOM 1919 O THR C 4 74.785 50.616 62.800 1.00 6.47 C -ATOM 1920 CB THR C 4 74.950 50.619 59.713 1.00 7.10 C -ATOM 1921 OG1 THR C 4 75.034 51.320 58.447 1.00 8.40 C -ATOM 1922 CG2 THR C 4 74.383 49.209 59.526 1.00 7.78 C -ATOM 1923 N ILE C 5 72.684 50.115 62.056 1.00 4.90 C -ATOM 1924 CA ILE C 5 72.395 49.139 63.114 1.00 5.03 C -ATOM 1925 C ILE C 5 72.500 47.762 62.401 1.00 5.26 C -ATOM 1926 O ILE C 5 71.875 47.535 61.375 1.00 5.95 C -ATOM 1927 CB ILE C 5 70.997 49.304 63.748 1.00 5.22 C -ATOM 1928 CG1 ILE C 5 70.810 50.722 64.326 1.00 5.41 C -ATOM 1929 CG2 ILE C 5 70.734 48.204 64.802 1.00 6.47 C -ATOM 1930 CD1 ILE C 5 69.334 51.050 64.678 1.00 4.98 C -ATOM 1931 N ALA C 6 73.340 46.901 62.990 1.00 5.80 C -ATOM 1932 CA ALA C 6 73.548 45.548 62.428 1.00 7.32 C -ATOM 1933 C ALA C 6 73.578 44.573 63.599 1.00 7.57 C -ATOM 1934 O ALA C 6 74.414 44.680 64.516 1.00 10.07 C -ATOM 1935 CB ALA C 6 74.808 45.481 61.583 1.00 8.24 C -ATOM 1936 N THR C 7 72.613 43.666 63.612 1.00 6.19 C -ATOM 1937 CA THR C 7 72.481 42.676 64.681 1.00 6.55 C -ATOM 1938 C THR C 7 72.188 41.286 64.145 1.00 5.76 C -ATOM 1939 O THR C 7 71.468 41.146 63.171 1.00 6.20 C -ATOM 1940 CB THR C 7 71.330 43.117 65.663 1.00 7.01 C -ATOM 1941 OG1 THR C 7 71.214 42.032 66.622 1.00 7.16 C -ATOM 1942 CG2 THR C 7 69.980 43.363 65.012 1.00 7.30 C -ATOM 1943 N GLU C 8 72.807 40.282 64.754 1.00 6.37 C -ATOM 1944 CA GLU C 8 72.568 38.895 64.376 1.00 6.48 C -ATOM 1945 C GLU C 8 71.162 38.497 64.803 1.00 6.14 C -ATOM 1946 O GLU C 8 70.650 37.460 64.341 1.00 6.07 C -ATOM 1947 CB GLU C 8 73.559 37.922 65.033 1.00 7.91 C -ATOM 1948 CG GLU C 8 73.490 37.722 66.540 1.00 9.70 C -ATOM 1949 CD GLU C 8 74.051 38.814 67.395 1.00 11.36 C -ATOM 1950 OE1 GLU C 8 74.261 39.958 66.979 1.00 12.18 C -ATOM 1951 OE2 GLU C 8 74.276 38.489 68.603 1.00 13.35 C -ATOM 1952 N ASN C 9 70.529 39.286 65.675 1.00 6.75 C -ATOM 1953 CA ASN C 9 69.204 38.967 66.220 1.00 7.05 C -ATOM 1954 C ASN C 9 68.025 39.238 65.308 1.00 7.06 C -ATOM 1955 O ASN C 9 66.872 38.959 65.680 1.00 6.95 C -ATOM 1956 CB ASN C 9 69.019 39.590 67.590 1.00 7.91 C -ATOM 1957 CG ASN C 9 70.034 39.030 68.573 1.00 9.05 C -ATOM 1958 OD1 ASN C 9 70.332 37.816 68.514 1.00 10.43 C -ATOM 1959 ND2 ASN C 9 70.545 39.902 69.410 1.00 9.59 C -ATOM 1960 N ALA C 10 68.250 39.839 64.140 1.00 5.82 C -ATOM 1961 CA ALA C 10 67.198 40.069 63.131 1.00 5.77 C -ATOM 1962 C ALA C 10 67.795 39.464 61.835 1.00 6.13 C -ATOM 1963 O ALA C 10 69.012 39.310 61.744 1.00 5.80 C -ATOM 1964 CB ALA C 10 66.850 41.527 62.935 1.00 6.12 C -ATOM 1965 N PRO C 11 66.939 39.127 60.887 1.00 6.62 C -ATOM 1966 CA PRO C 11 67.427 38.556 59.626 1.00 6.86 C -ATOM 1967 C PRO C 11 68.470 39.432 58.991 1.00 6.78 C -ATOM 1968 O PRO C 11 68.299 40.681 58.925 1.00 6.19 C -ATOM 1969 CB PRO C 11 66.191 38.483 58.750 1.00 7.77 C -ATOM 1970 CG PRO C 11 65.012 38.512 59.680 1.00 8.11 C -ATOM 1971 CD PRO C 11 65.475 39.270 60.918 1.00 7.42 C -ATOM 1972 N ALA C 12 69.527 38.830 58.469 1.00 8.21 C -ATOM 1973 CA ALA C 12 70.624 39.572 57.836 1.00 9.55 C -ATOM 1974 C ALA C 12 70.099 40.348 56.629 1.00 10.63 C -ATOM 1975 O ALA C 12 69.197 39.905 55.909 1.00 9.79 C -ATOM 1976 CB ALA C 12 71.687 38.589 57.344 1.00 10.50 C -ATOM 1977 N ALA C 13 70.685 41.520 56.468 1.00 11.95 C -ATOM 1978 CA ALA C 13 70.356 42.435 55.363 1.00 14.35 C -ATOM 1979 C ALA C 13 71.201 42.006 54.159 1.00 15.86 C -ATOM 1980 O ALA C 13 72.361 42.446 54.077 1.00 17.22 C -ATOM 1981 CB ALA C 13 70.640 43.882 55.728 1.00 14.52 C -ATOM 1982 N ILE C 14 70.571 41.192 53.335 1.00 16.89 C -ATOM 1983 CA ILE C 14 71.268 40.701 52.121 1.00 18.21 C -ATOM 1984 C ILE C 14 71.151 41.712 50.983 1.00 18.11 C -ATOM 1985 O ILE C 14 72.218 42.096 50.420 1.00 19.37 C -ATOM 1986 CB ILE C 14 70.805 39.249 51.808 1.00 19.06 C -ATOM 1987 CG1 ILE C 14 71.045 38.352 53.063 1.00 19.75 C -ATOM 1988 CG2 ILE C 14 71.498 38.616 50.571 1.00 19.75 C -ATOM 1989 CD1 ILE C 14 70.339 36.972 52.904 1.00 20.29 C -ATOM 1990 N GLY C 15 69.955 42.164 50.671 1.00 17.28 C -ATOM 1991 CA GLY C 15 69.783 43.173 49.589 1.00 15.10 C -ATOM 1992 C GLY C 15 70.474 44.499 49.929 1.00 13.16 C -ATOM 1993 O GLY C 15 71.233 44.655 50.901 1.00 14.07 C -ATOM 1994 N PRO C 16 70.180 45.491 49.082 1.00 11.29 C -ATOM 1995 CA PRO C 16 70.743 46.834 49.214 1.00 9.14 C -ATOM 1996 C PRO C 16 70.025 47.663 50.263 1.00 8.00 C -ATOM 1997 O PRO C 16 69.393 48.680 49.940 1.00 6.68 C -ATOM 1998 CB PRO C 16 70.627 47.384 47.790 1.00 9.25 C -ATOM 1999 CG PRO C 16 69.299 46.821 47.323 1.00 9.12 C -ATOM 2000 CD PRO C 16 69.312 45.393 47.874 1.00 10.61 C -ATOM 2001 N TYR C 17 70.158 47.238 51.512 1.00 6.92 C -ATOM 2002 CA TYR C 17 69.552 47.969 52.643 1.00 6.14 C -ATOM 2003 C TYR C 17 70.301 47.559 53.900 1.00 5.54 C -ATOM 2004 O TYR C 17 71.069 46.568 53.863 1.00 7.15 C -ATOM 2005 CB TYR C 17 68.038 47.653 52.770 1.00 6.78 C -ATOM 2006 CG TYR C 17 67.760 46.184 53.035 1.00 7.73 C -ATOM 2007 CD1 TYR C 17 67.570 45.725 54.354 1.00 8.18 C -ATOM 2008 CD2 TYR C 17 67.736 45.220 52.031 1.00 8.87 C -ATOM 2009 CE1 TYR C 17 67.316 44.386 54.645 1.00 9.51 C -ATOM 2010 CE2 TYR C 17 67.498 43.868 52.309 1.00 10.50 C -ATOM 2011 CZ TYR C 17 67.302 43.463 53.612 1.00 10.45 C -ATOM 2012 OH TYR C 17 67.069 42.136 53.906 1.00 12.81 C -ATOM 2013 N VAL C 18 70.101 48.285 54.974 1.00 5.53 C -ATOM 2014 CA VAL C 18 70.616 47.936 56.302 1.00 5.01 C -ATOM 2015 C VAL C 18 69.366 47.657 57.143 1.00 5.01 C -ATOM 2016 O VAL C 18 68.264 48.112 56.823 1.00 5.04 C -ATOM 2017 CB VAL C 18 71.510 48.995 56.929 1.00 5.59 C -ATOM 2018 CG1 VAL C 18 72.797 49.086 56.116 1.00 6.33 C -ATOM 2019 CG2 VAL C 18 70.825 50.342 57.091 1.00 6.00 C -ATOM 2020 N GLN C 19 69.553 46.945 58.244 1.00 4.48 C -ATOM 2021 CA GLN C 19 68.446 46.600 59.142 1.00 4.00 C -ATOM 2022 C GLN C 19 67.805 47.834 59.775 1.00 3.80 C -ATOM 2023 O GLN C 19 66.598 47.857 60.035 1.00 3.75 C -ATOM 2024 CB GLN C 19 68.895 45.663 60.267 1.00 5.03 C -ATOM 2025 CG GLN C 19 69.363 44.310 59.743 1.00 5.44 C -ATOM 2026 CD GLN C 19 70.048 43.542 60.837 1.00 5.87 C -ATOM 2027 OE1 GLN C 19 70.789 44.130 61.623 1.00 7.44 C -ATOM 2028 NE2 GLN C 19 69.850 42.220 60.896 1.00 6.86 C -ATOM 2029 N GLY C 20 68.629 48.826 60.101 1.00 4.08 C -ATOM 2030 CA GLY C 20 68.083 50.054 60.731 1.00 3.84 C -ATOM 2031 C GLY C 20 69.194 51.077 60.795 1.00 3.63 C -ATOM 2032 O GLY C 20 70.366 50.763 60.515 1.00 3.92 C -ATOM 2033 N VAL C 21 68.820 52.293 61.175 1.00 3.33 C -ATOM 2034 CA VAL C 21 69.766 53.390 61.313 1.00 3.95 C -ATOM 2035 C VAL C 21 69.576 54.047 62.676 1.00 3.79 C -ATOM 2036 O VAL C 21 68.449 54.224 63.146 1.00 4.94 C -ATOM 2037 CB VAL C 21 69.624 54.401 60.160 1.00 3.78 C -ATOM 2038 CG1 VAL C 21 70.091 53.754 58.864 1.00 4.83 C -ATOM 2039 CG2 VAL C 21 68.190 54.888 60.047 1.00 4.51 C -ATOM 2040 N ASP C 22 70.702 54.402 63.260 1.00 4.14 C -ATOM 2041 CA ASP C 22 70.749 55.097 64.566 1.00 4.70 C -ATOM 2042 C ASP C 22 71.148 56.528 64.213 1.00 4.45 C -ATOM 2043 O ASP C 22 72.315 56.763 63.839 1.00 5.58 C -ATOM 2044 CB ASP C 22 71.720 54.398 65.504 1.00 6.22 C -ATOM 2045 CG ASP C 22 71.968 55.106 66.810 1.00 7.08 C -ATOM 2046 OD1 ASP C 22 72.601 54.461 67.693 1.00 8.97 C -ATOM 2047 OD2 ASP C 22 71.563 56.249 66.976 1.00 7.76 C -ATOM 2048 N LEU C 23 70.241 57.471 64.305 1.00 4.71 C -ATOM 2049 CA LEU C 23 70.471 58.871 63.966 1.00 5.58 C -ATOM 2050 C LEU C 23 70.823 59.745 65.149 1.00 6.38 C -ATOM 2051 O LEU C 23 70.882 60.979 64.983 1.00 8.55 C -ATOM 2052 CB LEU C 23 69.193 59.403 63.270 1.00 5.54 C -ATOM 2053 CG LEU C 23 68.674 58.507 62.154 1.00 6.24 C -ATOM 2054 CD1 LEU C 23 67.451 59.178 61.512 1.00 6.77 C -ATOM 2055 CD2 LEU C 23 69.707 58.259 61.054 1.00 6.93 C -ATOM 2056 N GLY C 24 71.039 59.166 66.286 1.00 6.72 C -ATOM 2057 CA GLY C 24 71.338 59.920 67.523 1.00 7.67 C -ATOM 2058 C GLY C 24 70.084 59.707 68.400 1.00 7.60 C -ATOM 2059 O GLY C 24 69.915 58.600 68.942 1.00 8.31 C -ATOM 2060 N ASN C 25 69.248 60.704 68.474 1.00 7.01 C -ATOM 2061 CA ASN C 25 68.036 60.524 69.301 1.00 7.87 C -ATOM 2062 C ASN C 25 67.049 59.570 68.622 1.00 7.17 C -ATOM 2063 O ASN C 25 66.371 58.790 69.317 1.00 7.79 C -ATOM 2064 CB ASN C 25 67.343 61.872 69.507 1.00 9.22 C -ATOM 2065 CG ASN C 25 66.113 61.713 70.393 1.00 10.32 C -ATOM 2066 OD1 ASN C 25 66.200 61.175 71.506 1.00 12.32 C -ATOM 2067 ND2 ASN C 25 64.967 62.167 69.869 1.00 11.31 C -ATOM 2068 N MET C 26 66.912 59.596 67.320 1.00 6.21 C -ATOM 2069 CA MET C 26 65.949 58.766 66.599 1.00 5.60 C -ATOM 2070 C MET C 26 66.583 57.556 65.937 1.00 5.14 C -ATOM 2071 O MET C 26 67.653 57.663 65.301 1.00 5.60 C -ATOM 2072 CB MET C 26 65.295 59.657 65.517 1.00 6.37 C -ATOM 2073 CG MET C 26 64.201 58.892 64.822 1.00 7.10 C -ATOM 2074 SD MET C 26 63.237 59.952 63.718 1.00 8.83 C -ATOM 2075 CE MET C 26 62.195 60.817 64.935 1.00 9.98 C -ATOM 2076 N ILE C 27 65.904 56.435 66.080 1.00 4.19 C -ATOM 2077 CA ILE C 27 66.272 55.172 65.439 1.00 4.28 C -ATOM 2078 C ILE C 27 65.142 54.845 64.446 1.00 3.82 C -ATOM 2079 O ILE C 27 63.960 54.992 64.828 1.00 3.92 C -ATOM 2080 CB ILE C 27 66.370 54.038 66.521 1.00 6.29 C -ATOM 2081 CG1 ILE C 27 67.744 54.078 67.247 1.00 7.15 C -ATOM 2082 CG2 ILE C 27 66.085 52.630 65.945 1.00 7.40 C -ATOM 2083 CD1 ILE C 27 68.089 55.432 67.892 1.00 7.34 C -ATOM 2084 N ILE C 28 65.496 54.416 63.256 1.00 3.50 C -ATOM 2085 CA ILE C 28 64.494 54.000 62.289 1.00 3.86 C -ATOM 2086 C ILE C 28 64.841 52.595 61.811 1.00 3.50 C -ATOM 2087 O ILE C 28 66.009 52.349 61.387 1.00 4.39 C -ATOM 2088 CB ILE C 28 64.397 54.955 61.051 1.00 4.84 C -ATOM 2089 CG1 ILE C 28 64.271 56.417 61.518 1.00 5.31 C -ATOM 2090 CG2 ILE C 28 63.234 54.508 60.136 1.00 5.87 C -ATOM 2091 CD1 ILE C 28 64.133 57.405 60.336 1.00 5.89 C -ATOM 2092 N THR C 29 63.885 51.698 61.836 1.00 3.96 C -ATOM 2093 CA THR C 29 64.117 50.363 61.295 1.00 4.14 C -ATOM 2094 C THR C 29 63.625 50.241 59.858 1.00 3.59 C -ATOM 2095 O THR C 29 62.751 50.957 59.398 1.00 4.36 C -ATOM 2096 CB THR C 29 63.402 49.229 62.148 1.00 4.08 C -ATOM 2097 OG1 THR C 29 62.003 49.151 61.797 1.00 3.82 C -ATOM 2098 CG2 THR C 29 63.547 49.413 63.662 1.00 4.97 C -ATOM 2099 N SER C 30 64.195 49.245 59.184 1.00 3.82 C -ATOM 2100 CA SER C 30 63.673 48.819 57.896 1.00 3.64 C -ATOM 2101 C SER C 30 62.342 48.083 58.225 1.00 3.76 C -ATOM 2102 O SER C 30 62.094 47.678 59.377 1.00 4.49 C -ATOM 2103 CB SER C 30 64.615 47.782 57.269 1.00 3.92 C -ATOM 2104 OG SER C 30 65.679 48.466 56.635 1.00 4.47 C -ATOM 2105 N GLY C 31 61.521 47.915 57.202 1.00 3.83 C -ATOM 2106 CA GLY C 31 60.254 47.176 57.299 1.00 4.29 C -ATOM 2107 C GLY C 31 60.617 45.727 57.583 1.00 4.32 C -ATOM 2108 O GLY C 31 61.268 45.108 56.714 1.00 6.10 C -ATOM 2109 N GLN C 32 60.248 45.164 58.708 1.00 3.41 C -ATOM 2110 CA GLN C 32 60.581 43.789 59.085 1.00 3.93 C -ATOM 2111 C GLN C 32 59.469 42.841 58.647 1.00 3.99 C -ATOM 2112 O GLN C 32 58.292 43.019 58.943 1.00 4.71 C -ATOM 2113 CB GLN C 32 60.781 43.678 60.603 1.00 4.22 C -ATOM 2114 CG GLN C 32 61.955 44.494 61.116 1.00 3.95 C -ATOM 2115 CD GLN C 32 63.233 44.181 60.387 1.00 4.74 C -ATOM 2116 OE1 GLN C 32 63.674 43.025 60.399 1.00 5.56 C -ATOM 2117 NE2 GLN C 32 63.775 45.179 59.688 1.00 4.99 C -ATOM 2118 N ILE C 33 59.924 41.772 58.014 1.00 5.20 C -ATOM 2119 CA ILE C 33 59.037 40.684 57.594 1.00 5.52 C -ATOM 2120 C ILE C 33 59.277 39.527 58.558 1.00 5.61 C -ATOM 2121 O ILE C 33 60.308 39.471 59.271 1.00 5.33 C -ATOM 2122 CB ILE C 33 59.247 40.335 56.109 1.00 6.50 C -ATOM 2123 CG1 ILE C 33 60.720 39.958 55.811 1.00 7.36 C -ATOM 2124 CG2 ILE C 33 58.775 41.489 55.181 1.00 7.63 C -ATOM 2125 CD1 ILE C 33 60.854 39.290 54.422 1.00 8.30 C -ATOM 2126 N PRO C 34 58.333 38.606 58.600 1.00 5.57 C -ATOM 2127 CA PRO C 34 58.367 37.522 59.576 1.00 5.47 C -ATOM 2128 C PRO C 34 59.321 36.371 59.282 1.00 5.79 C -ATOM 2129 O PRO C 34 58.907 35.192 59.360 1.00 7.27 C -ATOM 2130 CB PRO C 34 56.914 37.030 59.664 1.00 5.88 C -ATOM 2131 CG PRO C 34 56.396 37.325 58.276 1.00 6.23 C -ATOM 2132 CD PRO C 34 57.019 38.678 57.937 1.00 5.26 C -ATOM 2133 N VAL C 35 60.555 36.721 58.985 1.00 5.68 C -ATOM 2134 CA VAL C 35 61.601 35.706 58.775 1.00 6.40 C -ATOM 2135 C VAL C 35 62.295 35.492 60.117 1.00 5.88 C -ATOM 2136 O VAL C 35 62.677 36.425 60.824 1.00 5.93 C -ATOM 2137 CB VAL C 35 62.615 36.200 57.731 1.00 7.54 C -ATOM 2138 CG1 VAL C 35 63.850 35.300 57.671 1.00 7.74 C -ATOM 2139 CG2 VAL C 35 61.976 36.356 56.376 1.00 7.73 C -ATOM 2140 N ASN C 36 62.453 34.209 60.449 1.00 6.56 C -ATOM 2141 CA ASN C 36 63.134 33.832 61.711 1.00 7.61 C -ATOM 2142 C ASN C 36 64.632 34.009 61.509 1.00 7.47 C -ATOM 2143 O ASN C 36 65.195 33.398 60.575 1.00 8.51 C -ATOM 2144 CB ASN C 36 62.735 32.397 62.016 1.00 9.42 C -ATOM 2145 CG ASN C 36 63.346 31.815 63.262 1.00 11.61 C -ATOM 2146 OD1 ASN C 36 64.567 31.911 63.471 1.00 12.84 C -ATOM 2147 ND2 ASN C 36 62.500 31.143 64.047 1.00 12.39 C -ATOM 2148 N PRO C 37 65.329 34.757 62.330 1.00 7.10 C -ATOM 2149 CA PRO C 37 66.766 34.975 62.151 1.00 8.07 C -ATOM 2150 C PRO C 37 67.622 33.759 62.412 1.00 8.69 C -ATOM 2151 O PRO C 37 68.790 33.731 62.001 1.00 9.39 C -ATOM 2152 CB PRO C 37 67.097 36.114 63.114 1.00 8.93 C -ATOM 2153 CG PRO C 37 66.064 35.942 64.190 1.00 9.33 C -ATOM 2154 CD PRO C 37 64.793 35.519 63.459 1.00 8.45 C -ATOM 2155 N LYS C 38 67.088 32.797 63.140 1.00 9.24 C -ATOM 2156 CA LYS C 38 67.841 31.560 63.446 1.00 11.17 C -ATOM 2157 C LYS C 38 67.772 30.604 62.270 1.00 11.35 C -ATOM 2158 O LYS C 38 68.821 30.007 61.908 1.00 12.18 C -ATOM 2159 CB LYS C 38 67.259 30.905 64.682 1.00 12.66 C -ATOM 2160 CG LYS C 38 67.972 29.693 65.260 1.00 13.74 C -ATOM 2161 CD LYS C 38 67.360 29.220 66.600 1.00 14.42 C -ATOM 2162 CE LYS C 38 67.528 30.156 67.638 1.00 17.20 C -ATOM 2163 NZ LYS C 38 68.973 30.401 67.909 1.00 18.80 C -ATOM 2164 N THR C 39 66.605 30.410 61.667 1.00 11.29 C -ATOM 2165 CA THR C 39 66.426 29.447 60.585 1.00 11.38 C -ATOM 2166 C THR C 39 66.161 29.945 59.192 1.00 11.67 C -ATOM 2167 O THR C 39 66.283 29.146 58.231 1.00 12.12 C -ATOM 2168 CB THR C 39 65.202 28.498 60.967 1.00 11.46 C -ATOM 2169 OG1 THR C 39 64.024 29.377 60.899 1.00 11.47 C -ATOM 2170 CG2 THR C 39 65.321 27.870 62.342 1.00 12.27 C -ATOM 2171 N GLY C 40 65.724 31.191 59.069 1.00 11.14 C -ATOM 2172 CA GLY C 40 65.397 31.757 57.763 1.00 11.25 C -ATOM 2173 C GLY C 40 63.969 31.414 57.343 1.00 11.36 C -ATOM 2174 O GLY C 40 63.543 31.858 56.264 1.00 12.70 C -ATOM 2175 N GLU C 41 63.248 30.667 58.149 1.00 11.11 C -ATOM 2176 CA GLU C 41 61.871 30.278 57.815 1.00 11.71 C -ATOM 2177 C GLU C 41 60.833 31.296 58.245 1.00 10.19 C -ATOM 2178 O GLU C 41 61.111 32.099 59.139 1.00 10.11 C -ATOM 2179 CB GLU C 41 61.534 28.947 58.517 1.00 13.86 C -ATOM 2180 CG GLU C 41 62.414 27.808 57.967 1.00 16.75 C -ATOM 2181 CD GLU C 41 62.196 26.469 58.606 1.00 18.82 C -ATOM 2182 OE1 GLU C 41 61.693 26.338 59.711 1.00 19.76 C -ATOM 2183 OE2 GLU C 41 62.618 25.559 57.848 1.00 20.70 C -ATOM 2184 N VAL C 42 59.670 31.202 57.633 1.00 9.39 C -ATOM 2185 CA VAL C 42 58.529 32.092 57.933 1.00 8.66 C -ATOM 2186 C VAL C 42 57.415 31.207 58.479 1.00 8.84 C -ATOM 2187 O VAL C 42 57.073 30.227 57.758 1.00 8.91 C -ATOM 2188 CB VAL C 42 58.081 32.799 56.643 1.00 8.81 C -ATOM 2189 CG1 VAL C 42 56.777 33.559 56.885 1.00 8.55 C -ATOM 2190 CG2 VAL C 42 59.169 33.725 56.120 1.00 9.11 C -ATOM 2191 N PRO C 43 56.877 31.514 59.617 1.00 8.44 C -ATOM 2192 CA PRO C 43 55.791 30.715 60.210 1.00 9.28 C -ATOM 2193 C PRO C 43 54.546 30.918 59.367 1.00 9.79 C -ATOM 2194 O PRO C 43 54.342 32.000 58.768 1.00 9.85 C -ATOM 2195 CB PRO C 43 55.701 31.207 61.650 1.00 9.38 C -ATOM 2196 CG PRO C 43 56.141 32.652 61.567 1.00 9.11 C -ATOM 2197 CD PRO C 43 57.216 32.661 60.480 1.00 8.87 C -ATOM 2198 N ALA C 44 53.711 29.882 59.303 1.00 11.00 C -ATOM 2199 CA ALA C 44 52.480 29.932 58.508 1.00 11.90 C -ATOM 2200 C ALA C 44 51.404 30.874 59.042 1.00 12.03 C -ATOM 2201 O ALA C 44 50.802 31.691 58.329 1.00 13.47 C -ATOM 2202 CB ALA C 44 51.963 28.484 58.433 1.00 12.50 C -ATOM 2203 N ASP C 45 51.148 30.762 60.303 1.00 11.52 C -ATOM 2204 CA ASP C 45 50.149 31.428 61.135 1.00 11.81 C -ATOM 2205 C ASP C 45 50.292 32.946 61.109 1.00 10.80 C -ATOM 2206 O ASP C 45 51.424 33.415 61.365 1.00 9.73 C -ATOM 2207 CB ASP C 45 50.311 30.749 62.522 1.00 12.76 C -ATOM 2208 CG ASP C 45 49.304 31.268 63.505 1.00 14.25 C -ATOM 2209 OD1 ASP C 45 49.667 32.157 64.292 1.00 13.77 C -ATOM 2210 OD2 ASP C 45 48.132 30.805 63.527 1.00 15.41 C -ATOM 2211 N VAL C 46 49.235 33.695 60.863 1.00 10.67 C -ATOM 2212 CA VAL C 46 49.368 35.167 60.837 1.00 9.52 C -ATOM 2213 C VAL C 46 49.754 35.756 62.188 1.00 7.84 C -ATOM 2214 O VAL C 46 50.509 36.743 62.245 1.00 7.66 C -ATOM 2215 CB VAL C 46 48.136 35.839 60.208 1.00 10.26 C -ATOM 2216 CG1 VAL C 46 46.877 35.681 61.046 1.00 10.79 C -ATOM 2217 CG2 VAL C 46 48.431 37.284 59.868 1.00 10.65 C -ATOM 2218 N ALA C 47 49.237 35.185 63.265 1.00 7.55 C -ATOM 2219 CA ALA C 47 49.612 35.697 64.600 1.00 7.95 C -ATOM 2220 C ALA C 47 51.114 35.497 64.795 1.00 7.45 C -ATOM 2221 O ALA C 47 51.831 36.408 65.283 1.00 7.40 C -ATOM 2222 CB ALA C 47 48.813 35.003 65.692 1.00 8.33 C -ATOM 2223 N ALA C 48 51.602 34.327 64.432 1.00 6.86 C -ATOM 2224 CA ALA C 48 53.034 34.040 64.567 1.00 6.14 C -ATOM 2225 C ALA C 48 53.826 34.976 63.666 1.00 5.74 C -ATOM 2226 O ALA C 48 54.919 35.401 64.063 1.00 5.87 C -ATOM 2227 CB ALA C 48 53.277 32.576 64.257 1.00 6.39 C -ATOM 2228 N GLN C 49 53.331 35.270 62.494 1.00 5.59 C -ATOM 2229 CA GLN C 49 54.043 36.209 61.597 1.00 5.03 C -ATOM 2230 C GLN C 49 54.116 37.590 62.247 1.00 4.68 C -ATOM 2231 O GLN C 49 55.172 38.233 62.234 1.00 5.23 C -ATOM 2232 CB GLN C 49 53.385 36.255 60.225 1.00 5.71 C -ATOM 2233 CG GLN C 49 53.671 34.994 59.395 1.00 6.17 C -ATOM 2234 CD GLN C 49 53.381 35.202 57.921 1.00 5.93 C -ATOM 2235 OE1 GLN C 49 53.335 36.340 57.420 1.00 5.99 C -ATOM 2236 NE2 GLN C 49 53.220 34.110 57.175 1.00 6.38 C -ATOM 2237 N ALA C 50 52.982 38.029 62.786 1.00 4.71 C -ATOM 2238 CA ALA C 50 53.010 39.364 63.431 1.00 4.54 C -ATOM 2239 C ALA C 50 54.046 39.396 64.554 1.00 4.94 C -ATOM 2240 O ALA C 50 54.833 40.349 64.694 1.00 4.87 C -ATOM 2241 CB ALA C 50 51.649 39.764 63.973 1.00 5.66 C -ATOM 2242 N ARG C 51 54.078 38.327 65.338 1.00 5.38 C -ATOM 2243 CA ARG C 51 55.051 38.260 66.439 1.00 5.49 C -ATOM 2244 C ARG C 51 56.478 38.200 65.950 1.00 5.04 C -ATOM 2245 O ARG C 51 57.349 38.845 66.565 1.00 6.12 C -ATOM 2246 CB ARG C 51 54.730 37.136 67.419 1.00 6.73 C -ATOM 2247 CG ARG C 51 55.631 37.074 68.640 1.00 7.56 C -ATOM 2248 CD ARG C 51 55.064 36.205 69.722 1.00 8.32 C -ATOM 2249 NE ARG C 51 53.902 36.735 70.418 1.00 8.95 C -ATOM 2250 CZ ARG C 51 53.925 37.601 71.442 1.00 9.18 C -ATOM 2251 NH1 ARG C 51 55.070 38.084 71.924 1.00 8.39 C -ATOM 2252 NH2 ARG C 51 52.772 37.999 71.993 1.00 10.81 C -ATOM 2253 N GLN C 52 56.762 37.460 64.896 1.00 4.75 C -ATOM 2254 CA GLN C 52 58.134 37.375 64.365 1.00 4.61 C -ATOM 2255 C GLN C 52 58.546 38.755 63.848 1.00 4.34 C -ATOM 2256 O GLN C 52 59.715 39.161 64.060 1.00 4.87 C -ATOM 2257 CB GLN C 52 58.235 36.296 63.303 1.00 5.74 C -ATOM 2258 CG GLN C 52 59.657 36.148 62.806 1.00 5.80 C -ATOM 2259 CD GLN C 52 60.622 35.679 63.854 1.00 6.30 C -ATOM 2260 OE1 GLN C 52 60.690 34.471 64.133 1.00 7.97 C -ATOM 2261 NE2 GLN C 52 61.386 36.576 64.428 1.00 7.04 C -ATOM 2262 N SER C 53 57.667 39.438 63.125 1.00 4.36 C -ATOM 2263 CA SER C 53 58.016 40.796 62.658 1.00 4.64 C -ATOM 2264 C SER C 53 58.319 41.730 63.831 1.00 4.34 C -ATOM 2265 O SER C 53 59.298 42.486 63.783 1.00 4.42 C -ATOM 2266 CB SER C 53 56.895 41.346 61.801 1.00 5.03 C -ATOM 2267 OG SER C 53 56.920 40.874 60.480 1.00 7.71 C -ATOM 2268 N LEU C 54 57.494 41.672 64.858 1.00 4.12 C -ATOM 2269 CA LEU C 54 57.715 42.501 66.053 1.00 4.70 C -ATOM 2270 C LEU C 54 59.020 42.130 66.747 1.00 3.93 C -ATOM 2271 O LEU C 54 59.740 43.026 67.222 1.00 4.71 C -ATOM 2272 CB LEU C 54 56.508 42.407 66.961 1.00 5.03 C -ATOM 2273 CG LEU C 54 55.288 43.166 66.430 1.00 5.82 C -ATOM 2274 CD1 LEU C 54 54.045 42.760 67.223 1.00 5.88 C -ATOM 2275 CD2 LEU C 54 55.463 44.673 66.492 1.00 6.70 C -ATOM 2276 N ASP C 55 59.334 40.853 66.819 1.00 4.46 C -ATOM 2277 CA ASP C 55 60.595 40.440 67.461 1.00 4.76 C -ATOM 2278 C ASP C 55 61.777 40.976 66.648 1.00 5.09 C -ATOM 2279 O ASP C 55 62.801 41.316 67.240 1.00 4.83 C -ATOM 2280 CB ASP C 55 60.620 38.926 67.603 1.00 6.75 C -ATOM 2281 CG ASP C 55 59.894 38.396 68.831 1.00 8.66 C -ATOM 2282 OD1 ASP C 55 59.457 37.229 68.842 1.00 10.67 C -ATOM 2283 OD2 ASP C 55 59.813 39.156 69.804 1.00 10.74 C -ATOM 2284 N ASN C 56 61.607 40.966 65.338 1.00 4.45 C -ATOM 2285 CA ASN C 56 62.713 41.477 64.473 1.00 3.71 C -ATOM 2286 C ASN C 56 62.874 42.971 64.745 1.00 3.25 C -ATOM 2287 O ASN C 56 64.018 43.473 64.821 1.00 4.24 C -ATOM 2288 CB ASN C 56 62.455 41.182 62.994 1.00 4.47 C -ATOM 2289 CG ASN C 56 62.655 39.696 62.707 1.00 4.53 C -ATOM 2290 OD1 ASN C 56 63.249 38.956 63.521 1.00 5.62 C -ATOM 2291 ND2 ASN C 56 62.124 39.213 61.580 1.00 4.94 C -ATOM 2292 N VAL C 57 61.766 43.710 64.803 1.00 4.41 C -ATOM 2293 CA VAL C 57 61.842 45.156 65.125 1.00 4.09 C -ATOM 2294 C VAL C 57 62.535 45.322 66.462 1.00 3.73 C -ATOM 2295 O VAL C 57 63.454 46.150 66.644 1.00 4.05 C -ATOM 2296 CB VAL C 57 60.449 45.777 65.167 1.00 4.49 C -ATOM 2297 CG1 VAL C 57 60.478 47.143 65.858 1.00 5.66 C -ATOM 2298 CG2 VAL C 57 59.829 45.886 63.791 1.00 5.00 C -ATOM 2299 N LYS C 58 62.121 44.563 67.461 1.00 3.78 C -ATOM 2300 CA LYS C 58 62.701 44.626 68.814 1.00 4.51 C -ATOM 2301 C LYS C 58 64.200 44.385 68.786 1.00 4.64 C -ATOM 2302 O LYS C 58 64.970 45.078 69.453 1.00 4.91 C -ATOM 2303 CB LYS C 58 62.023 43.566 69.685 1.00 5.87 C -ATOM 2304 CG LYS C 58 62.715 43.368 71.037 1.00 6.61 C -ATOM 2305 CD LYS C 58 61.914 42.422 71.911 1.00 8.95 C -ATOM 2306 CE LYS C 58 62.736 41.827 73.036 1.00 9.79 C -ATOM 2307 NZ LYS C 58 61.926 40.944 73.903 1.00 10.97 C -ATOM 2308 N ALA C 59 64.648 43.393 68.027 1.00 4.57 C -ATOM 2309 CA ALA C 59 66.089 43.097 67.955 1.00 4.83 C -ATOM 2310 C ALA C 59 66.884 44.313 67.483 1.00 4.63 C -ATOM 2311 O ALA C 59 67.993 44.584 67.996 1.00 4.41 C -ATOM 2312 CB ALA C 59 66.337 41.941 67.000 1.00 5.64 C -ATOM 2313 N ILE C 60 66.365 45.015 66.485 1.00 4.27 C -ATOM 2314 CA ILE C 60 67.056 46.183 65.916 1.00 4.66 C -ATOM 2315 C ILE C 60 67.056 47.337 66.898 1.00 3.81 C -ATOM 2316 O ILE C 60 68.071 48.023 67.079 1.00 4.20 C -ATOM 2317 CB ILE C 60 66.403 46.509 64.546 1.00 4.36 C -ATOM 2318 CG1 ILE C 60 66.623 45.317 63.588 1.00 4.56 C -ATOM 2319 CG2 ILE C 60 66.941 47.835 63.966 1.00 4.23 C -ATOM 2320 CD1 ILE C 60 65.655 45.375 62.373 1.00 5.34 C -ATOM 2321 N VAL C 61 65.896 47.603 67.504 1.00 3.65 C -ATOM 2322 CA VAL C 61 65.787 48.677 68.511 1.00 4.56 C -ATOM 2323 C VAL C 61 66.702 48.400 69.698 1.00 4.22 C -ATOM 2324 O VAL C 61 67.411 49.299 70.160 1.00 4.43 C -ATOM 2325 CB VAL C 61 64.309 48.830 68.907 1.00 4.74 C -ATOM 2326 CG1 VAL C 61 64.101 49.722 70.122 1.00 5.69 C -ATOM 2327 CG2 VAL C 61 63.493 49.318 67.725 1.00 5.47 C -ATOM 2328 N GLU C 62 66.723 47.153 70.151 1.00 4.43 C -ATOM 2329 CA GLU C 62 67.592 46.812 71.288 1.00 4.95 C -ATOM 2330 C GLU C 62 69.052 46.887 70.885 1.00 5.30 C -ATOM 2331 O GLU C 62 69.907 47.256 71.723 1.00 5.38 C -ATOM 2332 CB GLU C 62 67.274 45.453 71.893 1.00 5.58 C -ATOM 2333 CG GLU C 62 65.906 45.458 72.586 1.00 7.08 C -ATOM 2334 CD GLU C 62 65.533 44.237 73.352 1.00 8.46 C -ATOM 2335 OE1 GLU C 62 64.697 44.288 74.252 1.00 10.06 C -ATOM 2336 OE2 GLU C 62 66.109 43.157 73.067 1.00 10.50 C -ATOM 2337 N ALA C 63 69.401 46.584 69.650 1.00 5.02 C -ATOM 2338 CA ALA C 63 70.802 46.655 69.190 1.00 4.80 C -ATOM 2339 C ALA C 63 71.281 48.101 69.229 1.00 4.67 C -ATOM 2340 O ALA C 63 72.498 48.351 69.284 1.00 5.23 C -ATOM 2341 CB ALA C 63 70.900 46.025 67.832 1.00 4.87 C -ATOM 2342 N ALA C 64 70.374 49.063 69.195 1.00 4.95 C -ATOM 2343 CA ALA C 64 70.725 50.469 69.277 1.00 5.12 C -ATOM 2344 C ALA C 64 70.686 50.966 70.720 1.00 5.56 C -ATOM 2345 O ALA C 64 70.844 52.193 70.916 1.00 6.36 C -ATOM 2346 CB ALA C 64 69.816 51.305 68.378 1.00 6.01 C -ATOM 2347 N GLY C 65 70.458 50.111 71.682 1.00 5.32 C -ATOM 2348 CA GLY C 65 70.438 50.514 73.092 1.00 5.69 C -ATOM 2349 C GLY C 65 69.073 50.980 73.563 1.00 5.00 C -ATOM 2350 O GLY C 65 69.029 51.580 74.662 1.00 6.60 C -ATOM 2351 N LEU C 66 68.006 50.731 72.813 1.00 4.89 C -ATOM 2352 CA LEU C 66 66.660 51.180 73.201 1.00 5.10 C -ATOM 2353 C LEU C 66 65.820 49.989 73.579 1.00 5.52 C -ATOM 2354 O LEU C 66 66.215 48.832 73.428 1.00 6.12 C -ATOM 2355 CB LEU C 66 66.064 52.009 72.059 1.00 5.47 C -ATOM 2356 CG LEU C 66 66.729 53.366 71.886 1.00 7.05 C -ATOM 2357 CD1 LEU C 66 65.995 54.150 70.805 1.00 7.79 C -ATOM 2358 CD2 LEU C 66 66.813 54.124 73.209 1.00 8.50 C -ATOM 2359 N LYS C 67 64.601 50.268 74.007 1.00 5.84 C -ATOM 2360 CA LYS C 67 63.637 49.228 74.408 1.00 6.22 C -ATOM 2361 C LYS C 67 62.402 49.343 73.532 1.00 5.40 C -ATOM 2362 O LYS C 67 62.130 50.377 72.892 1.00 5.50 C -ATOM 2363 CB LYS C 67 63.194 49.489 75.855 1.00 8.08 C -ATOM 2364 CG LYS C 67 64.348 49.479 76.860 1.00 10.38 C -ATOM 2365 CD LYS C 67 63.839 49.838 78.259 1.00 13.10 C -ATOM 2366 CE LYS C 67 64.978 49.778 79.272 1.00 14.74 C -ATOM 2367 NZ LYS C 67 64.415 49.892 80.648 1.00 16.76 C -ATOM 2368 N VAL C 68 61.611 48.260 73.571 1.00 5.45 C -ATOM 2369 CA VAL C 68 60.318 48.274 72.874 1.00 5.05 C -ATOM 2370 C VAL C 68 59.513 49.501 73.341 1.00 5.56 C -ATOM 2371 O VAL C 68 58.804 50.091 72.512 1.00 5.83 C -ATOM 2372 CB VAL C 68 59.566 46.958 73.124 1.00 5.97 C -ATOM 2373 CG1 VAL C 68 58.097 47.047 72.733 1.00 6.44 C -ATOM 2374 CG2 VAL C 68 60.292 45.781 72.484 1.00 7.15 C -ATOM 2375 N GLY C 69 59.620 49.861 74.607 1.00 5.71 C -ATOM 2376 CA GLY C 69 58.890 51.014 75.148 1.00 6.22 C -ATOM 2377 C GLY C 69 59.314 52.347 74.533 1.00 5.67 C -ATOM 2378 O GLY C 69 58.601 53.347 74.754 1.00 6.75 C -ATOM 2379 N ASP C 70 60.435 52.380 73.824 1.00 4.83 C -ATOM 2380 CA ASP C 70 60.912 53.599 73.148 1.00 5.11 C -ATOM 2381 C ASP C 70 60.358 53.725 71.723 1.00 4.14 C -ATOM 2382 O ASP C 70 60.662 54.733 71.075 1.00 4.50 C -ATOM 2383 CB ASP C 70 62.438 53.647 73.177 1.00 5.29 C -ATOM 2384 CG ASP C 70 63.006 53.641 74.595 1.00 6.10 C -ATOM 2385 OD1 ASP C 70 63.965 52.875 74.820 1.00 6.91 C -ATOM 2386 OD2 ASP C 70 62.444 54.367 75.421 1.00 6.71 C -ATOM 2387 N ILE C 71 59.653 52.727 71.273 1.00 4.31 C -ATOM 2388 CA ILE C 71 59.080 52.803 69.910 1.00 4.32 C -ATOM 2389 C ILE C 71 57.903 53.793 69.964 1.00 3.98 C -ATOM 2390 O ILE C 71 57.004 53.583 70.796 1.00 5.01 C -ATOM 2391 CB ILE C 71 58.633 51.394 69.417 1.00 4.70 C -ATOM 2392 CG1 ILE C 71 59.861 50.449 69.260 1.00 4.36 C -ATOM 2393 CG2 ILE C 71 57.847 51.552 68.095 1.00 4.30 C -ATOM 2394 CD1 ILE C 71 59.494 48.952 69.090 1.00 4.71 C -ATOM 2395 N VAL C 72 57.918 54.776 69.082 1.00 3.47 C -ATOM 2396 CA VAL C 72 56.889 55.822 69.101 1.00 3.99 C -ATOM 2397 C VAL C 72 56.023 55.826 67.872 1.00 3.90 C -ATOM 2398 O VAL C 72 54.930 56.434 67.929 1.00 4.27 C -ATOM 2399 CB VAL C 72 57.550 57.201 69.355 1.00 4.41 C -ATOM 2400 CG1 VAL C 72 58.134 57.263 70.752 1.00 5.07 C -ATOM 2401 CG2 VAL C 72 58.575 57.520 68.283 1.00 5.77 C -ATOM 2402 N LYS C 73 56.414 55.155 66.779 1.00 3.52 C -ATOM 2403 CA LYS C 73 55.571 55.125 65.579 1.00 4.16 C -ATOM 2404 C LYS C 73 55.868 53.841 64.797 1.00 4.31 C -ATOM 2405 O LYS C 73 57.077 53.541 64.631 1.00 4.84 C -ATOM 2406 CB LYS C 73 55.893 56.294 64.647 1.00 5.02 C -ATOM 2407 CG LYS C 73 55.194 56.361 63.285 1.00 5.28 C -ATOM 2408 CD LYS C 73 53.682 56.411 63.319 1.00 5.37 C -ATOM 2409 CE LYS C 73 53.030 56.630 61.976 1.00 6.08 C -ATOM 2410 NZ LYS C 73 53.409 55.657 60.916 1.00 6.35 C -ATOM 2411 N THR C 74 54.825 53.193 64.350 1.00 3.73 C -ATOM 2412 CA THR C 74 55.013 52.052 63.456 1.00 3.85 C -ATOM 2413 C THR C 74 54.103 52.262 62.249 1.00 3.84 C -ATOM 2414 O THR C 74 53.119 53.017 62.260 1.00 3.85 C -ATOM 2415 CB THR C 74 54.626 50.705 64.155 1.00 4.06 C -ATOM 2416 OG1 THR C 74 53.208 50.782 64.451 1.00 4.62 C -ATOM 2417 CG2 THR C 74 55.461 50.387 65.381 1.00 4.69 C -ATOM 2418 N THR C 75 54.460 51.537 61.192 1.00 3.73 C -ATOM 2419 CA THR C 75 53.559 51.389 60.053 1.00 4.09 C -ATOM 2420 C THR C 75 53.439 49.849 59.881 1.00 4.02 C -ATOM 2421 O THR C 75 54.483 49.180 59.787 1.00 4.60 C -ATOM 2422 CB THR C 75 53.947 52.052 58.716 1.00 5.33 C -ATOM 2423 OG1 THR C 75 53.995 53.481 59.053 1.00 6.90 C -ATOM 2424 CG2 THR C 75 52.938 51.782 57.597 1.00 6.26 C -ATOM 2425 N VAL C 76 52.221 49.388 59.859 1.00 3.79 C -ATOM 2426 CA VAL C 76 51.923 47.970 59.705 1.00 4.37 C -ATOM 2427 C VAL C 76 51.232 47.772 58.362 1.00 4.23 C -ATOM 2428 O VAL C 76 50.109 48.259 58.120 1.00 5.09 C -ATOM 2429 CB VAL C 76 51.017 47.518 60.873 1.00 5.09 C -ATOM 2430 CG1 VAL C 76 50.674 46.034 60.718 1.00 6.10 C -ATOM 2431 CG2 VAL C 76 51.642 47.745 62.256 1.00 5.44 C -ATOM 2432 N PHE C 77 51.943 47.079 57.500 1.00 3.73 C -ATOM 2433 CA PHE C 77 51.434 46.755 56.152 1.00 4.03 C -ATOM 2434 C PHE C 77 50.948 45.307 56.221 1.00 3.31 C -ATOM 2435 O PHE C 77 51.785 44.458 56.607 1.00 5.04 C -ATOM 2436 CB PHE C 77 52.535 46.861 55.114 1.00 3.99 C -ATOM 2437 CG PHE C 77 53.226 48.187 55.025 1.00 3.46 C -ATOM 2438 CD1 PHE C 77 54.494 48.378 55.589 1.00 4.75 C -ATOM 2439 CD2 PHE C 77 52.632 49.243 54.338 1.00 4.57 C -ATOM 2440 CE1 PHE C 77 55.186 49.580 55.436 1.00 5.64 C -ATOM 2441 CE2 PHE C 77 53.314 50.457 54.208 1.00 5.55 C -ATOM 2442 CZ PHE C 77 54.585 50.626 54.721 1.00 5.75 C -ATOM 2443 N VAL C 78 49.713 45.018 55.872 1.00 3.70 C -ATOM 2444 CA VAL C 78 49.221 43.641 55.909 1.00 4.71 C -ATOM 2445 C VAL C 78 48.751 43.220 54.528 1.00 4.55 C -ATOM 2446 O VAL C 78 48.352 44.038 53.710 1.00 4.79 C -ATOM 2447 CB VAL C 78 48.100 43.447 56.948 1.00 5.00 C -ATOM 2448 CG1 VAL C 78 48.575 43.745 58.363 1.00 6.84 C -ATOM 2449 CG2 VAL C 78 46.861 44.287 56.648 1.00 5.75 C -ATOM 2450 N LYS C 79 48.753 41.906 54.334 1.00 5.21 C -ATOM 2451 CA LYS C 79 48.222 41.315 53.107 1.00 5.74 C -ATOM 2452 C LYS C 79 46.696 41.199 53.200 1.00 6.17 C -ATOM 2453 O LYS C 79 46.034 41.240 52.134 1.00 6.76 C -ATOM 2454 CB LYS C 79 48.840 39.956 52.842 1.00 6.81 C -ATOM 2455 CG LYS C 79 48.264 39.231 51.634 1.00 8.82 C -ATOM 2456 CD LYS C 79 48.396 39.989 50.323 1.00 10.71 C -ATOM 2457 CE LYS C 79 47.516 39.447 49.209 1.00 11.66 C -ATOM 2458 NZ LYS C 79 46.072 39.707 49.470 1.00 13.37 C -ATOM 2459 N ASP C 80 46.123 41.078 54.376 1.00 6.31 C -ATOM 2460 CA ASP C 80 44.661 40.898 54.487 1.00 6.74 C -ATOM 2461 C ASP C 80 44.088 41.474 55.764 1.00 6.52 C -ATOM 2462 O ASP C 80 44.340 40.896 56.841 1.00 7.52 C -ATOM 2463 CB ASP C 80 44.370 39.382 54.361 1.00 7.41 C -ATOM 2464 CG ASP C 80 42.895 39.052 54.297 1.00 8.15 C -ATOM 2465 OD1 ASP C 80 42.544 37.864 54.054 1.00 10.21 C -ATOM 2466 OD2 ASP C 80 42.034 39.923 54.466 1.00 8.03 C -ATOM 2467 N LEU C 81 43.364 42.574 55.668 1.00 6.91 C -ATOM 2468 CA LEU C 81 42.760 43.190 56.846 1.00 8.19 C -ATOM 2469 C LEU C 81 41.754 42.250 57.501 1.00 8.43 C -ATOM 2470 O LEU C 81 41.386 42.540 58.657 1.00 9.36 C -ATOM 2471 CB LEU C 81 42.188 44.569 56.573 1.00 8.43 C -ATOM 2472 CG LEU C 81 43.238 45.680 56.623 1.00 8.40 C -ATOM 2473 CD1 LEU C 81 42.606 46.935 56.024 1.00 9.27 C -ATOM 2474 CD2 LEU C 81 43.682 45.909 58.050 1.00 9.04 C -ATOM 2475 N ASN C 82 41.326 41.191 56.839 1.00 8.67 C -ATOM 2476 CA ASN C 82 40.394 40.271 57.540 1.00 9.87 C -ATOM 2477 C ASN C 82 41.113 39.557 58.691 1.00 10.44 C -ATOM 2478 O ASN C 82 40.434 39.033 59.592 1.00 11.63 C -ATOM 2479 CB ASN C 82 39.715 39.283 56.608 1.00 10.51 C -ATOM 2480 CG ASN C 82 38.642 39.992 55.772 1.00 10.87 C -ATOM 2481 OD1 ASN C 82 38.003 40.917 56.248 1.00 11.41 C -ATOM 2482 ND2 ASN C 82 38.505 39.530 54.538 1.00 11.83 C -ATOM 2483 N ASP C 83 42.430 39.542 58.688 1.00 10.73 C -ATOM 2484 CA ASP C 83 43.195 38.901 59.787 1.00 11.58 C -ATOM 2485 C ASP C 83 43.606 39.956 60.809 1.00 11.57 C -ATOM 2486 O ASP C 83 44.366 39.650 61.760 1.00 11.86 C -ATOM 2487 CB ASP C 83 44.409 38.174 59.225 1.00 12.86 C -ATOM 2488 CG ASP C 83 44.116 36.833 58.600 1.00 13.31 C -ATOM 2489 OD1 ASP C 83 44.833 36.447 57.683 1.00 14.31 C -ATOM 2490 OD2 ASP C 83 43.183 36.124 59.090 1.00 15.40 C -ATOM 2491 N PHE C 84 43.112 41.173 60.688 1.00 11.64 C -ATOM 2492 CA PHE C 84 43.566 42.211 61.630 1.00 12.27 C -ATOM 2493 C PHE C 84 43.200 42.034 63.088 1.00 11.14 C -ATOM 2494 O PHE C 84 43.995 42.522 63.933 1.00 10.67 C -ATOM 2495 CB PHE C 84 43.296 43.608 61.082 1.00 13.85 C -ATOM 2496 CG PHE C 84 44.457 44.516 61.435 1.00 15.36 C -ATOM 2497 CD1 PHE C 84 44.313 45.490 62.419 1.00 16.41 C -ATOM 2498 CD2 PHE C 84 45.675 44.347 60.771 1.00 15.95 C -ATOM 2499 CE1 PHE C 84 45.396 46.316 62.724 1.00 17.08 C -ATOM 2500 CE2 PHE C 84 46.757 45.182 61.074 1.00 16.89 C -ATOM 2501 CZ PHE C 84 46.612 46.170 62.051 1.00 16.95 C -ATOM 2502 N ALA C 85 42.102 41.392 63.448 1.00 10.77 C -ATOM 2503 CA ALA C 85 41.794 41.220 64.879 1.00 10.60 C -ATOM 2504 C ALA C 85 42.914 40.407 65.535 1.00 9.89 C -ATOM 2505 O ALA C 85 43.346 40.689 66.653 1.00 9.55 C -ATOM 2506 CB ALA C 85 40.425 40.575 65.072 1.00 11.44 C -ATOM 2507 N THR C 86 43.359 39.403 64.784 1.00 10.27 C -ATOM 2508 CA THR C 86 44.420 38.507 65.263 1.00 10.82 C -ATOM 2509 C THR C 86 45.740 39.247 65.418 1.00 9.25 C -ATOM 2510 O THR C 86 46.473 39.123 66.418 1.00 8.54 C -ATOM 2511 CB THR C 86 44.584 37.245 64.317 1.00 12.16 C -ATOM 2512 OG1 THR C 86 43.272 36.607 64.271 1.00 13.99 C -ATOM 2513 CG2 THR C 86 45.690 36.315 64.815 1.00 12.79 C -ATOM 2514 N VAL C 87 46.057 40.011 64.392 1.00 8.71 C -ATOM 2515 CA VAL C 87 47.289 40.822 64.395 1.00 8.40 C -ATOM 2516 C VAL C 87 47.232 41.809 65.555 1.00 7.98 C -ATOM 2517 O VAL C 87 48.236 41.965 66.265 1.00 8.35 C -ATOM 2518 CB VAL C 87 47.470 41.540 63.043 1.00 8.84 C -ATOM 2519 CG1 VAL C 87 48.539 42.621 63.167 1.00 9.19 C -ATOM 2520 CG2 VAL C 87 47.778 40.533 61.950 1.00 9.80 C -ATOM 2521 N ASN C 88 46.109 42.472 65.711 1.00 7.83 C -ATOM 2522 CA ASN C 88 45.933 43.463 66.775 1.00 9.07 C -ATOM 2523 C ASN C 88 46.146 42.851 68.144 1.00 8.46 C -ATOM 2524 O ASN C 88 46.768 43.450 69.026 1.00 7.86 C -ATOM 2525 CB ASN C 88 44.572 44.145 66.740 1.00 10.40 C -ATOM 2526 CG ASN C 88 44.610 45.540 66.169 1.00 11.76 C -ATOM 2527 OD1 ASN C 88 45.662 46.210 66.239 1.00 12.61 C -ATOM 2528 ND2 ASN C 88 43.454 45.921 65.615 1.00 13.35 C -ATOM 2529 N ALA C 89 45.587 41.664 68.340 1.00 7.67 C -ATOM 2530 CA ALA C 89 45.742 40.975 69.637 1.00 7.58 C -ATOM 2531 C ALA C 89 47.212 40.678 69.934 1.00 6.88 C -ATOM 2532 O ALA C 89 47.682 40.867 71.066 1.00 7.11 C -ATOM 2533 CB ALA C 89 44.884 39.713 69.635 1.00 8.02 C -ATOM 2534 N THR C 90 47.898 40.173 68.916 1.00 7.04 C -ATOM 2535 CA THR C 90 49.326 39.858 69.089 1.00 7.07 C -ATOM 2536 C THR C 90 50.133 41.132 69.328 1.00 6.37 C -ATOM 2537 O THR C 90 51.031 41.163 70.183 1.00 6.22 C -ATOM 2538 CB THR C 90 49.853 39.083 67.823 1.00 7.91 C -ATOM 2539 OG1 THR C 90 49.254 37.752 67.848 1.00 10.49 C -ATOM 2540 CG2 THR C 90 51.378 39.020 67.792 1.00 9.07 C -ATOM 2541 N TYR C 91 49.837 42.164 68.549 1.00 6.16 C -ATOM 2542 CA TYR C 91 50.539 43.451 68.653 1.00 5.79 C -ATOM 2543 C TYR C 91 50.341 44.026 70.048 1.00 5.81 C -ATOM 2544 O TYR C 91 51.278 44.488 70.724 1.00 6.66 C -ATOM 2545 CB TYR C 91 50.008 44.344 67.546 1.00 5.88 C -ATOM 2546 CG TYR C 91 50.645 45.698 67.369 1.00 5.59 C -ATOM 2547 CD1 TYR C 91 51.497 45.958 66.295 1.00 5.96 C -ATOM 2548 CD2 TYR C 91 50.394 46.730 68.267 1.00 6.04 C -ATOM 2549 CE1 TYR C 91 52.070 47.210 66.067 1.00 5.47 C -ATOM 2550 CE2 TYR C 91 50.940 47.994 68.093 1.00 6.05 C -ATOM 2551 CZ TYR C 91 51.768 48.210 66.985 1.00 5.90 C -ATOM 2552 OH TYR C 91 52.315 49.467 66.804 1.00 5.93 C -ATOM 2553 N GLU C 92 49.095 44.002 70.502 1.00 6.05 C -ATOM 2554 CA GLU C 92 48.771 44.514 71.841 1.00 6.75 C -ATOM 2555 C GLU C 92 49.548 43.765 72.917 1.00 6.71 C -ATOM 2556 O GLU C 92 50.151 44.350 73.846 1.00 7.08 C -ATOM 2557 CB GLU C 92 47.269 44.437 72.138 1.00 8.59 C -ATOM 2558 CG GLU C 92 46.875 44.989 73.518 1.00 11.80 C -ATOM 2559 CD GLU C 92 45.500 45.544 73.634 1.00 15.28 C -ATOM 2560 OE1 GLU C 92 45.106 46.349 74.486 1.00 18.01 C -ATOM 2561 OE2 GLU C 92 44.704 45.182 72.757 1.00 17.25 C -ATOM 2562 N ALA C 93 49.534 42.434 72.824 1.00 6.56 C -ATOM 2563 CA ALA C 93 50.239 41.573 73.786 1.00 7.09 C -ATOM 2564 C ALA C 93 51.726 41.900 73.817 1.00 6.90 C -ATOM 2565 O ALA C 93 52.313 42.030 74.895 1.00 7.00 C -ATOM 2566 CB ALA C 93 50.036 40.092 73.460 1.00 7.57 C -ATOM 2567 N PHE C 94 52.302 42.042 72.618 1.00 6.67 C -ATOM 2568 CA PHE C 94 53.752 42.332 72.516 1.00 6.61 C -ATOM 2569 C PHE C 94 54.131 43.597 73.288 1.00 5.97 C -ATOM 2570 O PHE C 94 55.105 43.607 74.054 1.00 6.59 C -ATOM 2571 CB PHE C 94 54.101 42.401 71.034 1.00 7.02 C -ATOM 2572 CG PHE C 94 55.555 42.599 70.771 1.00 7.23 C -ATOM 2573 CD1 PHE C 94 56.358 41.464 70.713 1.00 8.12 C -ATOM 2574 CD2 PHE C 94 56.098 43.862 70.605 1.00 8.71 C -ATOM 2575 CE1 PHE C 94 57.717 41.545 70.478 1.00 9.74 C -ATOM 2576 CE2 PHE C 94 57.485 43.979 70.367 1.00 9.96 C -ATOM 2577 CZ PHE C 94 58.243 42.813 70.332 1.00 9.82 C -ATOM 2578 N PHE C 95 53.389 44.675 73.086 1.00 5.98 C -ATOM 2579 CA PHE C 95 53.651 45.951 73.781 1.00 6.00 C -ATOM 2580 C PHE C 95 53.417 45.784 75.281 1.00 6.18 C -ATOM 2581 O PHE C 95 54.226 46.266 76.101 1.00 6.81 C -ATOM 2582 CB PHE C 95 52.962 47.140 73.124 1.00 6.51 C -ATOM 2583 CG PHE C 95 53.714 47.524 71.874 1.00 6.57 C -ATOM 2584 CD1 PHE C 95 53.373 47.028 70.622 1.00 7.43 C -ATOM 2585 CD2 PHE C 95 54.850 48.341 71.976 1.00 6.79 C -ATOM 2586 CE1 PHE C 95 54.111 47.329 69.479 1.00 7.20 C -ATOM 2587 CE2 PHE C 95 55.584 48.669 70.841 1.00 7.08 C -ATOM 2588 CZ PHE C 95 55.238 48.145 69.594 1.00 7.03 C -ATOM 2589 N THR C 96 52.319 45.112 75.622 1.00 6.49 C -ATOM 2590 CA THR C 96 52.019 44.897 77.053 1.00 8.11 C -ATOM 2591 C THR C 96 53.131 44.112 77.732 1.00 7.33 C -ATOM 2592 O THR C 96 53.504 44.429 78.891 1.00 7.70 C -ATOM 2593 CB THR C 96 50.627 44.186 77.231 1.00 9.27 C -ATOM 2594 OG1 THR C 96 49.670 45.085 76.633 1.00 11.25 C -ATOM 2595 CG2 THR C 96 50.311 43.881 78.696 1.00 9.94 C -ATOM 2596 N GLU C 97 53.665 43.106 77.060 1.00 7.31 C -ATOM 2597 CA GLU C 97 54.743 42.266 77.615 1.00 8.29 C -ATOM 2598 C GLU C 97 55.957 43.102 77.942 1.00 7.86 C -ATOM 2599 O GLU C 97 56.745 42.748 78.850 1.00 9.08 C -ATOM 2600 CB GLU C 97 55.168 41.175 76.606 1.00 8.63 C -ATOM 2601 CG GLU C 97 54.068 40.094 76.405 1.00 9.19 C -ATOM 2602 CD GLU C 97 54.140 39.441 75.045 1.00 9.70 C -ATOM 2603 OE1 GLU C 97 55.128 39.587 74.338 1.00 10.55 C -ATOM 2604 OE2 GLU C 97 53.131 38.781 74.714 1.00 11.38 C -ATOM 2605 N HIS C 98 56.159 44.220 77.252 1.00 7.67 C -ATOM 2606 CA HIS C 98 57.305 45.097 77.458 1.00 7.40 C -ATOM 2607 C HIS C 98 56.958 46.321 78.282 1.00 7.94 C -ATOM 2608 O HIS C 98 57.751 47.288 78.280 1.00 8.19 C -ATOM 2609 CB HIS C 98 57.908 45.506 76.069 1.00 7.48 C -ATOM 2610 CG HIS C 98 58.471 44.303 75.377 1.00 7.83 C -ATOM 2611 ND1 HIS C 98 57.790 43.472 74.517 1.00 7.93 C -ATOM 2612 CD2 HIS C 98 59.750 43.815 75.452 1.00 8.60 C -ATOM 2613 CE1 HIS C 98 58.614 42.522 74.117 1.00 8.30 C -ATOM 2614 NE2 HIS C 98 59.801 42.697 74.649 1.00 9.30 C -ATOM 2615 N ASN C 99 55.806 46.291 78.931 1.00 8.01 C -ATOM 2616 CA ASN C 99 55.341 47.423 79.752 1.00 8.93 C -ATOM 2617 C ASN C 99 55.499 48.728 78.974 1.00 7.82 C -ATOM 2618 O ASN C 99 55.928 49.777 79.517 1.00 8.81 C -ATOM 2619 CB ASN C 99 56.144 47.463 81.061 1.00 10.58 C -ATOM 2620 CG ASN C 99 55.546 48.447 82.056 1.00 11.86 C -ATOM 2621 OD1 ASN C 99 54.320 48.653 82.042 1.00 13.08 C -ATOM 2622 ND2 ASN C 99 56.417 49.031 82.877 1.00 13.49 C -ATOM 2623 N ALA C 100 55.106 48.690 77.711 1.00 7.10 C -ATOM 2624 CA ALA C 100 55.270 49.808 76.792 1.00 7.43 C -ATOM 2625 C ALA C 100 54.005 50.563 76.441 1.00 8.24 C -ATOM 2626 O ALA C 100 52.988 49.904 76.191 1.00 9.53 C -ATOM 2627 CB ALA C 100 55.884 49.262 75.483 1.00 7.38 C -ATOM 2628 N THR C 101 54.110 51.880 76.411 1.00 7.83 C -ATOM 2629 CA THR C 101 52.985 52.694 75.927 1.00 8.26 C -ATOM 2630 C THR C 101 52.883 52.331 74.436 1.00 7.07 C -ATOM 2631 O THR C 101 53.936 52.184 73.774 1.00 7.16 C -ATOM 2632 CB THR C 101 53.292 54.229 76.107 1.00 9.39 C -ATOM 2633 OG1 THR C 101 53.397 54.419 77.548 1.00 10.96 C -ATOM 2634 CG2 THR C 101 52.244 55.144 75.476 1.00 10.68 C -ATOM 2635 N PHE C 102 51.687 52.245 73.911 1.00 6.83 C -ATOM 2636 CA PHE C 102 51.556 51.894 72.488 1.00 6.82 C -ATOM 2637 C PHE C 102 52.049 53.025 71.584 1.00 6.10 C -ATOM 2638 O PHE C 102 51.781 54.203 71.847 1.00 6.28 C -ATOM 2639 CB PHE C 102 50.095 51.600 72.146 1.00 7.29 C -ATOM 2640 CG PHE C 102 49.431 50.546 72.979 1.00 7.87 C -ATOM 2641 CD1 PHE C 102 48.256 50.799 73.681 1.00 8.98 C -ATOM 2642 CD2 PHE C 102 49.997 49.264 73.053 1.00 7.94 C -ATOM 2643 CE1 PHE C 102 47.641 49.822 74.451 1.00 10.13 C -ATOM 2644 CE2 PHE C 102 49.401 48.256 73.816 1.00 8.74 C -ATOM 2645 CZ PHE C 102 48.219 48.548 74.523 1.00 9.67 C -ATOM 2646 N PRO C 103 52.750 52.655 70.515 1.00 6.23 C -ATOM 2647 CA PRO C 103 53.188 53.723 69.588 1.00 6.02 C -ATOM 2648 C PRO C 103 52.008 54.299 68.798 1.00 4.53 C -ATOM 2649 O PRO C 103 50.898 53.729 68.719 1.00 4.36 C -ATOM 2650 CB PRO C 103 54.011 52.895 68.557 1.00 7.30 C -ATOM 2651 CG PRO C 103 54.398 51.613 69.236 1.00 7.26 C -ATOM 2652 CD PRO C 103 53.207 51.314 70.155 1.00 6.81 C -ATOM 2653 N ALA C 104 52.268 55.432 68.152 1.00 4.08 C -ATOM 2654 CA ALA C 104 51.379 55.928 67.093 1.00 3.99 C -ATOM 2655 C ALA C 104 51.514 54.866 65.961 1.00 3.68 C -ATOM 2656 O ALA C 104 52.531 54.135 65.862 1.00 4.10 C -ATOM 2657 CB ALA C 104 51.799 57.278 66.624 1.00 4.60 C -ATOM 2658 N ARG C 105 50.488 54.754 65.116 1.00 4.14 C -ATOM 2659 CA ARG C 105 50.483 53.701 64.091 1.00 4.07 C -ATOM 2660 C ARG C 105 49.676 54.037 62.865 1.00 3.75 C -ATOM 2661 O ARG C 105 48.671 54.784 62.974 1.00 3.67 C -ATOM 2662 CB ARG C 105 49.844 52.439 64.776 1.00 5.04 C -ATOM 2663 CG ARG C 105 49.901 51.168 63.932 1.00 6.68 C -ATOM 2664 CD ARG C 105 49.471 49.920 64.669 1.00 7.36 C -ATOM 2665 NE ARG C 105 48.059 49.942 64.950 1.00 9.16 C -ATOM 2666 CZ ARG C 105 47.372 48.872 65.406 1.00 9.60 C -ATOM 2667 NH1 ARG C 105 46.061 48.897 65.570 1.00 10.15 C -ATOM 2668 NH2 ARG C 105 48.029 47.767 65.757 1.00 9.57 C -ATOM 2669 N SER C 106 50.143 53.519 61.735 1.00 3.97 C -ATOM 2670 CA SER C 106 49.356 53.565 60.496 1.00 4.51 C -ATOM 2671 C SER C 106 49.212 52.082 60.072 1.00 4.12 C -ATOM 2672 O SER C 106 50.144 51.289 60.266 1.00 4.73 C -ATOM 2673 CB SER C 106 49.959 54.353 59.374 1.00 5.49 C -ATOM 2674 OG SER C 106 49.957 55.710 59.796 1.00 6.48 C -HETATM 2675 N CSP C 107 48.054 51.758 59.505 1.00 4.52 C -HETATM 2676 CA CSP C 107 47.760 50.378 59.129 1.00 5.72 C -HETATM 2677 CB CSP C 107 46.804 49.700 60.089 0.67 8.42 C -HETATM 2679 SG CSP C 107 47.227 49.776 61.809 0.67 12.80 C -HETATM 2680 P CSP C 107 45.759 51.167 62.354 0.67 14.01 C -HETATM 2681 O1P CSP C 107 45.839 52.330 61.495 0.67 15.06 C -HETATM 2682 O2P CSP C 107 44.369 50.515 62.084 0.67 15.90 C -HETATM 2683 O3P CSP C 107 45.931 51.332 63.867 0.67 14.77 C -HETATM 2684 C CSP C 107 47.046 50.355 57.779 1.00 4.97 C -HETATM 2685 O CSP C 107 45.986 51.024 57.644 1.00 4.62 C -ATOM 2687 N VAL C 108 47.551 49.572 56.859 1.00 4.59 C -ATOM 2688 CA VAL C 108 46.918 49.485 55.529 1.00 4.55 C -ATOM 2689 C VAL C 108 47.075 48.074 55.005 1.00 4.55 C -ATOM 2690 O VAL C 108 48.046 47.373 55.353 1.00 4.69 C -ATOM 2691 CB VAL C 108 47.594 50.491 54.549 1.00 4.96 C -ATOM 2692 CG1 VAL C 108 47.484 51.949 54.998 1.00 5.33 C -ATOM 2693 CG2 VAL C 108 49.027 50.132 54.200 1.00 6.15 C -ATOM 2694 N GLU C 109 46.183 47.680 54.097 1.00 4.88 C -ATOM 2695 CA GLU C 109 46.293 46.413 53.393 1.00 4.49 C -ATOM 2696 C GLU C 109 46.954 46.709 52.038 1.00 4.13 C -ATOM 2697 O GLU C 109 46.405 47.528 51.280 1.00 5.16 C -ATOM 2698 CB GLU C 109 44.938 45.767 53.124 1.00 5.33 C -ATOM 2699 CG GLU C 109 45.089 44.371 52.523 1.00 5.37 C -ATOM 2700 CD GLU C 109 43.746 43.764 52.168 1.00 6.00 C -ATOM 2701 OE1 GLU C 109 43.552 43.382 51.012 1.00 7.16 C -ATOM 2702 OE2 GLU C 109 42.917 43.683 53.105 1.00 5.73 C -ATOM 2703 N VAL C 110 48.087 46.081 51.785 1.00 4.12 C -ATOM 2704 CA VAL C 110 48.778 46.266 50.496 1.00 5.16 C -ATOM 2705 C VAL C 110 48.429 45.106 49.561 1.00 4.97 C -ATOM 2706 O VAL C 110 47.748 44.159 49.994 1.00 5.83 C -ATOM 2707 CB VAL C 110 50.295 46.324 50.727 1.00 5.61 C -ATOM 2708 CG1 VAL C 110 50.678 47.521 51.594 1.00 6.03 C -ATOM 2709 CG2 VAL C 110 50.844 45.036 51.320 1.00 5.94 C -ATOM 2710 N ALA C 111 48.840 45.198 48.309 1.00 5.19 C -ATOM 2711 CA ALA C 111 48.558 44.126 47.352 1.00 5.46 C -ATOM 2712 C ALA C 111 49.429 42.900 47.562 1.00 5.34 C -ATOM 2713 O ALA C 111 48.964 41.750 47.334 1.00 6.46 C -ATOM 2714 CB ALA C 111 48.746 44.653 45.917 1.00 5.06 C -ATOM 2715 N ARG C 112 50.685 43.091 47.959 1.00 5.42 C -ATOM 2716 CA ARG C 112 51.619 41.972 48.127 1.00 5.97 C -ATOM 2717 C ARG C 112 52.817 42.478 48.900 1.00 5.15 C -ATOM 2718 O ARG C 112 53.130 43.687 48.874 1.00 5.33 C -ATOM 2719 CB ARG C 112 52.068 41.486 46.742 1.00 5.86 C -ATOM 2720 CG ARG C 112 52.715 40.113 46.714 1.00 7.01 C -ATOM 2721 CD ARG C 112 53.123 39.755 45.315 1.00 7.87 C -ATOM 2722 NE ARG C 112 53.754 38.438 45.315 1.00 9.03 C -ATOM 2723 CZ ARG C 112 54.495 37.936 44.312 1.00 9.58 C -ATOM 2724 NH1 ARG C 112 55.015 36.706 44.464 1.00 10.53 C -ATOM 2725 NH2 ARG C 112 54.677 38.619 43.181 1.00 10.02 C -ATOM 2726 N LEU C 113 53.475 41.571 49.596 1.00 5.16 C -ATOM 2727 CA LEU C 113 54.662 41.860 50.392 1.00 5.23 C -ATOM 2728 C LEU C 113 55.800 40.958 49.961 1.00 5.70 C -ATOM 2729 O LEU C 113 55.580 39.890 49.350 1.00 6.10 C -ATOM 2730 CB LEU C 113 54.335 41.632 51.873 1.00 5.50 C -ATOM 2731 CG LEU C 113 53.370 42.649 52.474 1.00 5.34 C -ATOM 2732 CD1 LEU C 113 52.921 42.176 53.859 1.00 5.70 C -ATOM 2733 CD2 LEU C 113 54.010 44.032 52.557 1.00 4.99 C -ATOM 2734 N PRO C 114 57.024 41.361 50.268 1.00 6.67 C -ATOM 2735 CA PRO C 114 58.195 40.539 49.934 1.00 7.38 C -ATOM 2736 C PRO C 114 57.984 39.124 50.475 1.00 7.04 C -ATOM 2737 O PRO C 114 57.489 38.861 51.586 1.00 7.08 C -ATOM 2738 CB PRO C 114 59.357 41.239 50.649 1.00 7.55 C -ATOM 2739 CG PRO C 114 58.922 42.679 50.756 1.00 7.89 C -ATOM 2740 CD PRO C 114 57.405 42.617 50.956 1.00 7.17 C -ATOM 2741 N LYS C 115 58.370 38.152 49.650 1.00 7.96 C -ATOM 2742 CA LYS C 115 58.299 36.717 49.953 1.00 9.22 C -ATOM 2743 C LYS C 115 56.876 36.276 50.209 1.00 9.21 C -ATOM 2744 O LYS C 115 56.725 35.203 50.835 1.00 9.21 C -ATOM 2745 CB LYS C 115 59.162 36.379 51.173 1.00 10.55 C -ATOM 2746 CG LYS C 115 60.632 36.740 50.934 1.00 12.98 C -ATOM 2747 CD LYS C 115 61.449 36.179 52.106 1.00 15.15 C -ATOM 2748 CE LYS C 115 62.932 36.188 51.791 1.00 16.92 C -ATOM 2749 NZ LYS C 115 63.588 34.907 52.176 1.00 18.34 C -ATOM 2750 N ASP C 116 55.882 37.020 49.783 1.00 8.41 C -ATOM 2751 CA ASP C 116 54.481 36.653 50.010 1.00 8.14 C -ATOM 2752 C ASP C 116 54.137 36.537 51.491 1.00 7.11 C -ATOM 2753 O ASP C 116 53.192 35.783 51.846 1.00 8.04 C -ATOM 2754 CB ASP C 116 54.075 35.408 49.198 1.00 9.13 C -ATOM 2755 CG ASP C 116 53.984 35.783 47.712 1.00 10.16 C -ATOM 2756 OD1 ASP C 116 54.853 35.295 46.977 1.00 11.23 C -ATOM 2757 OD2 ASP C 116 53.069 36.542 47.365 1.00 10.06 C -ATOM 2758 N VAL C 117 54.811 37.303 52.340 1.00 6.39 C -ATOM 2759 CA VAL C 117 54.470 37.277 53.781 1.00 5.93 C -ATOM 2760 C VAL C 117 53.123 37.988 53.972 1.00 5.45 C -ATOM 2761 O VAL C 117 52.615 38.671 53.077 1.00 5.92 C -ATOM 2762 CB VAL C 117 55.611 37.850 54.629 1.00 5.41 C -ATOM 2763 CG1 VAL C 117 56.910 37.045 54.552 1.00 6.56 C -ATOM 2764 CG2 VAL C 117 55.801 39.339 54.353 1.00 4.77 C -ATOM 2765 N LYS C 118 52.599 37.861 55.159 1.00 5.60 C -ATOM 2766 CA LYS C 118 51.309 38.448 55.494 1.00 5.78 C -ATOM 2767 C LYS C 118 51.421 39.794 56.190 1.00 5.20 C -ATOM 2768 O LYS C 118 50.398 40.449 56.351 1.00 4.89 C -ATOM 2769 CB LYS C 118 50.545 37.481 56.401 1.00 6.48 C -ATOM 2770 CG LYS C 118 50.197 36.142 55.766 1.00 8.03 C -ATOM 2771 CD LYS C 118 49.587 35.093 56.681 1.00 10.35 C -ATOM 2772 CE LYS C 118 49.354 33.779 55.939 1.00 12.02 C -ATOM 2773 NZ LYS C 118 48.768 32.708 56.770 1.00 13.89 C -ATOM 2774 N ILE C 119 52.620 40.201 56.595 1.00 4.72 C -ATOM 2775 CA ILE C 119 52.805 41.442 57.347 1.00 4.45 C -ATOM 2776 C ILE C 119 54.233 41.948 57.236 1.00 4.59 C -ATOM 2777 O ILE C 119 55.158 41.151 57.090 1.00 4.61 C -ATOM 2778 CB ILE C 119 52.378 41.166 58.835 1.00 4.91 C -ATOM 2779 CG1 ILE C 119 52.307 42.496 59.638 1.00 4.94 C -ATOM 2780 CG2 ILE C 119 53.294 40.145 59.557 1.00 5.42 C -ATOM 2781 CD1 ILE C 119 51.552 42.276 60.967 1.00 5.66 C -ATOM 2782 N GLU C 120 54.361 43.266 57.294 1.00 4.02 C -ATOM 2783 CA GLU C 120 55.668 43.938 57.295 1.00 3.81 C -ATOM 2784 C GLU C 120 55.491 45.119 58.249 1.00 3.77 C -ATOM 2785 O GLU C 120 54.507 45.874 58.112 1.00 4.01 C -ATOM 2786 CB GLU C 120 56.069 44.417 55.919 1.00 4.09 C -ATOM 2787 CG GLU C 120 57.420 45.120 55.856 1.00 4.28 C -ATOM 2788 CD GLU C 120 57.808 45.637 54.500 1.00 4.49 C -ATOM 2789 OE1 GLU C 120 58.514 46.641 54.356 1.00 6.49 C -ATOM 2790 OE2 GLU C 120 57.364 44.960 53.518 1.00 5.06 C -ATOM 2791 N ILE C 121 56.418 45.302 59.173 1.00 3.35 C -ATOM 2792 CA ILE C 121 56.304 46.382 60.161 1.00 3.57 C -ATOM 2793 C ILE C 121 57.596 47.173 60.255 1.00 3.38 C -ATOM 2794 O ILE C 121 58.665 46.614 60.488 1.00 3.55 C -ATOM 2795 CB ILE C 121 56.009 45.799 61.584 1.00 4.18 C -ATOM 2796 CG1 ILE C 121 54.777 44.888 61.562 1.00 5.00 C -ATOM 2797 CG2 ILE C 121 55.858 46.938 62.619 1.00 5.16 C -ATOM 2798 CD1 ILE C 121 54.470 44.198 62.912 1.00 5.62 C -ATOM 2799 N GLU C 122 57.456 48.487 60.086 1.00 3.62 C -ATOM 2800 CA GLU C 122 58.594 49.396 60.249 1.00 3.82 C -ATOM 2801 C GLU C 122 58.342 50.201 61.524 1.00 3.47 C -ATOM 2802 O GLU C 122 57.176 50.402 61.924 1.00 3.81 C -ATOM 2803 CB GLU C 122 58.847 50.309 59.073 1.00 6.01 C -ATOM 2804 CG GLU C 122 57.680 51.237 58.774 1.00 7.17 C -ATOM 2805 CD GLU C 122 57.886 52.243 57.696 1.00 8.33 C -ATOM 2806 OE1 GLU C 122 57.155 53.244 57.674 1.00 10.86 C -ATOM 2807 OE2 GLU C 122 58.772 52.050 56.839 1.00 7.19 C -ATOM 2808 N ALA C 123 59.418 50.651 62.151 1.00 4.17 C -ATOM 2809 CA ALA C 123 59.272 51.377 63.409 1.00 4.16 C -ATOM 2810 C ALA C 123 60.271 52.493 63.570 1.00 3.85 C -ATOM 2811 O ALA C 123 61.371 52.469 62.978 1.00 4.05 C -ATOM 2812 CB ALA C 123 59.479 50.429 64.603 1.00 5.43 C -ATOM 2813 N ILE C 124 59.869 53.494 64.325 1.00 3.64 C -ATOM 2814 CA ILE C 124 60.674 54.631 64.724 1.00 4.00 C -ATOM 2815 C ILE C 124 60.714 54.613 66.259 1.00 3.37 C -ATOM 2816 O ILE C 124 59.620 54.497 66.855 1.00 3.97 C -ATOM 2817 CB ILE C 124 60.087 56.000 64.242 1.00 5.41 C -ATOM 2818 CG1 ILE C 124 60.117 56.068 62.705 1.00 6.98 C -ATOM 2819 CG2 ILE C 124 60.874 57.183 64.859 1.00 6.64 C -ATOM 2820 CD1 ILE C 124 59.337 57.288 62.159 1.00 8.60 C -ATOM 2821 N ALA C 125 61.880 54.752 66.842 1.00 3.70 C -ATOM 2822 CA ALA C 125 62.068 54.808 68.301 1.00 4.32 C -ATOM 2823 C ALA C 125 62.930 56.028 68.635 1.00 3.88 C -ATOM 2824 O ALA C 125 63.665 56.523 67.777 1.00 4.96 C -ATOM 2825 CB ALA C 125 62.702 53.501 68.783 1.00 5.11 C -ATOM 2826 N VAL C 126 62.787 56.521 69.872 1.00 4.73 C -ATOM 2827 CA VAL C 126 63.588 57.683 70.287 1.00 5.32 C -ATOM 2828 C VAL C 126 64.218 57.397 71.648 1.00 5.65 C -ATOM 2829 O VAL C 126 63.670 56.687 72.479 1.00 6.01 C -ATOM 2830 CB VAL C 126 62.778 58.997 70.332 1.00 6.36 C -ATOM 2831 CG1 VAL C 126 62.402 59.496 68.943 1.00 7.37 C -ATOM 2832 CG2 VAL C 126 61.592 58.899 71.258 1.00 7.21 C -ATOM 2833 N ARG C 127 65.384 58.004 71.813 1.00 5.90 C -ATOM 2834 CA ARG C 127 66.095 57.867 73.105 1.00 8.86 C -ATOM 2835 C ARG C 127 65.483 58.748 74.200 1.00 10.67 C -ATOM 2836 O ARG C 127 65.521 58.297 75.374 1.00 12.25 C -ATOM 2837 CB ARG C 127 67.564 58.270 73.010 1.00 8.97 C -ATOM 2838 CG ARG C 127 68.304 57.429 71.998 1.00 8.83 C -ATOM 2839 CD ARG C 127 69.812 57.632 72.173 1.00 9.65 C -ATOM 2840 NE ARG C 127 70.494 56.885 71.128 1.00 8.63 C -ATOM 2841 CZ ARG C 127 70.713 55.591 71.181 1.00 8.65 C -ATOM 2842 NH1 ARG C 127 70.467 54.865 72.258 1.00 8.88 C -ATOM 2843 NH2 ARG C 127 71.099 54.968 70.066 1.00 8.68 C -ATOM 2844 N ARG C 128 65.001 59.905 73.836 1.00 12.46 C -ATOM 2845 CA ARG C 128 64.407 60.872 74.766 1.00 14.89 C -ATOM 2846 C ARG C 128 62.918 61.127 74.505 1.00 16.10 C -ATOM 2847 O ARG C 128 62.583 61.112 73.288 1.00 17.58 C -ATOM 2848 CB ARG C 128 65.151 62.222 74.648 1.00 15.67 C -ATOM 2849 OXT ARG C 128 62.395 61.959 75.293 1.00 17.72 C -END diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/prot-prot.pdb b/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/prot-prot.pdb deleted file mode 100644 index 4e05a6efb..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/data/0_topoaa/prot-prot.pdb +++ /dev/null @@ -1,3620 +0,0 @@ -SEQRES 1 A 168 GLY LEU PHE ASP LYS LEU LYS SER LEU VAL SER ASP ASP -SEQRES 4 A 168 VAL PHE ALA GLU LYS ILE VAL GLY ASP GLY ILE ALA ILE -SEQRES 7 A 168 ILE GLU SER ASP SER GLY VAL GLU LEU PHE VAL HIS PHE -SEQRES 8 A 168 GLY ILE ASP THR VAL GLU LEU LYS GLY GLU GLY PHE LYS -SEQRES 9 A 168 ARG ILE ALA GLU GLU GLY GLN ARG VAL LYS VAL GLY ASP -SEQRES 11 A 168 ALA LYS SER THR LEU THR PRO VAL VAL ILE SER ASN MET -SEQRES 12 A 168 ASP GLU ILE LYS GLU LEU ILE LYS LEU SER GLY SER VAL -SEQRES 6 B 85 GLU GLY GLU ASP GLU GLN LYS ALA VAL GLU HIS LEU VAL -SHEET 1 A 3 ILE A 20 ILE A 23 0 -SHEET 2 A 3 PRO A 162 LYS A 167 -1 N VAL A 163 O ILE A 22 -SHEET 3 A 3 GLU A 148 LYS A 151 -1 O GLU A 148 N LYS A 167 -SHEET 1 B 8 ARG A 112 VAL A 113 0 -SHEET 2 B 8 GLY A 65 ILE A 70 -1 O GLY A 65 N VAL A 113 -SHEET 3 B 8 ALA A 76 SER A 81 -1 O SER A 78 N GLY A 68 -SHEET 4 B 8 GLU A 86 HIS A 90 -1 N LEU A 87 O ILE A 79 -SHEET 5 B 8 THR A 136 ILE A 140 -1 O PRO A 137 N HIS A 90 -SHEET 6 B 8 ASP A 48 PRO A 54 -1 O ASP A 48 N ILE A 140 -SHEET 7 B 8 GLY A 28 VAL A 31 -1 O GLU A 29 N LYS A 53 -SHEET 8 B 8 SER A 155 VAL A 156 -1 N VAL A 156 O GLY A 28 -SHEET 1 C 3 LYS A 58 VAL A 60 0 -SHEET 2 C 3 THR A 118 PHE A 122 -1 N VAL A 119 O MET A 59 -SHEET 3 C 3 PHE A 103 ARG A 105 -1 O LYS A 104 N GLU A 121 -SHEET 1 D 4 PHE B 302 THR B 307 0 -SHEET 2 D 4 VAL B 360 GLU B 366 -1 N VAL B 361 O VAL B 306 -SHEET 3 D 4 GLU B 332 SER B 337 -1 O GLU B 332 N GLU B 366 -SHEET 4 D 4 LYS B 340 SER B 343 -1 O LYS B 340 N SER B 337 -ATOM 1 N THR A 19 51.382 49.015 12.266 1.00 0.15 A -ATOM 2 CA THR A 19 51.464 47.969 13.285 1.00 0.14 A -ATOM 3 C THR A 19 50.687 48.310 14.540 1.00 0.13 A -ATOM 4 O THR A 19 50.904 49.317 15.188 1.00 0.13 A -ATOM 5 CB THR A 19 52.915 47.521 13.637 1.00 0.13 A -ATOM 6 OG1 THR A 19 52.992 46.104 13.665 1.00 0.13 A -ATOM 7 CG2 THR A 19 53.358 48.069 15.002 1.00 0.13 A -ATOM 8 HA THR A 19 50.923 47.107 12.926 1.00 0.13 A -ATOM 9 HB THR A 19 53.588 47.896 12.881 1.00 0.14 A -ATOM 10 HG1 THR A 19 53.378 45.846 14.507 1.00 0.12 A -ATOM 11 1HG2 THR A 19 53.166 49.130 15.042 1.00 0.14 A -ATOM 12 2HG2 THR A 19 54.413 47.892 15.134 1.00 0.13 A -ATOM 13 3HG2 THR A 19 52.807 47.570 15.786 1.00 0.12 A -ATOM 14 N ILE A 20 49.771 47.410 14.891 1.00 0.12 A -ATOM 15 CA ILE A 20 49.010 47.580 16.076 1.00 0.12 A -ATOM 16 C ILE A 20 49.479 46.624 17.158 1.00 0.11 A -ATOM 17 O ILE A 20 49.608 45.428 16.967 1.00 0.10 A -ATOM 18 CB ILE A 20 47.541 47.355 15.789 1.00 0.12 A -ATOM 19 CG1 ILE A 20 47.124 48.242 14.572 1.00 0.13 A -ATOM 20 CG2 ILE A 20 46.684 47.697 17.013 1.00 0.11 A -ATOM 21 CD1 ILE A 20 46.614 47.391 13.409 1.00 0.13 A -ATOM 22 H ILE A 20 49.624 46.623 14.326 1.00 0.12 A -ATOM 23 HA ILE A 20 49.150 48.583 16.451 1.00 0.12 A -ATOM 24 HB ILE A 20 47.395 46.391 15.588 1.00 0.11 A -ATOM 25 1HG1 ILE A 20 46.340 48.920 14.868 1.00 0.13 A -ATOM 26 2HG1 ILE A 20 47.969 48.819 14.228 1.00 0.13 A -ATOM 27 1HG2 ILE A 20 46.783 48.744 17.248 1.00 0.12 A -ATOM 28 2HG2 ILE A 20 47.003 47.102 17.855 1.00 0.10 A -ATOM 29 3HG2 ILE A 20 45.648 47.475 16.790 1.00 0.11 A -ATOM 30 1HD1 ILE A 20 46.287 48.026 12.613 1.00 0.14 A -ATOM 31 2HD1 ILE A 20 45.792 46.811 13.736 1.00 0.13 A -ATOM 32 3HD1 ILE A 20 47.404 46.757 13.049 1.00 0.13 A -ATOM 33 N GLU A 21 49.697 47.189 18.314 1.00 0.10 A -ATOM 34 CA GLU A 21 50.078 46.438 19.494 1.00 0.10 A -ATOM 35 C GLU A 21 48.864 46.222 20.401 1.00 0.09 A -ATOM 36 O GLU A 21 48.211 47.155 20.833 1.00 0.09 A -ATOM 37 CB GLU A 21 51.156 47.156 20.303 1.00 0.10 A -ATOM 38 CG GLU A 21 52.561 46.600 20.010 1.00 0.10 A -ATOM 39 CD GLU A 21 53.641 47.575 20.497 1.00 0.11 A -ATOM 40 OE1 GLU A 21 53.427 48.234 21.507 1.00 0.11 A -ATOM 41 OE2 GLU A 21 54.669 47.650 19.836 1.00 0.12 A -ATOM 42 H GLU A 21 49.566 48.157 18.394 1.00 0.11 A -ATOM 43 HA GLU A 21 50.456 45.474 19.187 1.00 0.09 A -ATOM 44 1HB GLU A 21 51.140 48.204 20.049 1.00 0.11 A -ATOM 45 2HB GLU A 21 50.958 47.051 21.363 1.00 0.10 A -ATOM 46 1HG GLU A 21 52.684 45.657 20.517 1.00 0.10 A -ATOM 47 2HG GLU A 21 52.677 46.451 18.951 1.00 0.10 A -ATOM 48 N ILE A 22 48.608 44.981 20.708 1.00 0.08 A -ATOM 49 CA ILE A 22 47.531 44.605 21.626 1.00 0.07 A -ATOM 50 C ILE A 22 48.175 44.467 22.989 1.00 0.07 A -ATOM 51 O ILE A 22 49.129 43.730 23.172 1.00 0.06 A -ATOM 52 CB ILE A 22 46.798 43.298 21.232 1.00 0.07 A -ATOM 53 CG1 ILE A 22 46.411 43.262 19.744 1.00 0.07 A -ATOM 54 CG2 ILE A 22 45.569 43.084 22.117 1.00 0.06 A -ATOM 55 CD1 ILE A 22 45.253 44.213 19.451 1.00 0.08 A -ATOM 56 H ILE A 22 49.163 44.275 20.317 1.00 0.08 A -ATOM 57 HA ILE A 22 46.807 45.406 21.646 1.00 0.07 A -ATOM 58 HB ILE A 22 47.473 42.481 21.431 1.00 0.06 A -ATOM 59 1HG1 ILE A 22 47.265 43.544 19.149 1.00 0.08 A -ATOM 60 2HG1 ILE A 22 46.117 42.254 19.485 1.00 0.07 A -ATOM 61 1HG2 ILE A 22 44.884 43.906 21.994 1.00 0.06 A -ATOM 62 2HG2 ILE A 22 45.879 43.021 23.150 1.00 0.05 A -ATOM 63 3HG2 ILE A 22 45.081 42.162 21.833 1.00 0.06 A -ATOM 64 1HD1 ILE A 22 44.992 44.141 18.406 1.00 0.09 A -ATOM 65 2HD1 ILE A 22 45.551 45.223 19.679 1.00 0.08 A -ATOM 66 3HD1 ILE A 22 44.396 43.944 20.050 1.00 0.08 A -ATOM 67 N ILE A 23 47.674 45.200 23.936 1.00 0.07 A -ATOM 68 CA ILE A 23 48.214 45.187 25.257 1.00 0.06 A -ATOM 69 C ILE A 23 47.524 44.180 26.133 1.00 0.05 A -ATOM 70 O ILE A 23 46.365 43.887 25.994 1.00 0.05 A -ATOM 71 CB ILE A 23 48.244 46.597 25.858 1.00 0.07 A -ATOM 72 CG1 ILE A 23 48.863 47.564 24.839 1.00 0.08 A -ATOM 73 CG2 ILE A 23 49.061 46.606 27.152 1.00 0.08 A -ATOM 74 CD1 ILE A 23 50.332 47.223 24.576 1.00 0.09 A -ATOM 75 H ILE A 23 46.910 45.780 23.732 1.00 0.07 A -ATOM 76 HA ILE A 23 49.222 44.798 25.223 1.00 0.07 A -ATOM 77 HB ILE A 23 47.234 46.910 26.078 1.00 0.07 A -ATOM 78 1HG1 ILE A 23 48.316 47.493 23.910 1.00 0.08 A -ATOM 79 2HG1 ILE A 23 48.794 48.570 25.212 1.00 0.09 A -ATOM 80 1HG2 ILE A 23 49.214 47.627 27.472 1.00 0.08 A -ATOM 81 2HG2 ILE A 23 50.019 46.141 26.974 1.00 0.08 A -ATOM 82 3HG2 ILE A 23 48.533 46.062 27.919 1.00 0.07 A -ATOM 83 1HD1 ILE A 23 50.386 46.363 23.939 1.00 0.08 A -ATOM 84 2HD1 ILE A 23 50.843 47.022 25.503 1.00 0.09 A -ATOM 85 3HD1 ILE A 23 50.805 48.057 24.086 1.00 0.10 A -ATOM 86 N ALA A 24 48.283 43.611 27.034 1.00 0.05 A -ATOM 87 CA ALA A 24 47.709 42.611 27.878 1.00 0.05 A -ATOM 88 C ALA A 24 46.519 43.065 28.708 1.00 0.04 A -ATOM 89 O ALA A 24 46.580 44.043 29.435 1.00 0.05 A -ATOM 90 CB ALA A 24 48.786 42.193 28.879 1.00 0.05 A -ATOM 91 H ALA A 24 49.223 43.872 27.129 1.00 0.06 A -ATOM 92 HA ALA A 24 47.403 41.760 27.287 1.00 0.04 A -ATOM 93 1HB ALA A 24 49.615 41.763 28.342 1.00 0.05 A -ATOM 94 2HB ALA A 24 48.380 41.462 29.565 1.00 0.05 A -ATOM 95 3HB ALA A 24 49.123 43.058 29.431 1.00 0.06 A -ATOM 96 N PRO A 25 45.399 42.414 28.524 1.00 0.04 A -ATOM 97 CA PRO A 25 44.171 42.792 29.225 1.00 0.04 A -ATOM 98 C PRO A 25 44.198 42.324 30.711 1.00 0.04 A -ATOM 99 O PRO A 25 43.497 42.859 31.546 1.00 0.04 A -ATOM 100 CB PRO A 25 43.034 42.136 28.433 1.00 0.03 A -ATOM 101 CG PRO A 25 43.668 41.077 27.566 1.00 0.03 A -ATOM 102 CD PRO A 25 45.127 41.454 27.409 1.00 0.03 A -ATOM 103 HA PRO A 25 44.056 43.865 29.233 1.00 0.04 A -ATOM 104 1HB PRO A 25 42.321 41.680 29.111 1.00 0.03 A -ATOM 105 2HB PRO A 25 42.532 42.871 27.819 1.00 0.04 A -ATOM 106 1HG PRO A 25 43.596 40.106 28.034 1.00 0.03 A -ATOM 107 2HG PRO A 25 43.187 41.050 26.591 1.00 0.04 A -ATOM 108 1HD PRO A 25 45.757 40.589 27.432 1.00 0.03 A -ATOM 109 2HD PRO A 25 45.251 41.982 26.462 1.00 0.04 A -ATOM 110 N LEU A 26 45.039 41.362 31.023 1.00 0.04 A -ATOM 111 CA LEU A 26 45.258 40.877 32.399 1.00 0.05 A -ATOM 112 C LEU A 26 46.724 40.422 32.577 1.00 0.05 A -ATOM 113 O LEU A 26 47.431 40.153 31.624 1.00 0.05 A -ATOM 114 CB LEU A 26 44.284 39.798 33.045 1.00 0.05 A -ATOM 115 CG LEU A 26 43.438 38.919 32.089 1.00 0.04 A -ATOM 116 CD1 LEU A 26 44.229 38.417 30.898 1.00 0.04 A -ATOM 117 CD2 LEU A 26 42.899 37.696 32.874 1.00 0.05 A -ATOM 118 H LEU A 26 45.575 40.961 30.308 1.00 0.04 A -ATOM 119 HA LEU A 26 45.222 41.745 33.039 1.00 0.05 A -ATOM 120 1HB LEU A 26 44.874 39.134 33.658 1.00 0.05 A -ATOM 121 2HB LEU A 26 43.599 40.324 33.702 1.00 0.05 A -ATOM 122 HG LEU A 26 42.616 39.483 31.733 1.00 0.04 A -ATOM 123 1HD1 LEU A 26 43.679 37.609 30.428 1.00 0.04 A -ATOM 124 2HD1 LEU A 26 45.189 38.057 31.226 1.00 0.05 A -ATOM 125 3HD1 LEU A 26 44.355 39.218 30.192 1.00 0.04 A -ATOM 126 1HD2 LEU A 26 42.000 37.337 32.408 1.00 0.05 A -ATOM 127 2HD2 LEU A 26 42.681 37.971 33.897 1.00 0.06 A -ATOM 128 3HD2 LEU A 26 43.638 36.911 32.862 1.00 0.06 A -ATOM 129 N SER A 27 47.172 40.328 33.834 1.00 0.06 A -ATOM 130 CA SER A 27 48.525 39.860 34.118 1.00 0.07 A -ATOM 131 C SER A 27 48.590 38.363 34.115 1.00 0.07 A -ATOM 132 O SER A 27 47.653 37.682 34.484 1.00 0.07 A -ATOM 133 CB SER A 27 49.037 40.332 35.469 1.00 0.08 A -ATOM 134 OG SER A 27 49.037 41.751 35.525 1.00 0.08 A -ATOM 135 H SER A 27 46.570 40.538 34.578 1.00 0.06 A -ATOM 136 HA SER A 27 49.188 40.230 33.349 1.00 0.07 A -ATOM 137 1HB SER A 27 48.400 39.947 36.248 1.00 0.08 A -ATOM 138 2HB SER A 27 50.042 39.959 35.616 1.00 0.09 A -ATOM 139 HG SER A 27 49.820 42.026 36.012 1.00 0.09 A -ATOM 140 N GLY A 28 49.717 37.836 33.717 1.00 0.08 A -ATOM 141 CA GLY A 28 49.856 36.412 33.714 1.00 0.08 A -ATOM 142 C GLY A 28 50.928 35.974 32.741 1.00 0.08 A -ATOM 143 O GLY A 28 51.862 36.691 32.426 1.00 0.08 A -ATOM 144 H GLY A 28 50.457 38.414 33.433 1.00 0.08 A -ATOM 145 1HA GLY A 28 50.136 36.077 34.702 1.00 0.09 A -ATOM 146 2HA GLY A 28 48.916 35.960 33.435 1.00 0.08 A -ATOM 147 N GLU A 29 50.783 34.763 32.308 1.00 0.08 A -ATOM 148 CA GLU A 29 51.720 34.110 31.417 1.00 0.09 A -ATOM 149 C GLU A 29 51.052 33.780 30.117 1.00 0.08 A -ATOM 150 O GLU A 29 49.942 33.287 30.091 1.00 0.08 A -ATOM 151 CB GLU A 29 52.330 32.838 32.078 1.00 0.10 A -ATOM 152 CG GLU A 29 53.877 32.953 32.241 1.00 0.11 A -ATOM 153 CD GLU A 29 54.571 31.908 31.374 1.00 0.11 A -ATOM 154 OE1 GLU A 29 54.250 30.741 31.546 1.00 0.12 A -ATOM 155 OE2 GLU A 29 55.393 32.287 30.552 1.00 0.11 A -ATOM 156 H GLU A 29 50.004 34.254 32.612 1.00 0.09 A -ATOM 157 HA GLU A 29 52.517 34.799 31.176 1.00 0.09 A -ATOM 158 1HB GLU A 29 51.882 32.714 33.055 1.00 0.10 A -ATOM 159 2HB GLU A 29 52.090 31.966 31.480 1.00 0.10 A -ATOM 160 1HG GLU A 29 54.223 33.932 31.955 1.00 0.10 A -ATOM 161 2HG GLU A 29 54.142 32.778 33.273 1.00 0.11 A -ATOM 162 N ILE A 30 51.718 34.059 29.015 1.00 0.08 A -ATOM 163 CA ILE A 30 51.087 33.766 27.768 1.00 0.07 A -ATOM 164 C ILE A 30 51.099 32.268 27.509 1.00 0.08 A -ATOM 165 O ILE A 30 52.035 31.557 27.813 1.00 0.09 A -ATOM 166 CB ILE A 30 51.692 34.547 26.609 1.00 0.07 A -ATOM 167 CG1 ILE A 30 51.330 36.020 26.804 1.00 0.06 A -ATOM 168 CG2 ILE A 30 51.132 34.032 25.275 1.00 0.07 A -ATOM 169 CD1 ILE A 30 51.972 36.885 25.722 1.00 0.06 A -ATOM 170 H ILE A 30 52.610 34.462 29.048 1.00 0.08 A -ATOM 171 HA ILE A 30 50.039 34.014 27.843 1.00 0.07 A -ATOM 172 HB ILE A 30 52.766 34.433 26.617 1.00 0.07 A -ATOM 173 1HG1 ILE A 30 50.257 36.128 26.758 1.00 0.06 A -ATOM 174 2HG1 ILE A 30 51.680 36.344 27.772 1.00 0.07 A -ATOM 175 1HG2 ILE A 30 50.057 33.973 25.338 1.00 0.06 A -ATOM 176 2HG2 ILE A 30 51.534 33.050 25.070 1.00 0.07 A -ATOM 177 3HG2 ILE A 30 51.411 34.703 24.478 1.00 0.06 A -ATOM 178 1HD1 ILE A 30 51.676 36.525 24.748 1.00 0.06 A -ATOM 179 2HD1 ILE A 30 53.046 36.843 25.814 1.00 0.07 A -ATOM 180 3HD1 ILE A 30 51.642 37.901 25.842 1.00 0.06 A -ATOM 181 N VAL A 31 50.007 31.804 26.952 1.00 0.08 A -ATOM 182 CA VAL A 31 49.820 30.401 26.658 1.00 0.09 A -ATOM 183 C VAL A 31 49.295 30.264 25.218 1.00 0.09 A -ATOM 184 O VAL A 31 48.700 31.177 24.679 1.00 0.08 A -ATOM 185 CB VAL A 31 48.846 29.829 27.687 1.00 0.09 A -ATOM 186 CG1 VAL A 31 48.242 28.510 27.205 1.00 0.10 A -ATOM 187 CG2 VAL A 31 49.548 29.614 29.025 1.00 0.10 A -ATOM 188 H VAL A 31 49.288 32.430 26.726 1.00 0.07 A -ATOM 189 HA VAL A 31 50.766 29.883 26.721 1.00 0.09 A -ATOM 190 HB VAL A 31 48.045 30.541 27.833 1.00 0.09 A -ATOM 191 1HG1 VAL A 31 47.644 28.687 26.323 1.00 0.10 A -ATOM 192 2HG1 VAL A 31 47.614 28.103 27.981 1.00 0.11 A -ATOM 193 3HG1 VAL A 31 49.031 27.814 26.973 1.00 0.11 A -ATOM 194 1HG2 VAL A 31 49.961 30.551 29.368 1.00 0.09 A -ATOM 195 2HG2 VAL A 31 50.338 28.889 28.910 1.00 0.10 A -ATOM 196 3HG2 VAL A 31 48.829 29.253 29.749 1.00 0.10 A -ATOM 197 N ASN A 32 49.517 29.120 24.605 1.00 0.09 A -ATOM 198 CA ASN A 32 49.037 28.878 23.238 1.00 0.10 A -ATOM 199 C ASN A 32 47.549 28.716 23.211 1.00 0.10 A -ATOM 200 O ASN A 32 46.967 28.050 24.047 1.00 0.10 A -ATOM 201 CB ASN A 32 49.563 27.579 22.571 1.00 0.11 A -ATOM 202 CG ASN A 32 51.071 27.562 22.387 1.00 0.11 A -ATOM 203 OD1 ASN A 32 51.680 26.500 22.400 1.00 0.11 A -ATOM 204 ND2 ASN A 32 51.695 28.684 22.193 1.00 0.10 A -ATOM 205 H ASN A 32 49.997 28.406 25.074 1.00 0.10 A -ATOM 206 HA ASN A 32 49.339 29.714 22.626 1.00 0.09 A -ATOM 207 1HB ASN A 32 49.281 26.740 23.179 1.00 0.11 A -ATOM 208 2HB ASN A 32 49.101 27.487 21.623 1.00 0.11 A -ATOM 209 1HD2 ASN A 32 51.189 29.523 22.175 1.00 0.09 A -ATOM 210 2HD2 ASN A 32 52.663 28.692 22.052 1.00 0.10 A -ATOM 211 N ILE A 33 46.921 29.294 22.238 1.00 0.10 A -ATOM 212 CA ILE A 33 45.491 29.170 22.170 1.00 0.10 A -ATOM 213 C ILE A 33 45.147 27.742 21.863 1.00 0.11 A -ATOM 214 O ILE A 33 44.070 27.266 22.185 1.00 0.12 A -ATOM 215 CB ILE A 33 44.833 30.207 21.226 1.00 0.10 A -ATOM 216 CG1 ILE A 33 43.340 30.333 21.601 1.00 0.10 A -ATOM 217 CG2 ILE A 33 44.983 29.790 19.753 1.00 0.10 A -ATOM 218 CD1 ILE A 33 42.789 31.682 21.188 1.00 0.09 A -ATOM 219 H ILE A 33 47.413 29.817 21.571 1.00 0.09 A -ATOM 220 HA ILE A 33 45.087 29.304 23.161 1.00 0.10 A -ATOM 221 HB ILE A 33 45.322 31.162 21.366 1.00 0.09 A -ATOM 222 1HG1 ILE A 33 42.780 29.557 21.112 1.00 0.11 A -ATOM 223 2HG1 ILE A 33 43.218 30.236 22.670 1.00 0.10 A -ATOM 224 1HG2 ILE A 33 44.173 29.135 19.473 1.00 0.11 A -ATOM 225 2HG2 ILE A 33 45.924 29.280 19.614 1.00 0.10 A -ATOM 226 3HG2 ILE A 33 44.961 30.674 19.128 1.00 0.10 A -ATOM 227 1HD1 ILE A 33 42.747 31.748 20.112 1.00 0.10 A -ATOM 228 2HD1 ILE A 33 43.419 32.465 21.581 1.00 0.08 A -ATOM 229 3HD1 ILE A 33 41.799 31.775 21.599 1.00 0.09 A -ATOM 230 N GLU A 34 46.048 27.032 21.271 1.00 0.12 A -ATOM 231 CA GLU A 34 45.754 25.673 20.965 1.00 0.13 A -ATOM 232 C GLU A 34 45.783 24.833 22.210 1.00 0.13 A -ATOM 233 O GLU A 34 45.287 23.721 22.201 1.00 0.14 A -ATOM 234 CB GLU A 34 46.584 25.088 19.807 1.00 0.13 A -ATOM 235 CG GLU A 34 48.023 25.596 19.810 1.00 0.13 A -ATOM 236 CD GLU A 34 48.106 26.983 19.159 1.00 0.12 A -ATOM 237 OE1 GLU A 34 47.335 27.241 18.249 1.00 0.12 A -ATOM 238 OE2 GLU A 34 48.956 27.756 19.566 1.00 0.11 A -ATOM 239 H GLU A 34 46.905 27.437 21.023 1.00 0.11 A -ATOM 240 HA GLU A 34 44.709 25.605 20.699 1.00 0.13 A -ATOM 241 1HB GLU A 34 46.598 24.011 19.897 1.00 0.14 A -ATOM 242 2HB GLU A 34 46.115 25.351 18.870 1.00 0.13 A -ATOM 243 1HG GLU A 34 48.377 25.638 20.819 1.00 0.12 A -ATOM 244 2HG GLU A 34 48.639 24.910 19.247 1.00 0.13 A -ATOM 245 N ASP A 35 46.322 25.341 23.287 1.00 0.13 A -ATOM 246 CA ASP A 35 46.372 24.560 24.500 1.00 0.13 A -ATOM 247 C ASP A 35 45.216 24.829 25.447 1.00 0.13 A -ATOM 248 O ASP A 35 45.229 24.396 26.586 1.00 0.14 A -ATOM 249 CB ASP A 35 47.701 24.694 25.230 1.00 0.13 A -ATOM 250 CG ASP A 35 48.870 24.444 24.279 1.00 0.13 A -ATOM 251 OD1 ASP A 35 48.631 23.898 23.215 1.00 0.13 A -ATOM 252 OD2 ASP A 35 49.988 24.807 24.629 1.00 0.13 A -ATOM 253 H ASP A 35 46.711 26.239 23.263 1.00 0.12 A -ATOM 254 HA ASP A 35 46.220 23.521 24.247 1.00 0.14 A -ATOM 255 1HB ASP A 35 47.779 25.687 25.645 1.00 0.12 A -ATOM 256 2HB ASP A 35 47.736 23.970 26.032 1.00 0.14 A -ATOM 257 N VAL A 36 44.221 25.503 24.981 1.00 0.13 A -ATOM 258 CA VAL A 36 43.039 25.810 25.801 1.00 0.13 A -ATOM 259 C VAL A 36 42.030 24.651 25.721 1.00 0.14 A -ATOM 260 O VAL A 36 41.819 24.076 24.669 1.00 0.15 A -ATOM 261 CB VAL A 36 42.350 27.104 25.340 1.00 0.12 A -ATOM 262 CG1 VAL A 36 40.876 27.140 25.723 1.00 0.12 A -ATOM 263 CG2 VAL A 36 43.056 28.339 25.913 1.00 0.11 A -ATOM 264 H VAL A 36 44.261 25.837 24.060 1.00 0.13 A -ATOM 265 HA VAL A 36 43.347 25.925 26.830 1.00 0.13 A -ATOM 266 HB VAL A 36 42.418 27.153 24.262 1.00 0.12 A -ATOM 267 1HG1 VAL A 36 40.513 28.152 25.637 1.00 0.12 A -ATOM 268 2HG1 VAL A 36 40.762 26.789 26.731 1.00 0.13 A -ATOM 269 3HG1 VAL A 36 40.317 26.503 25.056 1.00 0.13 A -ATOM 270 1HG2 VAL A 36 42.689 29.222 25.408 1.00 0.10 A -ATOM 271 2HG2 VAL A 36 44.120 28.253 25.757 1.00 0.11 A -ATOM 272 3HG2 VAL A 36 42.847 28.418 26.969 1.00 0.11 A -ATOM 273 N PRO A 37 41.556 24.207 26.863 1.00 0.15 A -ATOM 274 CA PRO A 37 40.691 23.029 26.956 1.00 0.16 A -ATOM 275 C PRO A 37 39.301 23.299 26.377 1.00 0.16 A -ATOM 276 O PRO A 37 38.285 22.999 26.981 1.00 0.16 A -ATOM 277 CB PRO A 37 40.585 22.740 28.471 1.00 0.16 A -ATOM 278 CG PRO A 37 41.360 23.779 29.226 1.00 0.15 A -ATOM 279 CD PRO A 37 42.043 24.660 28.210 1.00 0.14 A -ATOM 280 HA PRO A 37 41.132 22.191 26.438 1.00 0.16 A -ATOM 281 1HB PRO A 37 39.551 22.765 28.794 1.00 0.16 A -ATOM 282 2HB PRO A 37 40.989 21.758 28.680 1.00 0.17 A -ATOM 283 1HG PRO A 37 40.699 24.378 29.843 1.00 0.15 A -ATOM 284 2HG PRO A 37 42.105 23.302 29.862 1.00 0.15 A -ATOM 285 1HD PRO A 37 41.841 25.698 28.395 1.00 0.13 A -ATOM 286 2HD PRO A 37 43.120 24.469 28.271 1.00 0.14 A -ATOM 287 N ASP A 38 39.245 23.864 25.218 1.00 0.16 A -ATOM 288 CA ASP A 38 37.962 24.146 24.610 1.00 0.16 A -ATOM 289 C ASP A 38 38.145 24.095 23.103 1.00 0.16 A -ATOM 290 O ASP A 38 38.884 24.871 22.531 1.00 0.15 A -ATOM 291 CB ASP A 38 37.414 25.506 25.059 1.00 0.15 A -ATOM 292 CG ASP A 38 35.978 25.667 24.558 1.00 0.17 A -ATOM 293 OD1 ASP A 38 35.556 24.849 23.757 1.00 0.22 A -ATOM 294 OD2 ASP A 38 35.322 26.601 24.987 1.00 0.18 A -ATOM 295 H ASP A 38 40.072 24.105 24.751 1.00 0.15 A -ATOM 296 HA ASP A 38 37.263 23.373 24.893 1.00 0.17 A -ATOM 297 1HB ASP A 38 37.428 25.561 26.138 1.00 0.15 A -ATOM 298 2HB ASP A 38 38.025 26.294 24.651 1.00 0.14 A -ATOM 299 N VAL A 39 37.501 23.164 22.447 1.00 0.17 A -ATOM 300 CA VAL A 39 37.679 23.064 21.011 1.00 0.17 A -ATOM 301 C VAL A 39 37.250 24.328 20.309 1.00 0.17 A -ATOM 302 O VAL A 39 37.896 24.717 19.352 1.00 0.16 A -ATOM 303 CB VAL A 39 37.057 21.845 20.323 1.00 0.19 A -ATOM 304 CG1 VAL A 39 37.626 20.565 20.939 1.00 0.19 A -ATOM 305 CG2 VAL A 39 35.539 21.871 20.517 1.00 0.19 A -ATOM 306 H VAL A 39 36.919 22.533 22.921 1.00 0.18 A -ATOM 307 HA VAL A 39 38.740 23.044 20.814 1.00 0.17 A -ATOM 308 HB VAL A 39 37.288 21.870 19.268 1.00 0.19 A -ATOM 309 1HG1 VAL A 39 37.023 19.722 20.637 1.00 1.03 A -ATOM 310 2HG1 VAL A 39 37.615 20.649 22.015 1.00 1.02 A -ATOM 311 3HG1 VAL A 39 38.641 20.423 20.598 1.00 1.04 A -ATOM 312 1HG2 VAL A 39 35.095 21.038 19.991 1.00 1.01 A -ATOM 313 2HG2 VAL A 39 35.142 22.796 20.126 1.00 1.02 A -ATOM 314 3HG2 VAL A 39 35.309 21.796 21.569 1.00 1.05 A -ATOM 315 N VAL A 40 36.211 24.997 20.712 1.00 0.17 A -ATOM 316 CA VAL A 40 35.874 26.201 19.968 1.00 0.16 A -ATOM 317 C VAL A 40 36.968 27.239 20.038 1.00 0.15 A -ATOM 318 O VAL A 40 37.196 27.944 19.070 1.00 0.15 A -ATOM 319 CB VAL A 40 34.454 26.799 20.091 1.00 0.17 A -ATOM 320 CG1 VAL A 40 33.446 25.870 19.410 1.00 0.19 A -ATOM 321 CG2 VAL A 40 34.097 26.943 21.575 1.00 0.27 A -ATOM 322 H VAL A 40 35.677 24.686 21.471 1.00 0.17 A -ATOM 323 HA VAL A 40 36.029 25.977 18.924 1.00 0.17 A -ATOM 324 HB VAL A 40 34.429 27.769 19.615 1.00 0.22 A -ATOM 325 1HG1 VAL A 40 32.451 26.274 19.523 1.00 1.06 A -ATOM 326 2HG1 VAL A 40 33.492 24.892 19.866 1.00 0.99 A -ATOM 327 3HG1 VAL A 40 33.684 25.789 18.360 1.00 1.03 A -ATOM 328 1HG2 VAL A 40 33.268 27.622 21.680 1.00 1.06 A -ATOM 329 2HG2 VAL A 40 34.948 27.330 22.116 1.00 1.06 A -ATOM 330 3HG2 VAL A 40 33.824 25.977 21.977 1.00 1.07 A -ATOM 331 N PHE A 41 37.652 27.365 21.090 1.00 0.14 A -ATOM 332 CA PHE A 41 38.695 28.359 21.124 1.00 0.13 A -ATOM 333 C PHE A 41 39.985 27.785 20.503 1.00 0.13 A -ATOM 334 O PHE A 41 40.689 28.436 19.757 1.00 0.13 A -ATOM 335 CB PHE A 41 39.002 28.721 22.577 1.00 0.12 A -ATOM 336 CG PHE A 41 37.992 29.708 23.111 1.00 0.13 A -ATOM 337 CD1 PHE A 41 38.161 31.083 22.855 1.00 0.16 A -ATOM 338 CD2 PHE A 41 36.901 29.264 23.880 1.00 0.16 A -ATOM 339 CE1 PHE A 41 37.241 32.013 23.370 1.00 0.18 A -ATOM 340 CE2 PHE A 41 35.976 30.196 24.392 1.00 0.19 A -ATOM 341 CZ PHE A 41 36.149 31.571 24.138 1.00 0.18 A -ATOM 342 H PHE A 41 37.442 26.821 21.878 1.00 0.15 A -ATOM 343 HA PHE A 41 38.369 29.241 20.595 1.00 0.13 A -ATOM 344 1HB PHE A 41 38.974 27.827 23.178 1.00 0.14 A -ATOM 345 2HB PHE A 41 39.989 29.161 22.643 1.00 0.11 A -ATOM 346 HD1 PHE A 41 38.999 31.422 22.264 1.00 0.20 A -ATOM 347 HD2 PHE A 41 36.770 28.210 24.074 1.00 0.18 A -ATOM 348 HE1 PHE A 41 37.372 33.067 23.174 1.00 0.21 A -ATOM 349 HE2 PHE A 41 35.138 29.857 24.982 1.00 0.23 A -ATOM 350 HZ PHE A 41 35.448 32.287 24.536 1.00 0.21 A -ATOM 351 N ALA A 42 40.298 26.573 20.872 1.00 0.14 A -ATOM 352 CA ALA A 42 41.505 25.895 20.427 1.00 0.14 A -ATOM 353 C ALA A 42 41.474 25.777 18.945 1.00 0.14 A -ATOM 354 O ALA A 42 42.496 25.893 18.288 1.00 0.14 A -ATOM 355 CB ALA A 42 41.653 24.529 21.098 1.00 0.15 A -ATOM 356 H ALA A 42 39.711 26.101 21.497 1.00 0.14 A -ATOM 357 HA ALA A 42 42.362 26.503 20.676 1.00 0.13 A -ATOM 358 1HB ALA A 42 40.920 23.848 20.693 1.00 0.16 A -ATOM 359 2HB ALA A 42 41.501 24.632 22.161 1.00 0.14 A -ATOM 360 3HB ALA A 42 42.644 24.142 20.911 1.00 0.15 A -ATOM 361 N GLU A 43 40.322 25.563 18.389 1.00 0.15 A -ATOM 362 CA GLU A 43 40.269 25.443 16.937 1.00 0.16 A -ATOM 363 C GLU A 43 40.012 26.815 16.290 1.00 0.15 A -ATOM 364 O GLU A 43 39.855 26.951 15.094 1.00 0.16 A -ATOM 365 CB GLU A 43 39.339 24.302 16.419 1.00 0.17 A -ATOM 366 CG GLU A 43 39.837 22.956 16.950 1.00 0.20 A -ATOM 367 CD GLU A 43 38.973 21.830 16.381 1.00 0.57 A -ATOM 368 OE1 GLU A 43 37.963 22.137 15.769 1.00 0.81 A -ATOM 369 OE2 GLU A 43 39.335 20.680 16.566 1.00 0.70 A -ATOM 370 H GLU A 43 39.514 25.479 18.937 1.00 0.15 A -ATOM 371 HA GLU A 43 41.269 25.254 16.578 1.00 0.16 A -ATOM 372 1HB GLU A 43 38.330 24.475 16.765 1.00 0.17 A -ATOM 373 2HB GLU A 43 39.352 24.289 15.339 1.00 0.20 A -ATOM 374 1HG GLU A 43 40.865 22.810 16.650 1.00 0.28 A -ATOM 375 2HG GLU A 43 39.772 22.948 18.028 1.00 0.45 A -ATOM 376 N LYS A 44 40.049 27.819 17.102 1.00 0.14 A -ATOM 377 CA LYS A 44 39.903 29.211 16.692 1.00 0.14 A -ATOM 378 C LYS A 44 38.679 29.477 15.861 1.00 0.14 A -ATOM 379 O LYS A 44 38.703 30.258 14.928 1.00 0.15 A -ATOM 380 CB LYS A 44 41.095 29.763 15.959 1.00 0.13 A -ATOM 381 CG LYS A 44 42.417 29.445 16.648 1.00 0.12 A -ATOM 382 CD LYS A 44 43.351 28.785 15.606 1.00 0.13 A -ATOM 383 CE LYS A 44 44.800 29.237 15.767 1.00 0.12 A -ATOM 384 NZ LYS A 44 45.664 28.038 15.791 1.00 0.13 A -ATOM 385 H LYS A 44 40.185 27.638 18.054 1.00 0.14 A -ATOM 386 HA LYS A 44 39.740 29.810 17.577 1.00 0.13 A -ATOM 387 1HB LYS A 44 41.074 29.338 14.968 1.00 0.14 A -ATOM 388 2HB LYS A 44 40.987 30.821 15.855 1.00 0.13 A -ATOM 389 1HG LYS A 44 42.850 30.365 17.022 1.00 0.12 A -ATOM 390 2HG LYS A 44 42.256 28.766 17.475 1.00 0.13 A -ATOM 391 1HD LYS A 44 43.292 27.717 15.719 1.00 0.14 A -ATOM 392 2HD LYS A 44 43.027 29.043 14.603 1.00 0.13 A -ATOM 393 1HE LYS A 44 45.075 29.860 14.927 1.00 0.12 A -ATOM 394 2HE LYS A 44 44.932 29.789 16.681 1.00 0.11 A -ATOM 395 1HZ LYS A 44 45.079 27.186 15.673 1.00 0.13 A -ATOM 396 2HZ LYS A 44 46.163 27.997 16.701 1.00 0.12 A -ATOM 397 3HZ LYS A 44 46.351 28.095 15.015 1.00 0.13 A -ATOM 398 N ILE A 45 37.616 28.876 16.202 1.00 0.15 A -ATOM 399 CA ILE A 45 36.414 29.103 15.479 1.00 0.16 A -ATOM 400 C ILE A 45 35.921 30.546 15.684 1.00 0.15 A -ATOM 401 O ILE A 45 35.225 31.141 14.885 1.00 0.16 A -ATOM 402 CB ILE A 45 35.422 28.160 16.114 1.00 0.17 A -ATOM 403 CG1 ILE A 45 35.958 26.707 16.089 1.00 0.17 A -ATOM 404 CG2 ILE A 45 34.076 28.235 15.372 1.00 0.17 A -ATOM 405 CD1 ILE A 45 36.604 26.339 14.741 1.00 0.17 A -ATOM 406 H ILE A 45 37.628 28.250 16.957 1.00 0.15 A -ATOM 407 HA ILE A 45 36.546 28.872 14.433 1.00 0.17 A -ATOM 408 HB ILE A 45 35.268 28.459 17.141 1.00 0.18 A -ATOM 409 1HG1 ILE A 45 36.700 26.599 16.859 1.00 0.18 A -ATOM 410 2HG1 ILE A 45 35.140 26.028 16.284 1.00 0.17 A -ATOM 411 1HG2 ILE A 45 33.717 29.251 15.376 1.00 1.03 A -ATOM 412 2HG2 ILE A 45 33.357 27.601 15.868 1.00 1.05 A -ATOM 413 3HG2 ILE A 45 34.195 27.908 14.354 1.00 1.01 A -ATOM 414 1HD1 ILE A 45 37.569 26.813 14.664 1.00 1.04 A -ATOM 415 2HD1 ILE A 45 35.981 26.660 13.926 1.00 1.02 A -ATOM 416 3HD1 ILE A 45 36.731 25.268 14.689 1.00 1.02 A -ATOM 417 N VAL A 46 36.242 31.009 16.821 1.00 0.15 A -ATOM 418 CA VAL A 46 35.869 32.280 17.372 1.00 0.14 A -ATOM 419 C VAL A 46 36.898 33.396 17.005 1.00 0.13 A -ATOM 420 O VAL A 46 36.651 34.568 17.211 1.00 0.13 A -ATOM 421 CB VAL A 46 35.660 31.929 18.858 1.00 0.14 A -ATOM 422 CG1 VAL A 46 34.748 32.980 19.505 1.00 0.46 A -ATOM 423 CG2 VAL A 46 35.032 30.533 19.022 1.00 0.50 A -ATOM 424 H VAL A 46 36.755 30.418 17.407 1.00 0.14 A -ATOM 425 HA VAL A 46 34.960 32.651 16.924 1.00 0.15 A -ATOM 426 HB VAL A 46 36.620 31.949 19.358 1.00 0.32 A -ATOM 427 1HG1 VAL A 46 35.018 33.965 19.151 1.00 1.10 A -ATOM 428 2HG1 VAL A 46 34.861 32.942 20.578 1.00 1.12 A -ATOM 429 3HG1 VAL A 46 33.720 32.773 19.245 1.00 1.25 A -ATOM 430 1HG2 VAL A 46 34.493 30.476 19.958 1.00 1.21 A -ATOM 431 2HG2 VAL A 46 35.810 29.790 19.015 1.00 1.18 A -ATOM 432 3HG2 VAL A 46 34.360 30.349 18.209 1.00 1.14 A -ATOM 433 N GLY A 47 38.003 33.036 16.409 1.00 0.13 A -ATOM 434 CA GLY A 47 39.012 33.980 15.948 1.00 0.12 A -ATOM 435 C GLY A 47 40.353 33.495 16.376 1.00 0.12 A -ATOM 436 O GLY A 47 40.447 32.447 16.967 1.00 0.12 A -ATOM 437 H GLY A 47 38.161 32.080 16.272 1.00 0.13 A -ATOM 438 1HA GLY A 47 38.962 34.065 14.872 1.00 0.13 A -ATOM 439 2HA GLY A 47 38.835 34.947 16.393 1.00 0.12 A -ATOM 440 N ASP A 48 41.403 34.243 16.140 1.00 0.11 A -ATOM 441 CA ASP A 48 42.697 33.751 16.575 1.00 0.10 A -ATOM 442 C ASP A 48 43.373 34.676 17.581 1.00 0.09 A -ATOM 443 O ASP A 48 43.132 35.867 17.601 1.00 0.09 A -ATOM 444 CB ASP A 48 43.642 33.605 15.350 1.00 0.11 A -ATOM 445 CG ASP A 48 44.837 32.697 15.644 1.00 0.11 A -ATOM 446 OD1 ASP A 48 44.904 32.143 16.729 1.00 0.10 A -ATOM 447 OD2 ASP A 48 45.672 32.570 14.754 1.00 0.11 A -ATOM 448 H ASP A 48 41.311 35.116 15.704 1.00 0.11 A -ATOM 449 HA ASP A 48 42.574 32.788 17.049 1.00 0.11 A -ATOM 450 1HB ASP A 48 43.085 33.193 14.523 1.00 0.12 A -ATOM 451 2HB ASP A 48 44.005 34.584 15.079 1.00 0.10 A -ATOM 452 N GLY A 49 44.266 34.138 18.405 1.00 0.09 A -ATOM 453 CA GLY A 49 44.957 35.025 19.324 1.00 0.08 A -ATOM 454 C GLY A 49 45.805 34.231 20.330 1.00 0.07 A -ATOM 455 O GLY A 49 46.455 33.274 19.966 1.00 0.08 A -ATOM 456 H GLY A 49 44.471 33.181 18.376 1.00 0.09 A -ATOM 457 1HA GLY A 49 45.594 35.688 18.756 1.00 0.08 A -ATOM 458 2HA GLY A 49 44.226 35.605 19.867 1.00 0.07 A -ATOM 459 N ILE A 50 45.790 34.621 21.606 1.00 0.07 A -ATOM 460 CA ILE A 50 46.543 33.907 22.623 1.00 0.07 A -ATOM 461 C ILE A 50 45.647 33.721 23.855 1.00 0.06 A -ATOM 462 O ILE A 50 44.552 34.244 23.930 1.00 0.06 A -ATOM 463 CB ILE A 50 47.825 34.652 23.072 1.00 0.06 A -ATOM 464 CG1 ILE A 50 47.564 36.120 23.466 1.00 0.05 A -ATOM 465 CG2 ILE A 50 48.894 34.624 21.973 1.00 0.06 A -ATOM 466 CD1 ILE A 50 47.049 36.234 24.902 1.00 0.05 A -ATOM 467 H ILE A 50 45.247 35.392 21.869 1.00 0.06 A -ATOM 468 HA ILE A 50 46.827 32.943 22.227 1.00 0.07 A -ATOM 469 HB ILE A 50 48.228 34.126 23.922 1.00 0.06 A -ATOM 470 1HG1 ILE A 50 48.488 36.677 23.395 1.00 0.05 A -ATOM 471 2HG1 ILE A 50 46.847 36.541 22.791 1.00 0.05 A -ATOM 472 1HG2 ILE A 50 48.474 34.972 21.044 1.00 0.06 A -ATOM 473 2HG2 ILE A 50 49.264 33.618 21.852 1.00 0.07 A -ATOM 474 3HG2 ILE A 50 49.713 35.272 22.262 1.00 0.06 A -ATOM 475 1HD1 ILE A 50 47.187 37.248 25.253 1.00 0.04 A -ATOM 476 2HD1 ILE A 50 47.589 35.559 25.545 1.00 0.05 A -ATOM 477 3HD1 ILE A 50 46.014 35.992 24.921 1.00 0.05 A -ATOM 478 N ALA A 51 46.158 33.007 24.820 1.00 0.07 A -ATOM 479 CA ALA A 51 45.521 32.783 26.117 1.00 0.07 A -ATOM 480 C ALA A 51 46.471 33.296 27.223 1.00 0.07 A -ATOM 481 O ALA A 51 47.667 33.406 27.014 1.00 0.07 A -ATOM 482 CB ALA A 51 45.306 31.291 26.329 1.00 0.08 A -ATOM 483 H ALA A 51 47.042 32.612 24.677 1.00 0.07 A -ATOM 484 HA ALA A 51 44.567 33.291 26.142 1.00 0.07 A -ATOM 485 1HB ALA A 51 44.657 30.908 25.556 1.00 0.08 A -ATOM 486 2HB ALA A 51 44.851 31.127 27.294 1.00 0.08 A -ATOM 487 3HB ALA A 51 46.256 30.781 26.287 1.00 0.08 A -ATOM 488 N ILE A 52 45.945 33.590 28.395 1.00 0.06 A -ATOM 489 CA ILE A 52 46.733 34.039 29.523 1.00 0.07 A -ATOM 490 C ILE A 52 46.347 33.293 30.788 1.00 0.07 A -ATOM 491 O ILE A 52 45.196 33.254 31.169 1.00 0.07 A -ATOM 492 CB ILE A 52 46.555 35.520 29.810 1.00 0.06 A -ATOM 493 CG1 ILE A 52 47.171 36.333 28.659 1.00 0.05 A -ATOM 494 CG2 ILE A 52 47.243 35.906 31.130 1.00 0.06 A -ATOM 495 CD1 ILE A 52 46.589 37.750 28.622 1.00 0.04 A -ATOM 496 H ILE A 52 44.978 33.490 28.515 1.00 0.07 A -ATOM 497 HA ILE A 52 47.774 33.850 29.314 1.00 0.07 A -ATOM 498 HB ILE A 52 45.501 35.744 29.882 1.00 0.05 A -ATOM 499 1HG1 ILE A 52 48.240 36.394 28.799 1.00 0.05 A -ATOM 500 2HG1 ILE A 52 46.961 35.842 27.725 1.00 0.05 A -ATOM 501 1HG2 ILE A 52 47.402 36.974 31.157 1.00 0.06 A -ATOM 502 2HG2 ILE A 52 48.192 35.397 31.205 1.00 0.07 A -ATOM 503 3HG2 ILE A 52 46.614 35.616 31.959 1.00 0.06 A -ATOM 504 1HD1 ILE A 52 47.020 38.289 27.790 1.00 0.04 A -ATOM 505 2HD1 ILE A 52 46.822 38.264 29.542 1.00 0.04 A -ATOM 506 3HD1 ILE A 52 45.517 37.698 28.497 1.00 0.04 A -ATOM 507 N LYS A 53 47.325 32.753 31.468 1.00 0.08 A -ATOM 508 CA LYS A 53 47.073 32.119 32.746 1.00 0.09 A -ATOM 509 C LYS A 53 47.162 33.312 33.700 1.00 0.09 A -ATOM 510 O LYS A 53 48.207 33.909 33.825 1.00 0.09 A -ATOM 511 CB LYS A 53 48.064 31.002 33.081 1.00 0.10 A -ATOM 512 CG LYS A 53 47.373 29.772 33.749 1.00 0.11 A -ATOM 513 CD LYS A 53 47.317 29.902 35.288 1.00 0.12 A -ATOM 514 CE LYS A 53 46.424 28.781 35.871 1.00 0.13 A -ATOM 515 NZ LYS A 53 46.079 29.045 37.304 1.00 0.13 A -ATOM 516 H LYS A 53 48.240 32.798 31.122 1.00 0.08 A -ATOM 517 HA LYS A 53 46.078 31.699 32.728 1.00 0.09 A -ATOM 518 1HB LYS A 53 48.539 30.678 32.165 1.00 0.10 A -ATOM 519 2HB LYS A 53 48.824 31.383 33.750 1.00 0.10 A -ATOM 520 1HG LYS A 53 46.373 29.665 33.374 1.00 0.11 A -ATOM 521 2HG LYS A 53 47.934 28.883 33.498 1.00 0.12 A -ATOM 522 1HD LYS A 53 48.315 29.805 35.689 1.00 0.12 A -ATOM 523 2HD LYS A 53 46.909 30.862 35.557 1.00 0.11 A -ATOM 524 1HE LYS A 53 45.510 28.720 35.302 1.00 0.12 A -ATOM 525 2HE LYS A 53 46.948 27.840 35.803 1.00 0.13 A -ATOM 526 1HZ LYS A 53 46.485 29.950 37.606 1.00 0.13 A -ATOM 527 2HZ LYS A 53 46.460 28.276 37.897 1.00 0.14 A -ATOM 528 3HZ LYS A 53 45.044 29.076 37.410 1.00 0.13 A -ATOM 529 N PRO A 54 46.049 33.734 34.243 1.00 0.09 A -ATOM 530 CA PRO A 54 45.940 34.975 35.019 1.00 0.08 A -ATOM 531 C PRO A 54 46.634 34.889 36.403 1.00 0.09 A -ATOM 532 O PRO A 54 46.687 33.848 37.022 1.00 0.10 A -ATOM 533 CB PRO A 54 44.419 35.156 35.247 1.00 0.08 A -ATOM 534 CG PRO A 54 43.711 33.998 34.631 1.00 0.08 A -ATOM 535 CD PRO A 54 44.762 32.985 34.242 1.00 0.09 A -ATOM 536 HA PRO A 54 46.345 35.808 34.463 1.00 0.08 A -ATOM 537 1HB PRO A 54 44.201 35.199 36.311 1.00 0.08 A -ATOM 538 2HB PRO A 54 44.090 36.072 34.795 1.00 0.07 A -ATOM 539 1HG PRO A 54 43.032 33.571 35.345 1.00 0.09 A -ATOM 540 2HG PRO A 54 43.164 34.307 33.751 1.00 0.08 A -ATOM 541 1HD PRO A 54 44.801 32.176 34.973 1.00 0.10 A -ATOM 542 2HD PRO A 54 44.540 32.593 33.272 1.00 0.09 A -ATOM 543 N THR A 55 47.121 36.009 36.890 1.00 0.09 A -ATOM 544 CA THR A 55 47.759 36.093 38.212 1.00 0.10 A -ATOM 545 C THR A 55 47.322 37.366 38.926 1.00 0.10 A -ATOM 546 O THR A 55 47.803 37.649 40.005 1.00 0.11 A -ATOM 547 CB THR A 55 49.294 36.242 38.145 1.00 0.11 A -ATOM 548 OG1 THR A 55 49.622 37.403 37.398 1.00 0.10 A -ATOM 549 CG2 THR A 55 49.937 35.013 37.502 1.00 0.11 A -ATOM 550 H THR A 55 47.044 36.828 36.360 1.00 0.08 A -ATOM 551 HA THR A 55 47.527 35.193 38.763 1.00 0.11 A -ATOM 552 HB THR A 55 49.684 36.346 39.148 1.00 0.11 A -ATOM 553 HG1 THR A 55 50.127 37.988 37.968 1.00 0.10 A -ATOM 554 1HG2 THR A 55 49.428 34.772 36.583 1.00 0.10 A -ATOM 555 2HG2 THR A 55 49.873 34.178 38.183 1.00 0.12 A -ATOM 556 3HG2 THR A 55 50.977 35.225 37.294 1.00 0.11 A -ATOM 557 N GLY A 56 46.458 38.162 38.327 1.00 0.09 A -ATOM 558 CA GLY A 56 46.046 39.418 38.947 1.00 0.09 A -ATOM 559 C GLY A 56 44.604 39.428 39.471 1.00 0.09 A -ATOM 560 O GLY A 56 44.100 38.441 39.966 1.00 0.09 A -ATOM 561 H GLY A 56 46.084 37.908 37.458 1.00 0.08 A -ATOM 562 1HA GLY A 56 46.711 39.621 39.772 1.00 0.10 A -ATOM 563 2HA GLY A 56 46.136 40.202 38.211 1.00 0.09 A -ATOM 564 N ASN A 57 43.945 40.588 39.356 1.00 0.08 A -ATOM 565 CA ASN A 57 42.577 40.750 39.822 1.00 0.08 A -ATOM 566 C ASN A 57 41.778 41.630 38.920 1.00 0.08 A -ATOM 567 O ASN A 57 40.710 42.075 39.306 1.00 0.08 A -ATOM 568 CB ASN A 57 42.521 41.365 41.224 1.00 0.09 A -ATOM 569 CG ASN A 57 43.170 42.748 41.224 1.00 0.09 A -ATOM 570 OD1 ASN A 57 42.697 43.664 40.576 1.00 0.09 A -ATOM 571 ND2 ASN A 57 44.248 42.933 41.939 1.00 0.10 A -ATOM 572 H ASN A 57 44.393 41.353 38.938 1.00 0.08 A -ATOM 573 HA ASN A 57 42.099 39.783 39.846 1.00 0.09 A -ATOM 574 1HB ASN A 57 41.491 41.451 41.535 1.00 0.09 A -ATOM 575 2HB ASN A 57 43.050 40.725 41.914 1.00 0.10 A -ATOM 576 N LYS A 58 42.221 41.917 37.734 1.00 0.07 A -ATOM 577 CA LYS A 58 41.372 42.734 36.950 1.00 0.06 A -ATOM 578 C LYS A 58 41.628 42.600 35.448 1.00 0.05 A -ATOM 579 O LYS A 58 42.701 42.244 35.001 1.00 0.05 A -ATOM 580 CB LYS A 58 41.517 44.141 37.443 1.00 0.07 A -ATOM 581 CG LYS A 58 42.825 44.723 36.916 1.00 0.07 A -ATOM 582 CD LYS A 58 43.121 46.093 37.579 1.00 0.08 A -ATOM 583 CE LYS A 58 44.587 46.176 38.062 1.00 0.09 A -ATOM 584 NZ LYS A 58 45.416 46.936 37.087 1.00 0.09 A -ATOM 585 H LYS A 58 43.082 41.583 37.409 1.00 0.07 A -ATOM 586 HA LYS A 58 40.347 42.409 37.058 1.00 0.06 A -ATOM 587 1HB LYS A 58 40.687 44.734 37.085 1.00 0.07 A -ATOM 588 2HB LYS A 58 41.526 44.149 38.521 1.00 0.07 A -ATOM 589 1HG LYS A 58 43.614 44.021 37.118 1.00 0.07 A -ATOM 590 2HG LYS A 58 42.743 44.859 35.847 1.00 0.06 A -ATOM 591 1HD LYS A 58 42.941 46.880 36.859 1.00 0.08 A -ATOM 592 2HD LYS A 58 42.462 46.242 38.426 1.00 0.08 A -ATOM 593 1HE LYS A 58 44.619 46.679 39.012 1.00 0.09 A -ATOM 594 2HE LYS A 58 45.003 45.188 38.179 1.00 0.08 A -ATOM 595 1HZ LYS A 58 45.473 46.412 36.191 1.00 0.08 A -ATOM 596 2HZ LYS A 58 46.372 47.056 37.480 1.00 0.09 A -ATOM 597 3HZ LYS A 58 44.989 47.868 36.918 1.00 0.09 A -ATOM 598 N MET A 59 40.589 42.903 34.674 1.00 0.05 A -ATOM 599 CA MET A 59 40.652 42.860 33.238 1.00 0.04 A -ATOM 600 C MET A 59 40.472 44.289 32.682 1.00 0.05 A -ATOM 601 O MET A 59 39.477 44.941 32.942 1.00 0.05 A -ATOM 602 CB MET A 59 39.550 41.917 32.785 1.00 0.04 A -ATOM 603 CG MET A 59 40.023 40.839 31.827 1.00 0.04 A -ATOM 604 SD MET A 59 38.785 39.504 31.625 1.00 0.05 A -ATOM 605 CE MET A 59 37.878 39.625 33.193 1.00 0.06 A -ATOM 606 H MET A 59 39.758 43.201 35.096 1.00 0.05 A -ATOM 607 HA MET A 59 41.615 42.490 32.918 1.00 0.04 A -ATOM 608 1HB MET A 59 39.176 41.480 33.665 1.00 0.05 A -ATOM 609 2HB MET A 59 38.757 42.485 32.314 1.00 0.05 A -ATOM 610 1HG MET A 59 40.204 41.289 30.863 1.00 0.04 A -ATOM 611 2HG MET A 59 40.924 40.429 32.204 1.00 0.04 A -ATOM 612 1HE MET A 59 37.336 40.559 33.217 1.00 0.05 A -ATOM 613 2HE MET A 59 38.568 39.578 34.019 1.00 0.06 A -ATOM 614 3HE MET A 59 37.185 38.811 33.277 1.00 0.06 A -ATOM 615 N VAL A 60 41.451 44.782 31.927 1.00 0.05 A -ATOM 616 CA VAL A 60 41.380 46.121 31.378 1.00 0.05 A -ATOM 617 C VAL A 60 41.289 46.084 29.877 1.00 0.05 A -ATOM 618 O VAL A 60 41.393 45.055 29.237 1.00 0.05 A -ATOM 619 CB VAL A 60 42.591 46.937 31.700 1.00 0.06 A -ATOM 620 CG1 VAL A 60 42.961 46.748 33.170 1.00 0.06 A -ATOM 621 CG2 VAL A 60 43.758 46.432 30.833 1.00 0.06 A -ATOM 622 H VAL A 60 42.244 44.234 31.751 1.00 0.04 A -ATOM 623 HA VAL A 60 40.511 46.616 31.784 1.00 0.06 A -ATOM 624 HB VAL A 60 42.401 47.968 31.497 1.00 0.07 A -ATOM 625 1HG1 VAL A 60 42.129 47.025 33.794 1.00 0.06 A -ATOM 626 2HG1 VAL A 60 43.815 47.366 33.406 1.00 0.07 A -ATOM 627 3HG1 VAL A 60 43.212 45.712 33.340 1.00 0.06 A -ATOM 628 1HG2 VAL A 60 43.697 46.875 29.847 1.00 0.06 A -ATOM 629 2HG2 VAL A 60 43.686 45.361 30.747 1.00 0.05 A -ATOM 630 3HG2 VAL A 60 44.699 46.686 31.284 1.00 0.06 A -ATOM 631 N ALA A 61 41.112 47.242 29.340 1.00 0.06 A -ATOM 632 CA ALA A 61 41.017 47.412 27.883 1.00 0.07 A -ATOM 633 C ALA A 61 42.345 47.121 27.252 1.00 0.06 A -ATOM 634 O ALA A 61 43.335 47.704 27.655 1.00 0.07 A -ATOM 635 CB ALA A 61 40.618 48.853 27.559 1.00 0.08 A -ATOM 636 H ALA A 61 41.018 48.030 29.915 1.00 0.07 A -ATOM 637 HA ALA A 61 40.273 46.736 27.490 1.00 0.06 A -ATOM 638 1HB ALA A 61 40.560 48.978 26.488 1.00 0.08 A -ATOM 639 2HB ALA A 61 41.357 49.530 27.961 1.00 0.08 A -ATOM 640 3HB ALA A 61 39.655 49.067 27.999 1.00 0.08 A -ATOM 641 N PRO A 62 42.432 46.240 26.269 1.00 0.06 A -ATOM 642 CA PRO A 62 43.755 45.976 25.683 1.00 0.06 A -ATOM 643 C PRO A 62 44.066 46.999 24.574 1.00 0.07 A -ATOM 644 O PRO A 62 45.111 46.948 23.959 1.00 0.07 A -ATOM 645 CB PRO A 62 43.679 44.581 25.038 1.00 0.05 A -ATOM 646 CG PRO A 62 42.193 44.301 24.871 1.00 0.06 A -ATOM 647 CD PRO A 62 41.397 45.423 25.597 1.00 0.06 A -ATOM 648 HA PRO A 62 44.512 45.990 26.452 1.00 0.06 A -ATOM 649 1HB PRO A 62 44.184 44.567 24.081 1.00 0.06 A -ATOM 650 2HB PRO A 62 44.114 43.845 25.692 1.00 0.05 A -ATOM 651 1HG PRO A 62 41.935 44.287 23.817 1.00 0.06 A -ATOM 652 2HG PRO A 62 41.944 43.342 25.311 1.00 0.05 A -ATOM 653 1HD PRO A 62 40.860 46.022 24.876 1.00 0.07 A -ATOM 654 2HD PRO A 62 40.719 44.991 26.313 1.00 0.06 A -ATOM 655 N VAL A 63 43.138 47.896 24.302 1.00 0.08 A -ATOM 656 CA VAL A 63 43.319 48.897 23.230 1.00 0.09 A -ATOM 657 C VAL A 63 42.415 50.097 23.442 1.00 0.10 A -ATOM 658 O VAL A 63 41.448 50.042 24.178 1.00 0.10 A -ATOM 659 CB VAL A 63 43.003 48.369 21.817 1.00 0.09 A -ATOM 660 CG1 VAL A 63 43.818 47.114 21.503 1.00 0.09 A -ATOM 661 CG2 VAL A 63 41.508 48.055 21.709 1.00 0.09 A -ATOM 662 H VAL A 63 42.306 47.899 24.820 1.00 0.08 A -ATOM 663 HA VAL A 63 44.347 49.230 23.247 1.00 0.09 A -ATOM 664 HB VAL A 63 43.252 49.135 21.096 1.00 0.10 A -ATOM 665 1HG1 VAL A 63 43.698 46.865 20.457 1.00 0.09 A -ATOM 666 2HG1 VAL A 63 43.466 46.294 22.109 1.00 0.08 A -ATOM 667 3HG1 VAL A 63 44.860 47.299 21.707 1.00 0.09 A -ATOM 668 1HG2 VAL A 63 40.964 48.975 21.585 1.00 0.10 A -ATOM 669 2HG2 VAL A 63 41.174 47.560 22.606 1.00 0.09 A -ATOM 670 3HG2 VAL A 63 41.330 47.414 20.867 1.00 0.09 A -ATOM 671 N ASP A 64 42.708 51.169 22.735 1.00 0.11 A -ATOM 672 CA ASP A 64 41.847 52.343 22.767 1.00 0.12 A -ATOM 673 C ASP A 64 40.735 51.996 21.791 1.00 0.12 A -ATOM 674 O ASP A 64 40.979 51.554 20.685 1.00 0.12 A -ATOM 675 CB ASP A 64 42.570 53.649 22.472 1.00 0.13 A -ATOM 676 CG ASP A 64 43.757 53.886 23.407 1.00 0.13 A -ATOM 677 OD1 ASP A 64 43.758 53.367 24.508 1.00 0.12 A -ATOM 678 OD2 ASP A 64 44.659 54.594 22.986 1.00 0.13 A -ATOM 679 H ASP A 64 43.494 51.166 22.150 1.00 0.11 A -ATOM 680 HA ASP A 64 41.407 52.414 23.751 1.00 0.11 A -ATOM 681 1HB ASP A 64 42.936 53.621 21.457 1.00 0.13 A -ATOM 682 2HB ASP A 64 41.871 54.468 22.570 1.00 0.13 A -ATOM 683 N GLY A 65 39.517 52.108 22.234 1.00 0.12 A -ATOM 684 CA GLY A 65 38.385 51.714 21.424 1.00 0.12 A -ATOM 685 C GLY A 65 37.103 51.805 22.216 1.00 0.12 A -ATOM 686 O GLY A 65 37.014 52.544 23.179 1.00 0.12 A -ATOM 687 H GLY A 65 39.363 52.439 23.143 1.00 0.12 A -ATOM 688 1HA GLY A 65 38.305 52.376 20.575 1.00 0.13 A -ATOM 689 2HA GLY A 65 38.529 50.702 21.078 1.00 0.12 A -ATOM 690 N THR A 66 36.090 51.081 21.795 1.00 0.13 A -ATOM 691 CA THR A 66 34.809 51.167 22.473 1.00 0.13 A -ATOM 692 C THR A 66 34.346 49.805 22.951 1.00 0.12 A -ATOM 693 O THR A 66 34.398 48.843 22.209 1.00 0.12 A -ATOM 694 CB THR A 66 33.791 51.680 21.429 1.00 0.14 A -ATOM 695 OG1 THR A 66 34.241 52.927 20.930 1.00 0.15 A -ATOM 696 CG2 THR A 66 32.403 51.847 22.051 1.00 0.14 A -ATOM 697 H THR A 66 36.197 50.502 21.011 1.00 0.13 A -ATOM 698 HA THR A 66 34.872 51.855 23.303 1.00 0.13 A -ATOM 699 HB THR A 66 33.729 50.973 20.614 1.00 0.14 A -ATOM 700 HG1 THR A 66 34.729 52.761 20.121 1.00 0.15 A -ATOM 701 1HG2 THR A 66 31.764 52.379 21.359 1.00 0.15 A -ATOM 702 2HG2 THR A 66 32.482 52.406 22.970 1.00 0.14 A -ATOM 703 3HG2 THR A 66 31.980 50.874 22.253 1.00 0.14 A -ATOM 704 N ILE A 67 33.865 49.698 24.170 1.00 0.12 A -ATOM 705 CA ILE A 67 33.400 48.379 24.603 1.00 0.11 A -ATOM 706 C ILE A 67 32.165 48.060 23.817 1.00 0.12 A -ATOM 707 O ILE A 67 31.323 48.910 23.603 1.00 0.13 A -ATOM 708 CB ILE A 67 32.975 48.289 26.069 1.00 0.10 A -ATOM 709 CG1 ILE A 67 34.148 48.553 27.064 1.00 0.10 A -ATOM 710 CG2 ILE A 67 32.332 46.912 26.330 1.00 0.10 A -ATOM 711 CD1 ILE A 67 35.526 48.301 26.445 1.00 0.09 A -ATOM 712 H ILE A 67 33.816 50.472 24.768 1.00 0.12 A -ATOM 713 HA ILE A 67 34.200 47.673 24.444 1.00 0.10 A -ATOM 714 HB ILE A 67 32.209 49.040 26.234 1.00 0.11 A -ATOM 715 1HG1 ILE A 67 34.106 49.579 27.390 1.00 0.10 A -ATOM 716 2HG1 ILE A 67 34.032 47.912 27.926 1.00 0.09 A -ATOM 717 1HG2 ILE A 67 31.309 46.923 25.975 1.00 0.11 A -ATOM 718 2HG2 ILE A 67 32.340 46.701 27.386 1.00 0.10 A -ATOM 719 3HG2 ILE A 67 32.881 46.147 25.802 1.00 0.10 A -ATOM 720 1HD1 ILE A 67 35.590 47.283 26.093 1.00 0.09 A -ATOM 721 2HD1 ILE A 67 36.287 48.466 27.190 1.00 0.09 A -ATOM 722 3HD1 ILE A 67 35.677 48.984 25.623 1.00 0.10 A -ATOM 723 N GLY A 68 32.043 46.847 23.422 1.00 0.12 A -ATOM 724 CA GLY A 68 30.906 46.409 22.664 1.00 0.13 A -ATOM 725 C GLY A 68 29.880 45.657 23.465 1.00 0.13 A -ATOM 726 O GLY A 68 28.741 46.063 23.598 1.00 0.13 A -ATOM 727 H GLY A 68 32.747 46.200 23.638 1.00 0.11 A -ATOM 728 1HA GLY A 68 30.432 47.277 22.231 1.00 0.13 A -ATOM 729 2HA GLY A 68 31.253 45.757 21.876 1.00 0.13 A -ATOM 730 N LYS A 69 30.264 44.542 23.959 1.00 0.12 A -ATOM 731 CA LYS A 69 29.359 43.724 24.698 1.00 0.12 A -ATOM 732 C LYS A 69 30.026 43.072 25.879 1.00 0.11 A -ATOM 733 O LYS A 69 31.116 42.569 25.821 1.00 0.11 A -ATOM 734 CB LYS A 69 28.559 42.766 23.808 1.00 0.13 A -ATOM 735 CG LYS A 69 27.458 42.034 24.639 1.00 0.13 A -ATOM 736 CD LYS A 69 27.688 40.514 24.625 1.00 1.43 A -ATOM 737 CE LYS A 69 26.566 39.820 25.402 1.00 1.48 A -ATOM 738 NZ LYS A 69 25.251 40.133 24.770 1.00 2.16 A -ATOM 739 H LYS A 69 31.188 44.246 23.820 1.00 0.11 A -ATOM 740 HA LYS A 69 28.666 44.365 25.225 1.00 0.12 A -ATOM 741 1HB LYS A 69 28.096 43.333 23.010 1.00 0.15 A -ATOM 742 2HB LYS A 69 29.237 42.046 23.381 1.00 0.17 A -ATOM 743 1HG LYS A 69 27.472 42.375 25.661 1.00 1.01 A -ATOM 744 2HG LYS A 69 26.482 42.244 24.220 1.00 0.97 A -ATOM 745 1HD LYS A 69 27.697 40.156 23.607 1.00 2.12 A -ATOM 746 2HD LYS A 69 28.635 40.290 25.092 1.00 2.13 A -ATOM 747 1HE LYS A 69 26.727 38.753 25.389 1.00 1.66 A -ATOM 748 2HE LYS A 69 26.567 40.172 26.423 1.00 1.84 A -ATOM 749 1HZ LYS A 69 24.664 39.276 24.746 1.00 2.66 A -ATOM 750 2HZ LYS A 69 25.404 40.478 23.800 1.00 2.64 A -ATOM 751 3HZ LYS A 69 24.766 40.866 25.326 1.00 2.46 A -ATOM 752 N ILE A 70 29.287 43.116 26.978 1.00 0.11 A -ATOM 753 CA ILE A 70 29.698 42.559 28.238 1.00 0.11 A -ATOM 754 C ILE A 70 28.705 41.448 28.535 1.00 0.11 A -ATOM 755 O ILE A 70 27.504 41.651 28.511 1.00 0.12 A -ATOM 756 CB ILE A 70 29.740 43.624 29.331 1.00 0.10 A -ATOM 757 CG1 ILE A 70 30.772 44.689 28.924 1.00 0.10 A -ATOM 758 CG2 ILE A 70 30.139 42.986 30.662 1.00 0.10 A -ATOM 759 CD1 ILE A 70 30.833 45.831 29.941 1.00 0.10 A -ATOM 760 H ILE A 70 28.392 43.511 26.920 1.00 0.12 A -ATOM 761 HA ILE A 70 30.683 42.129 28.129 1.00 0.10 A -ATOM 762 HB ILE A 70 28.766 44.080 29.429 1.00 0.11 A -ATOM 763 1HG1 ILE A 70 31.744 44.229 28.854 1.00 0.09 A -ATOM 764 2HG1 ILE A 70 30.505 45.088 27.964 1.00 0.11 A -ATOM 765 1HG2 ILE A 70 30.072 43.724 31.447 1.00 0.09 A -ATOM 766 2HG2 ILE A 70 31.152 42.620 30.596 1.00 0.09 A -ATOM 767 3HG2 ILE A 70 29.473 42.166 30.884 1.00 0.10 A -ATOM 768 1HD1 ILE A 70 31.642 46.498 29.674 1.00 0.09 A -ATOM 769 2HD1 ILE A 70 31.010 45.432 30.927 1.00 0.09 A -ATOM 770 3HD1 ILE A 70 29.902 46.378 29.932 1.00 0.10 A -ATOM 771 N PHE A 71 29.203 40.266 28.772 1.00 0.11 A -ATOM 772 CA PHE A 71 28.329 39.132 29.053 1.00 0.12 A -ATOM 773 C PHE A 71 27.553 39.433 30.351 1.00 0.12 A -ATOM 774 O PHE A 71 28.035 40.082 31.258 1.00 0.11 A -ATOM 775 CB PHE A 71 29.169 37.845 29.165 1.00 0.12 A -ATOM 776 CG PHE A 71 29.326 37.209 27.797 1.00 0.12 A -ATOM 777 CD1 PHE A 71 29.833 37.965 26.723 1.00 0.14 A -ATOM 778 CD2 PHE A 71 28.957 35.863 27.596 1.00 0.18 A -ATOM 779 CE1 PHE A 71 29.972 37.377 25.450 1.00 0.15 A -ATOM 780 CE2 PHE A 71 29.097 35.276 26.324 1.00 0.21 A -ATOM 781 CZ PHE A 71 29.604 36.033 25.252 1.00 0.16 A -ATOM 782 H PHE A 71 30.173 40.135 28.757 1.00 0.10 A -ATOM 783 HA PHE A 71 27.613 39.025 28.252 1.00 0.13 A -ATOM 784 1HB PHE A 71 30.144 38.089 29.560 1.00 0.11 A -ATOM 785 2HB PHE A 71 28.677 37.150 29.831 1.00 0.12 A -ATOM 786 HD1 PHE A 71 30.117 38.996 26.875 1.00 0.19 A -ATOM 787 HD2 PHE A 71 28.567 35.282 28.417 1.00 0.24 A -ATOM 788 HE1 PHE A 71 30.358 37.957 24.627 1.00 0.18 A -ATOM 789 HE2 PHE A 71 28.815 34.245 26.172 1.00 0.28 A -ATOM 790 HZ PHE A 71 29.711 35.583 24.276 1.00 0.18 A -ATOM 791 N GLU A 72 26.340 38.977 30.395 1.00 0.13 A -ATOM 792 CA GLU A 72 25.439 39.189 31.517 1.00 0.13 A -ATOM 793 C GLU A 72 26.018 38.543 32.809 1.00 0.13 A -ATOM 794 O GLU A 72 25.596 38.839 33.909 1.00 0.13 A -ATOM 795 CB GLU A 72 23.982 38.713 31.244 1.00 0.15 A -ATOM 796 CG GLU A 72 23.351 39.613 30.181 1.00 0.15 A -ATOM 797 CD GLU A 72 21.882 39.233 29.992 1.00 0.20 A -ATOM 798 OE1 GLU A 72 21.504 38.164 30.442 1.00 0.20 A -ATOM 799 OE2 GLU A 72 21.160 40.023 29.408 1.00 0.40 A -ATOM 800 H GLU A 72 26.006 38.472 29.626 1.00 0.14 A -ATOM 801 HA GLU A 72 25.418 40.245 31.742 1.00 0.13 A -ATOM 802 1HB GLU A 72 23.996 37.692 30.892 1.00 0.18 A -ATOM 803 2HB GLU A 72 23.405 38.774 32.155 1.00 0.17 A -ATOM 804 1HG GLU A 72 23.419 40.644 30.496 1.00 0.15 A -ATOM 805 2HG GLU A 72 23.876 39.487 29.246 1.00 0.18 A -ATOM 806 N THR A 73 26.992 37.696 32.662 1.00 0.13 A -ATOM 807 CA THR A 73 27.683 37.015 33.772 1.00 0.12 A -ATOM 808 C THR A 73 28.957 37.756 34.087 1.00 0.11 A -ATOM 809 O THR A 73 29.737 37.413 34.948 1.00 0.11 A -ATOM 810 CB THR A 73 27.918 35.516 33.548 1.00 0.13 A -ATOM 811 OG1 THR A 73 28.602 35.327 32.319 1.00 0.14 A -ATOM 812 CG2 THR A 73 26.576 34.777 33.505 1.00 0.15 A -ATOM 813 H THR A 73 27.298 37.495 31.754 1.00 0.13 A -ATOM 814 HA THR A 73 27.086 37.133 34.664 1.00 0.13 A -ATOM 815 HB THR A 73 28.515 35.121 34.356 1.00 0.13 A -ATOM 816 HG1 THR A 73 27.978 35.482 31.606 1.00 0.88 A -ATOM 817 1HG2 THR A 73 26.742 33.724 33.677 1.00 1.02 A -ATOM 818 2HG2 THR A 73 26.120 34.915 32.537 1.00 1.03 A -ATOM 819 3HG2 THR A 73 25.920 35.165 34.271 1.00 1.03 A -ATOM 820 N ASN A 74 29.092 38.818 33.422 1.00 0.11 A -ATOM 821 CA ASN A 74 30.179 39.745 33.613 1.00 0.10 A -ATOM 822 C ASN A 74 31.530 39.067 33.600 1.00 0.09 A -ATOM 823 O ASN A 74 32.365 39.352 34.438 1.00 0.09 A -ATOM 824 CB ASN A 74 29.936 40.411 34.967 1.00 0.10 A -ATOM 825 CG ASN A 74 28.553 41.025 35.040 1.00 0.10 A -ATOM 826 OD1 ASN A 74 27.800 40.738 35.954 1.00 0.11 A -ATOM 827 ND2 ASN A 74 28.195 41.884 34.130 1.00 0.11 A -ATOM 828 H ASN A 74 28.404 39.049 32.766 1.00 0.11 A -ATOM 829 HA ASN A 74 30.182 40.486 32.827 1.00 0.10 A -ATOM 830 1HB ASN A 74 30.038 39.672 35.747 1.00 0.10 A -ATOM 831 2HB ASN A 74 30.674 41.186 35.115 1.00 0.09 A -ATOM 832 N HIS A 75 31.758 38.167 32.668 1.00 0.09 A -ATOM 833 CA HIS A 75 33.001 37.465 32.653 1.00 0.09 A -ATOM 834 C HIS A 75 33.742 37.541 31.293 1.00 0.08 A -ATOM 835 O HIS A 75 34.825 37.010 31.144 1.00 0.08 A -ATOM 836 CB HIS A 75 32.757 36.006 33.049 1.00 0.10 A -ATOM 837 CG HIS A 75 32.243 35.218 31.873 1.00 0.11 A -ATOM 838 ND1 HIS A 75 30.894 35.144 31.561 1.00 0.18 A -ATOM 839 CD2 HIS A 75 32.888 34.457 30.928 1.00 0.16 A -ATOM 840 CE1 HIS A 75 30.770 34.363 30.472 1.00 0.16 A -ATOM 841 NE2 HIS A 75 31.955 33.922 30.048 1.00 0.13 A -ATOM 842 H HIS A 75 31.059 37.956 32.016 1.00 0.10 A -ATOM 843 HA HIS A 75 33.684 37.922 33.355 1.00 0.08 A -ATOM 844 1HB HIS A 75 33.684 35.570 33.391 1.00 0.10 A -ATOM 845 2HB HIS A 75 32.030 35.971 33.848 1.00 0.10 A -ATOM 846 HD2 HIS A 75 33.955 34.300 30.876 1.00 0.27 A -ATOM 847 HE1 HIS A 75 29.829 34.121 30.003 1.00 0.23 A -ATOM 848 HE2 HIS A 75 32.130 33.341 29.278 1.00 0.17 A -ATOM 849 N ALA A 76 33.181 38.178 30.324 1.00 0.09 A -ATOM 850 CA ALA A 76 33.778 38.299 29.051 1.00 0.08 A -ATOM 851 C ALA A 76 33.306 39.548 28.345 1.00 0.09 A -ATOM 852 O ALA A 76 32.212 40.026 28.574 1.00 0.09 A -ATOM 853 CB ALA A 76 33.344 37.093 28.273 1.00 0.09 A -ATOM 854 H ALA A 76 32.296 38.575 30.471 1.00 0.09 A -ATOM 855 HA ALA A 76 34.854 38.318 29.142 1.00 0.08 A -ATOM 856 1HB ALA A 76 32.267 37.086 28.191 1.00 0.10 A -ATOM 857 2HB ALA A 76 33.673 36.199 28.783 1.00 0.09 A -ATOM 858 3HB ALA A 76 33.780 37.126 27.286 1.00 0.09 A -ATOM 859 N PHE A 77 34.110 40.089 27.466 1.00 0.08 A -ATOM 860 CA PHE A 77 33.667 41.265 26.769 1.00 0.08 A -ATOM 861 C PHE A 77 34.299 41.422 25.389 1.00 0.09 A -ATOM 862 O PHE A 77 35.258 40.769 25.019 1.00 0.08 A -ATOM 863 CB PHE A 77 33.925 42.500 27.619 1.00 0.08 A -ATOM 864 CG PHE A 77 35.399 42.843 27.671 1.00 0.07 A -ATOM 865 CD1 PHE A 77 35.969 43.669 26.690 1.00 0.07 A -ATOM 866 CD2 PHE A 77 36.187 42.371 28.723 1.00 0.06 A -ATOM 867 CE1 PHE A 77 37.322 44.022 26.769 1.00 0.06 A -ATOM 868 CE2 PHE A 77 37.541 42.719 28.798 1.00 0.05 A -ATOM 869 CZ PHE A 77 38.108 43.548 27.825 1.00 0.06 A -ATOM 870 H PHE A 77 34.989 39.698 27.279 1.00 0.08 A -ATOM 871 HA PHE A 77 32.610 41.186 26.569 1.00 0.09 A -ATOM 872 1HB PHE A 77 33.383 43.335 27.202 1.00 0.09 A -ATOM 873 2HB PHE A 77 33.572 42.316 28.623 1.00 0.08 A -ATOM 874 HD1 PHE A 77 35.363 44.039 25.878 1.00 0.08 A -ATOM 875 HD2 PHE A 77 35.754 41.728 29.473 1.00 0.06 A -ATOM 876 HE1 PHE A 77 37.763 44.650 26.008 1.00 0.07 A -ATOM 877 HE2 PHE A 77 38.147 42.353 29.613 1.00 0.05 A -ATOM 878 HZ PHE A 77 39.148 43.828 27.893 1.00 0.05 A -ATOM 879 N SER A 78 33.697 42.321 24.640 1.00 0.09 A -ATOM 880 CA SER A 78 34.082 42.642 23.291 1.00 0.10 A -ATOM 881 C SER A 78 34.502 44.100 23.209 1.00 0.10 A -ATOM 882 O SER A 78 33.832 44.949 23.762 1.00 0.10 A -ATOM 883 CB SER A 78 32.836 42.581 22.404 1.00 0.11 A -ATOM 884 OG SER A 78 32.516 41.228 22.141 1.00 0.11 A -ATOM 885 H SER A 78 32.942 42.810 25.028 1.00 0.10 A -ATOM 886 HA SER A 78 34.814 41.930 22.941 1.00 0.09 A -ATOM 887 1HB SER A 78 32.010 43.045 22.910 1.00 0.11 A -ATOM 888 2HB SER A 78 33.019 43.099 21.470 1.00 0.12 A -ATOM 889 HG SER A 78 33.094 40.920 21.439 1.00 0.11 A -ATOM 890 N ILE A 79 35.532 44.414 22.477 1.00 0.10 A -ATOM 891 CA ILE A 79 35.912 45.804 22.297 1.00 0.10 A -ATOM 892 C ILE A 79 36.407 45.963 20.875 1.00 0.11 A -ATOM 893 O ILE A 79 36.941 45.038 20.294 1.00 0.10 A -ATOM 894 CB ILE A 79 37.006 46.218 23.273 1.00 0.09 A -ATOM 895 CG1 ILE A 79 37.588 47.602 22.949 1.00 0.10 A -ATOM 896 CG2 ILE A 79 38.107 45.178 23.244 1.00 0.08 A -ATOM 897 CD1 ILE A 79 38.417 48.111 24.142 1.00 0.09 A -ATOM 898 H ILE A 79 36.041 43.712 22.021 1.00 0.09 A -ATOM 899 HA ILE A 79 35.046 46.428 22.457 1.00 0.10 A -ATOM 900 HB ILE A 79 36.585 46.237 24.267 1.00 0.09 A -ATOM 901 1HG1 ILE A 79 38.222 47.531 22.080 1.00 0.10 A -ATOM 902 2HG1 ILE A 79 36.783 48.294 22.757 1.00 0.10 A -ATOM 903 1HG2 ILE A 79 37.692 44.209 23.483 1.00 0.08 A -ATOM 904 2HG2 ILE A 79 38.857 45.435 23.969 1.00 0.08 A -ATOM 905 3HG2 ILE A 79 38.542 45.155 22.263 1.00 0.09 A -ATOM 906 1HD1 ILE A 79 39.125 48.855 23.803 1.00 0.09 A -ATOM 907 2HD1 ILE A 79 38.948 47.293 24.602 1.00 0.08 A -ATOM 908 3HD1 ILE A 79 37.761 48.552 24.864 1.00 0.09 A -ATOM 909 N GLU A 80 36.231 47.127 20.318 1.00 0.11 A -ATOM 910 CA GLU A 80 36.698 47.421 18.975 1.00 0.12 A -ATOM 911 C GLU A 80 37.686 48.529 19.126 1.00 0.12 A -ATOM 912 O GLU A 80 37.411 49.491 19.790 1.00 0.12 A -ATOM 913 CB GLU A 80 35.554 47.799 18.031 1.00 0.13 A -ATOM 914 CG GLU A 80 36.100 47.977 16.613 1.00 0.18 A -ATOM 915 CD GLU A 80 34.977 48.454 15.690 1.00 0.47 A -ATOM 916 OE1 GLU A 80 33.875 48.641 16.178 1.00 0.84 A -ATOM 917 OE2 GLU A 80 35.238 48.623 14.510 1.00 0.56 A -ATOM 918 H GLU A 80 35.779 47.833 20.825 1.00 0.12 A -ATOM 919 HA GLU A 80 37.198 46.549 18.582 1.00 0.12 A -ATOM 920 1HB GLU A 80 34.811 47.015 18.035 1.00 0.15 A -ATOM 921 2HB GLU A 80 35.105 48.724 18.361 1.00 0.17 A -ATOM 922 1HG GLU A 80 36.894 48.709 16.623 1.00 0.41 A -ATOM 923 2HG GLU A 80 36.483 47.034 16.253 1.00 0.52 A -ATOM 924 N SER A 81 38.846 48.400 18.559 1.00 0.12 A -ATOM 925 CA SER A 81 39.819 49.429 18.757 1.00 0.12 A -ATOM 926 C SER A 81 39.515 50.543 17.823 1.00 0.13 A -ATOM 927 O SER A 81 38.755 50.388 16.884 1.00 0.14 A -ATOM 928 CB SER A 81 41.185 48.957 18.353 1.00 0.12 A -ATOM 929 OG SER A 81 41.147 48.769 16.947 1.00 0.12 A -ATOM 930 H SER A 81 39.049 47.607 18.021 1.00 0.12 A -ATOM 931 HA SER A 81 39.835 49.706 19.801 1.00 0.12 A -ATOM 932 1HB SER A 81 41.927 49.698 18.601 1.00 0.12 A -ATOM 933 2HB SER A 81 41.420 48.028 18.832 1.00 0.11 A -ATOM 934 HG SER A 81 40.223 48.846 16.671 1.00 0.13 A -ATOM 935 N ASP A 82 40.123 51.646 18.029 1.00 0.14 A -ATOM 936 CA ASP A 82 39.894 52.747 17.111 1.00 0.15 A -ATOM 937 C ASP A 82 40.511 52.374 15.746 1.00 0.15 A -ATOM 938 O ASP A 82 40.033 52.776 14.701 1.00 0.16 A -ATOM 939 CB ASP A 82 40.434 54.112 17.606 1.00 0.15 A -ATOM 940 CG ASP A 82 39.735 54.603 18.874 1.00 0.15 A -ATOM 941 OD1 ASP A 82 38.593 54.223 19.086 1.00 0.15 A -ATOM 942 OD2 ASP A 82 40.353 55.373 19.602 1.00 0.15 A -ATOM 943 H ASP A 82 40.733 51.745 18.789 1.00 0.13 A -ATOM 944 HA ASP A 82 38.830 52.842 16.955 1.00 0.15 A -ATOM 945 1HB ASP A 82 41.490 54.017 17.803 1.00 0.15 A -ATOM 946 2HB ASP A 82 40.291 54.843 16.823 1.00 0.16 A -ATOM 947 N SER A 83 41.570 51.598 15.798 1.00 0.15 A -ATOM 948 CA SER A 83 42.317 51.125 14.651 1.00 0.15 A -ATOM 949 C SER A 83 41.526 50.095 13.833 1.00 0.15 A -ATOM 950 O SER A 83 42.036 49.508 12.896 1.00 0.15 A -ATOM 951 CB SER A 83 43.627 50.470 15.061 1.00 0.14 A -ATOM 952 OG SER A 83 43.562 50.103 16.432 1.00 0.13 A -ATOM 953 H SER A 83 41.891 51.327 16.683 1.00 0.14 A -ATOM 954 HA SER A 83 42.533 51.963 14.006 1.00 0.16 A -ATOM 955 1HB SER A 83 43.817 49.586 14.470 1.00 0.14 A -ATOM 956 2HB SER A 83 44.442 51.169 14.913 1.00 0.15 A -ATOM 957 HG SER A 83 42.838 49.485 16.540 1.00 0.13 A -ATOM 958 N GLY A 84 40.325 49.878 14.218 1.00 0.15 A -ATOM 959 CA GLY A 84 39.414 48.918 13.594 1.00 0.15 A -ATOM 960 C GLY A 84 39.603 47.429 13.946 1.00 0.14 A -ATOM 961 O GLY A 84 39.040 46.587 13.269 1.00 0.14 A -ATOM 962 H GLY A 84 39.992 50.377 14.992 1.00 0.15 A -ATOM 963 1HA GLY A 84 38.412 49.188 13.890 1.00 0.15 A -ATOM 964 2HA GLY A 84 39.517 49.026 12.525 1.00 0.16 A -ATOM 965 N VAL A 85 40.336 47.062 14.962 1.00 0.13 A -ATOM 966 CA VAL A 85 40.448 45.637 15.287 1.00 0.12 A -ATOM 967 C VAL A 85 39.368 45.219 16.331 1.00 0.12 A -ATOM 968 O VAL A 85 39.185 45.866 17.344 1.00 0.12 A -ATOM 969 CB VAL A 85 41.852 45.293 15.855 1.00 0.11 A -ATOM 970 CG1 VAL A 85 41.990 43.788 16.135 1.00 0.11 A -ATOM 971 CG2 VAL A 85 42.915 45.752 14.854 1.00 0.12 A -ATOM 972 H VAL A 85 40.797 47.735 15.504 1.00 0.13 A -ATOM 973 HA VAL A 85 40.280 45.059 14.391 1.00 0.13 A -ATOM 974 HB VAL A 85 41.984 45.829 16.787 1.00 0.11 A -ATOM 975 1HG1 VAL A 85 41.280 43.492 16.890 1.00 0.10 A -ATOM 976 2HG1 VAL A 85 42.994 43.584 16.487 1.00 0.10 A -ATOM 977 3HG1 VAL A 85 41.811 43.232 15.228 1.00 0.11 A -ATOM 978 1HG2 VAL A 85 42.469 46.343 14.070 1.00 0.13 A -ATOM 979 2HG2 VAL A 85 43.375 44.894 14.415 1.00 0.12 A -ATOM 980 3HG2 VAL A 85 43.648 46.353 15.369 1.00 0.12 A -ATOM 981 N GLU A 86 38.677 44.104 16.077 1.00 0.12 A -ATOM 982 CA GLU A 86 37.674 43.557 17.011 1.00 0.12 A -ATOM 983 C GLU A 86 38.302 42.449 17.877 1.00 0.11 A -ATOM 984 O GLU A 86 38.826 41.474 17.374 1.00 0.11 A -ATOM 985 CB GLU A 86 36.476 42.971 16.256 1.00 0.13 A -ATOM 986 CG GLU A 86 35.777 44.086 15.474 1.00 0.25 A -ATOM 987 CD GLU A 86 34.583 43.509 14.712 1.00 0.94 A -ATOM 988 OE1 GLU A 86 34.522 42.300 14.574 1.00 1.70 A -ATOM 989 OE2 GLU A 86 33.750 44.288 14.279 1.00 1.05 A -ATOM 990 H GLU A 86 38.858 43.617 15.248 1.00 0.12 A -ATOM 991 HA GLU A 86 37.330 44.346 17.661 1.00 0.12 A -ATOM 992 1HB GLU A 86 36.820 42.209 15.571 1.00 0.20 A -ATOM 993 2HB GLU A 86 35.783 42.537 16.960 1.00 0.18 A -ATOM 994 1HG GLU A 86 35.434 44.846 16.161 1.00 0.89 A -ATOM 995 2HG GLU A 86 36.472 44.523 14.772 1.00 0.93 A -ATOM 996 N LEU A 87 38.263 42.620 19.185 1.00 0.10 A -ATOM 997 CA LEU A 87 38.838 41.667 20.119 1.00 0.09 A -ATOM 998 C LEU A 87 37.765 41.055 20.993 1.00 0.09 A -ATOM 999 O LEU A 87 36.707 41.618 21.205 1.00 0.09 A -ATOM 1000 CB LEU A 87 39.801 42.345 21.125 1.00 0.08 A -ATOM 1001 CG LEU A 87 41.183 42.838 20.650 1.00 0.08 A -ATOM 1002 CD1 LEU A 87 41.826 41.874 19.689 1.00 0.08 A -ATOM 1003 CD2 LEU A 87 41.077 44.229 20.039 1.00 0.09 A -ATOM 1004 H LEU A 87 37.858 43.437 19.544 1.00 0.10 A -ATOM 1005 HA LEU A 87 39.384 40.920 19.562 1.00 0.09 A -ATOM 1006 1HB LEU A 87 39.287 43.187 21.534 1.00 0.08 A -ATOM 1007 2HB LEU A 87 39.969 41.643 21.940 1.00 0.07 A -ATOM 1008 HG LEU A 87 41.824 42.910 21.523 1.00 0.07 A -ATOM 1009 1HD1 LEU A 87 41.264 41.857 18.781 1.00 0.09 A -ATOM 1010 2HD1 LEU A 87 41.841 40.895 20.139 1.00 0.07 A -ATOM 1011 3HD1 LEU A 87 42.841 42.194 19.488 1.00 0.08 A -ATOM 1012 1HD2 LEU A 87 40.418 44.203 19.190 1.00 0.09 A -ATOM 1013 2HD2 LEU A 87 42.059 44.558 19.734 1.00 0.09 A -ATOM 1014 3HD2 LEU A 87 40.686 44.910 20.783 1.00 0.08 A -ATOM 1015 N PHE A 88 38.069 39.920 21.545 1.00 0.08 A -ATOM 1016 CA PHE A 88 37.146 39.270 22.441 1.00 0.08 A -ATOM 1017 C PHE A 88 37.920 38.580 23.573 1.00 0.08 A -ATOM 1018 O PHE A 88 38.624 37.606 23.395 1.00 0.08 A -ATOM 1019 CB PHE A 88 36.217 38.306 21.700 1.00 0.10 A -ATOM 1020 CG PHE A 88 35.195 37.751 22.665 1.00 0.11 A -ATOM 1021 CD1 PHE A 88 34.236 38.608 23.236 1.00 0.15 A -ATOM 1022 CD2 PHE A 88 35.198 36.380 22.992 1.00 0.12 A -ATOM 1023 CE1 PHE A 88 33.280 38.097 24.134 1.00 0.18 A -ATOM 1024 CE2 PHE A 88 34.241 35.868 23.889 1.00 0.15 A -ATOM 1025 CZ PHE A 88 33.282 36.727 24.460 1.00 0.18 A -ATOM 1026 H PHE A 88 38.934 39.505 21.350 1.00 0.08 A -ATOM 1027 HA PHE A 88 36.548 40.021 22.932 1.00 0.09 A -ATOM 1028 1HB PHE A 88 35.712 38.835 20.905 1.00 0.11 A -ATOM 1029 2HB PHE A 88 36.797 37.497 21.282 1.00 0.10 A -ATOM 1030 HD1 PHE A 88 34.233 39.658 22.986 1.00 0.16 A -ATOM 1031 HD2 PHE A 88 35.934 35.722 22.553 1.00 0.13 A -ATOM 1032 HE1 PHE A 88 32.546 38.756 24.572 1.00 0.22 A -ATOM 1033 HE2 PHE A 88 34.242 34.818 24.139 1.00 0.16 A -ATOM 1034 HZ PHE A 88 32.549 36.335 25.150 1.00 0.21 A -ATOM 1035 N VAL A 89 37.742 39.127 24.754 1.00 0.07 A -ATOM 1036 CA VAL A 89 38.356 38.646 25.987 1.00 0.06 A -ATOM 1037 C VAL A 89 37.377 37.849 26.818 1.00 0.07 A -ATOM 1038 O VAL A 89 36.374 38.345 27.292 1.00 0.07 A -ATOM 1039 CB VAL A 89 38.877 39.844 26.725 1.00 0.05 A -ATOM 1040 CG1 VAL A 89 39.703 39.424 27.945 1.00 0.05 A -ATOM 1041 CG2 VAL A 89 39.737 40.622 25.730 1.00 0.05 A -ATOM 1042 H VAL A 89 37.143 39.897 24.824 1.00 0.07 A -ATOM 1043 HA VAL A 89 39.168 37.971 25.757 1.00 0.06 A -ATOM 1044 HB VAL A 89 38.049 40.460 27.043 1.00 0.06 A -ATOM 1045 1HG1 VAL A 89 40.226 40.285 28.337 1.00 0.04 A -ATOM 1046 2HG1 VAL A 89 40.417 38.669 27.656 1.00 0.05 A -ATOM 1047 3HG1 VAL A 89 39.045 39.028 28.705 1.00 0.05 A -ATOM 1048 1HG2 VAL A 89 39.090 41.153 25.045 1.00 0.06 A -ATOM 1049 2HG2 VAL A 89 40.359 39.932 25.170 1.00 0.05 A -ATOM 1050 3HG2 VAL A 89 40.361 41.322 26.254 1.00 0.05 A -ATOM 1051 N HIS A 90 37.677 36.573 26.984 1.00 0.07 A -ATOM 1052 CA HIS A 90 36.797 35.720 27.737 1.00 0.08 A -ATOM 1053 C HIS A 90 37.548 35.048 28.923 1.00 0.08 A -ATOM 1054 O HIS A 90 38.296 34.127 28.744 1.00 0.08 A -ATOM 1055 CB HIS A 90 36.172 34.677 26.766 1.00 0.09 A -ATOM 1056 CG HIS A 90 35.330 33.706 27.547 1.00 0.10 A -ATOM 1057 ND1 HIS A 90 35.881 32.806 28.445 1.00 0.16 A -ATOM 1058 CD2 HIS A 90 33.975 33.483 27.576 1.00 0.16 A -ATOM 1059 CE1 HIS A 90 34.871 32.089 28.972 1.00 0.15 A -ATOM 1060 NE2 HIS A 90 33.688 32.461 28.476 1.00 0.15 A -ATOM 1061 H HIS A 90 38.489 36.207 26.573 1.00 0.07 A -ATOM 1062 HA HIS A 90 36.013 36.312 28.189 1.00 0.08 A -ATOM 1063 1HB HIS A 90 35.555 35.186 26.041 1.00 0.10 A -ATOM 1064 2HB HIS A 90 36.960 34.142 26.256 1.00 0.10 A -ATOM 1065 HD1 HIS A 90 36.832 32.709 28.658 1.00 0.22 A -ATOM 1066 HD2 HIS A 90 33.244 34.019 26.989 1.00 0.24 A -ATOM 1067 HE1 HIS A 90 35.001 31.308 29.706 1.00 0.20 A -ATOM 1068 N PHE A 91 37.322 35.505 30.162 1.00 0.08 A -ATOM 1069 CA PHE A 91 37.981 34.887 31.299 1.00 0.08 A -ATOM 1070 C PHE A 91 37.629 33.397 31.586 1.00 0.09 A -ATOM 1071 O PHE A 91 36.490 33.050 31.828 1.00 0.10 A -ATOM 1072 CB PHE A 91 37.615 35.640 32.583 1.00 0.08 A -ATOM 1073 CG PHE A 91 38.570 35.251 33.687 1.00 0.08 A -ATOM 1074 CD1 PHE A 91 38.322 34.107 34.466 1.00 0.09 A -ATOM 1075 CD2 PHE A 91 39.712 36.037 33.935 1.00 0.07 A -ATOM 1076 CE1 PHE A 91 39.217 33.746 35.493 1.00 0.09 A -ATOM 1077 CE2 PHE A 91 40.606 35.678 34.961 1.00 0.08 A -ATOM 1078 CZ PHE A 91 40.359 34.532 35.740 1.00 0.09 A -ATOM 1079 H PHE A 91 36.698 36.248 30.307 1.00 0.07 A -ATOM 1080 HA PHE A 91 39.051 34.920 31.156 1.00 0.07 A -ATOM 1081 1HB PHE A 91 37.686 36.702 32.405 1.00 0.07 A -ATOM 1082 2HB PHE A 91 36.605 35.392 32.876 1.00 0.08 A -ATOM 1083 HD1 PHE A 91 37.448 33.507 34.277 1.00 0.09 A -ATOM 1084 HD2 PHE A 91 39.900 36.916 33.338 1.00 0.07 A -ATOM 1085 HE1 PHE A 91 39.026 32.867 36.091 1.00 0.10 A -ATOM 1086 HE2 PHE A 91 41.482 36.281 35.150 1.00 0.08 A -ATOM 1087 HZ PHE A 91 41.044 34.255 36.527 1.00 0.09 A -ATOM 1088 N GLY A 92 38.652 32.527 31.637 1.00 0.09 A -ATOM 1089 CA GLY A 92 38.442 31.136 31.983 1.00 0.10 A -ATOM 1090 C GLY A 92 37.692 30.329 30.931 1.00 0.11 A -ATOM 1091 O GLY A 92 37.345 30.803 29.868 1.00 0.11 A -ATOM 1092 H GLY A 92 39.565 32.836 31.455 1.00 0.09 A -ATOM 1093 1HA GLY A 92 39.407 30.681 32.148 1.00 0.10 A -ATOM 1094 2HA GLY A 92 37.866 31.100 32.896 1.00 0.11 A -ATOM 1095 N ILE A 93 37.429 29.084 31.290 1.00 0.12 A -ATOM 1096 CA ILE A 93 36.724 28.149 30.462 1.00 0.13 A -ATOM 1097 C ILE A 93 35.432 27.729 31.165 1.00 0.14 A -ATOM 1098 O ILE A 93 35.381 27.439 32.344 1.00 0.14 A -ATOM 1099 CB ILE A 93 37.626 26.986 30.060 1.00 0.14 A -ATOM 1100 CG1 ILE A 93 38.890 27.508 29.368 1.00 0.13 A -ATOM 1101 CG2 ILE A 93 36.887 25.990 29.164 1.00 0.15 A -ATOM 1102 CD1 ILE A 93 38.541 28.334 28.130 1.00 0.12 A -ATOM 1103 H ILE A 93 37.720 28.785 32.176 1.00 0.12 A -ATOM 1104 HA ILE A 93 36.380 28.654 29.572 1.00 0.13 A -ATOM 1105 HB ILE A 93 37.913 26.465 30.955 1.00 0.14 A -ATOM 1106 1HG1 ILE A 93 39.437 28.129 30.061 1.00 0.12 A -ATOM 1107 2HG1 ILE A 93 39.505 26.672 29.076 1.00 0.13 A -ATOM 1108 1HG2 ILE A 93 36.551 26.482 28.267 1.00 0.14 A -ATOM 1109 2HG2 ILE A 93 36.037 25.591 29.700 1.00 0.15 A -ATOM 1110 3HG2 ILE A 93 37.555 25.179 28.906 1.00 0.15 A -ATOM 1111 1HD1 ILE A 93 37.736 27.863 27.587 1.00 0.13 A -ATOM 1112 2HD1 ILE A 93 39.402 28.400 27.505 1.00 0.12 A -ATOM 1113 3HD1 ILE A 93 38.251 29.324 28.419 1.00 0.12 A -ATOM 1114 N ASP A 94 34.373 27.766 30.401 1.00 0.14 A -ATOM 1115 CA ASP A 94 33.061 27.469 30.883 1.00 0.15 A -ATOM 1116 C ASP A 94 32.701 28.346 32.105 1.00 0.15 A -ATOM 1117 O ASP A 94 31.893 27.959 32.926 1.00 0.15 A -ATOM 1118 CB ASP A 94 32.843 26.015 31.315 1.00 0.16 A -ATOM 1119 CG ASP A 94 32.968 25.097 30.098 1.00 0.17 A -ATOM 1120 OD1 ASP A 94 32.946 25.608 28.990 1.00 0.17 A -ATOM 1121 OD2 ASP A 94 33.082 23.898 30.293 1.00 0.18 A -ATOM 1122 H ASP A 94 34.480 28.023 29.463 1.00 0.14 A -ATOM 1123 HA ASP A 94 32.357 27.694 30.096 1.00 0.15 A -ATOM 1124 1HB ASP A 94 33.587 25.743 32.050 1.00 0.16 A -ATOM 1125 2HB ASP A 94 31.857 25.909 31.743 1.00 0.17 A -ATOM 1126 N THR A 95 33.282 29.503 32.244 1.00 0.14 A -ATOM 1127 CA THR A 95 32.988 30.350 33.364 1.00 0.13 A -ATOM 1128 C THR A 95 31.528 30.879 33.436 1.00 0.14 A -ATOM 1129 O THR A 95 31.080 31.254 34.507 1.00 0.14 A -ATOM 1130 CB THR A 95 34.054 31.455 33.419 1.00 0.12 A -ATOM 1131 OG1 THR A 95 34.344 31.849 32.087 1.00 0.12 A -ATOM 1132 CG2 THR A 95 35.317 30.900 34.061 1.00 0.12 A -ATOM 1133 H THR A 95 33.952 29.801 31.595 1.00 0.13 A -ATOM 1134 HA THR A 95 33.011 29.773 34.277 1.00 0.14 A -ATOM 1135 HB THR A 95 33.688 32.301 33.978 1.00 0.12 A -ATOM 1136 HG1 THR A 95 35.167 32.339 32.096 1.00 0.11 A -ATOM 1137 1HG2 THR A 95 35.657 30.042 33.498 1.00 0.12 A -ATOM 1138 2HG2 THR A 95 35.107 30.606 35.077 1.00 0.12 A -ATOM 1139 3HG2 THR A 95 36.075 31.658 34.058 1.00 0.11 A -ATOM 1140 N VAL A 96 30.782 30.891 32.381 1.00 0.14 A -ATOM 1141 CA VAL A 96 29.381 31.348 32.449 1.00 0.14 A -ATOM 1142 C VAL A 96 28.626 30.511 33.479 1.00 0.15 A -ATOM 1143 O VAL A 96 27.717 30.980 34.136 1.00 0.15 A -ATOM 1144 CB VAL A 96 28.584 31.190 31.131 1.00 0.15 A -ATOM 1145 CG1 VAL A 96 28.409 29.705 30.786 1.00 0.17 A -ATOM 1146 CG2 VAL A 96 27.207 31.845 31.279 1.00 0.17 A -ATOM 1147 H VAL A 96 31.158 30.599 31.524 1.00 0.14 A -ATOM 1148 HA VAL A 96 29.383 32.393 32.720 1.00 0.14 A -ATOM 1149 HB VAL A 96 29.126 31.676 30.332 1.00 0.14 A -ATOM 1150 1HG1 VAL A 96 28.132 29.608 29.746 1.00 1.00 A -ATOM 1151 2HG1 VAL A 96 27.633 29.278 31.405 1.00 1.04 A -ATOM 1152 3HG1 VAL A 96 29.338 29.183 30.961 1.00 1.02 A -ATOM 1153 1HG2 VAL A 96 27.330 32.874 31.583 1.00 1.02 A -ATOM 1154 2HG2 VAL A 96 26.631 31.316 32.023 1.00 1.03 A -ATOM 1155 3HG2 VAL A 96 26.690 31.810 30.332 1.00 1.03 A -ATOM 1156 N GLU A 97 28.993 29.262 33.611 1.00 0.16 A -ATOM 1157 CA GLU A 97 28.307 28.401 34.562 1.00 0.17 A -ATOM 1158 C GLU A 97 28.385 28.958 36.024 1.00 0.17 A -ATOM 1159 O GLU A 97 27.562 28.608 36.847 1.00 0.17 A -ATOM 1160 CB GLU A 97 28.741 26.911 34.483 1.00 0.18 A -ATOM 1161 CG GLU A 97 28.385 26.340 33.107 1.00 0.19 A -ATOM 1162 CD GLU A 97 26.865 26.325 32.931 1.00 0.21 A -ATOM 1163 OE1 GLU A 97 26.171 26.412 33.930 1.00 0.20 A -ATOM 1164 OE2 GLU A 97 26.421 26.226 31.799 1.00 0.24 A -ATOM 1165 H GLU A 97 29.741 28.908 33.086 1.00 0.16 A -ATOM 1166 HA GLU A 97 27.247 28.458 34.369 1.00 0.17 A -ATOM 1167 1HB GLU A 97 29.808 26.839 34.637 1.00 0.18 A -ATOM 1168 2HB GLU A 97 28.229 26.347 35.248 1.00 0.18 A -ATOM 1169 1HG GLU A 97 28.831 26.954 32.338 1.00 0.21 A -ATOM 1170 2HG GLU A 97 28.764 25.332 33.027 1.00 0.19 A -ATOM 1171 N LEU A 98 29.308 29.828 36.357 1.00 0.16 A -ATOM 1172 CA LEU A 98 29.363 30.382 37.694 1.00 0.15 A -ATOM 1173 C LEU A 98 28.312 31.510 37.955 1.00 0.15 A -ATOM 1174 O LEU A 98 28.220 32.041 39.045 1.00 0.15 A -ATOM 1175 CB LEU A 98 30.741 30.978 37.954 1.00 0.15 A -ATOM 1176 CG LEU A 98 31.698 29.928 38.520 1.00 0.15 A -ATOM 1177 CD1 LEU A 98 31.504 28.595 37.792 1.00 0.16 A -ATOM 1178 CD2 LEU A 98 33.135 30.420 38.330 1.00 0.14 A -ATOM 1179 H LEU A 98 29.962 30.114 35.687 1.00 0.15 A -ATOM 1180 HA LEU A 98 29.168 29.599 38.412 1.00 0.16 A -ATOM 1181 1HB LEU A 98 31.138 31.353 37.021 1.00 0.14 A -ATOM 1182 2HB LEU A 98 30.666 31.797 38.659 1.00 0.14 A -ATOM 1183 HG LEU A 98 31.500 29.799 39.575 1.00 0.15 A -ATOM 1184 1HD1 LEU A 98 30.591 28.125 38.117 1.00 0.17 A -ATOM 1185 2HD1 LEU A 98 32.328 27.943 38.011 1.00 0.16 A -ATOM 1186 3HD1 LEU A 98 31.453 28.776 36.728 1.00 0.15 A -ATOM 1187 1HD2 LEU A 98 33.328 30.570 37.277 1.00 0.14 A -ATOM 1188 2HD2 LEU A 98 33.824 29.690 38.723 1.00 0.14 A -ATOM 1189 3HD2 LEU A 98 33.261 31.355 38.852 1.00 0.14 A -ATOM 1190 N LYS A 99 27.577 31.863 36.971 1.00 0.15 A -ATOM 1191 CA LYS A 99 26.555 32.901 37.008 1.00 0.15 A -ATOM 1192 C LYS A 99 26.975 34.234 37.619 1.00 0.14 A -ATOM 1193 O LYS A 99 26.239 34.837 38.374 1.00 0.14 A -ATOM 1194 CB LYS A 99 25.223 32.439 37.615 1.00 0.16 A -ATOM 1195 CG LYS A 99 24.651 31.293 36.776 1.00 1.40 A -ATOM 1196 CD LYS A 99 23.216 30.990 37.224 1.00 1.78 A -ATOM 1197 CE LYS A 99 23.211 30.462 38.665 1.00 2.52 A -ATOM 1198 NZ LYS A 99 23.257 31.609 39.615 1.00 3.21 A -ATOM 1199 H LYS A 99 27.716 31.406 36.116 1.00 0.15 A -ATOM 1200 HA LYS A 99 26.371 33.233 35.998 1.00 0.15 A -ATOM 1201 1HB LYS A 99 25.390 32.098 38.626 1.00 1.00 A -ATOM 1202 2HB LYS A 99 24.525 33.262 37.622 1.00 1.01 A -ATOM 1203 1HG LYS A 99 24.650 31.579 35.734 1.00 2.08 A -ATOM 1204 2HG LYS A 99 25.261 30.412 36.906 1.00 2.05 A -ATOM 1205 1HD LYS A 99 22.627 31.894 37.172 1.00 2.10 A -ATOM 1206 2HD LYS A 99 22.788 30.245 36.570 1.00 2.16 A -ATOM 1207 1HE LYS A 99 22.308 29.894 38.835 1.00 2.93 A -ATOM 1208 2HE LYS A 99 24.069 29.826 38.826 1.00 2.92 A -ATOM 1209 1HZ LYS A 99 24.115 31.544 40.197 1.00 3.61 A -ATOM 1210 2HZ LYS A 99 22.417 31.584 40.230 1.00 3.56 A -ATOM 1211 3HZ LYS A 99 23.270 32.502 39.082 1.00 3.54 A -ATOM 1212 N GLY A 100 28.118 34.736 37.243 1.00 0.13 A -ATOM 1213 CA GLY A 100 28.547 36.049 37.723 1.00 0.13 A -ATOM 1214 C GLY A 100 29.380 36.040 39.021 1.00 0.12 A -ATOM 1215 O GLY A 100 29.981 37.037 39.387 1.00 0.12 A -ATOM 1216 H GLY A 100 28.699 34.228 36.640 1.00 0.13 A -ATOM 1217 1HA GLY A 100 29.138 36.505 36.943 1.00 0.12 A -ATOM 1218 2HA GLY A 100 27.661 36.640 37.897 1.00 0.13 A -ATOM 1219 N GLU A 101 29.409 34.955 39.706 1.00 0.13 A -ATOM 1220 CA GLU A 101 30.155 34.843 40.952 1.00 0.13 A -ATOM 1221 C GLU A 101 31.670 35.057 40.741 1.00 0.12 A -ATOM 1222 O GLU A 101 32.304 34.329 40.002 1.00 0.12 A -ATOM 1223 CB GLU A 101 29.936 33.470 41.602 1.00 0.14 A -ATOM 1224 CG GLU A 101 29.601 33.592 43.122 1.00 0.15 A -ATOM 1225 CD GLU A 101 30.363 32.545 43.942 1.00 0.15 A -ATOM 1226 OE1 GLU A 101 30.358 31.390 43.543 1.00 0.16 A -ATOM 1227 OE2 GLU A 101 30.925 32.918 44.965 1.00 0.15 A -ATOM 1228 H GLU A 101 28.914 34.176 39.376 1.00 0.14 A -ATOM 1229 HA GLU A 101 29.824 35.613 41.632 1.00 0.13 A -ATOM 1230 1HB GLU A 101 29.112 32.981 41.099 1.00 0.15 A -ATOM 1231 2HB GLU A 101 30.823 32.861 41.477 1.00 0.14 A -ATOM 1232 1HG GLU A 101 29.866 34.570 43.487 1.00 0.14 A -ATOM 1233 2HG GLU A 101 28.542 33.438 43.262 1.00 0.15 A -ATOM 1234 N GLY A 102 32.242 36.057 41.425 1.00 0.12 A -ATOM 1235 CA GLY A 102 33.663 36.346 41.348 1.00 0.11 A -ATOM 1236 C GLY A 102 34.037 37.460 40.386 1.00 0.10 A -ATOM 1237 O GLY A 102 35.165 37.871 40.347 1.00 0.10 A -ATOM 1238 H GLY A 102 31.682 36.624 41.996 1.00 0.12 A -ATOM 1239 1HA GLY A 102 33.995 36.628 42.336 1.00 0.12 A -ATOM 1240 2HA GLY A 102 34.166 35.440 41.042 1.00 0.12 A -ATOM 1241 N PHE A 103 33.101 37.932 39.646 1.00 0.10 A -ATOM 1242 CA PHE A 103 33.278 39.036 38.705 1.00 0.09 A -ATOM 1243 C PHE A 103 32.430 40.259 39.120 1.00 0.09 A -ATOM 1244 O PHE A 103 31.382 40.132 39.721 1.00 0.10 A -ATOM 1245 CB PHE A 103 32.807 38.647 37.280 1.00 0.09 A -ATOM 1246 CG PHE A 103 33.515 37.392 36.833 1.00 0.09 A -ATOM 1247 CD1 PHE A 103 34.812 37.464 36.328 1.00 0.09 A -ATOM 1248 CD2 PHE A 103 32.862 36.158 36.911 1.00 0.10 A -ATOM 1249 CE1 PHE A 103 35.458 36.300 35.894 1.00 0.09 A -ATOM 1250 CE2 PHE A 103 33.506 34.994 36.483 1.00 0.10 A -ATOM 1251 CZ PHE A 103 34.804 35.065 35.971 1.00 0.10 A -ATOM 1252 H PHE A 103 32.212 37.532 39.728 1.00 0.11 A -ATOM 1253 HA PHE A 103 34.322 39.302 38.669 1.00 0.09 A -ATOM 1254 1HB PHE A 103 31.740 38.477 37.287 1.00 0.10 A -ATOM 1255 2HB PHE A 103 33.038 39.453 36.605 1.00 0.09 A -ATOM 1256 HD1 PHE A 103 35.316 38.415 36.270 1.00 0.08 A -ATOM 1257 HD2 PHE A 103 31.863 36.104 37.312 1.00 0.11 A -ATOM 1258 HE1 PHE A 103 36.462 36.355 35.505 1.00 0.08 A -ATOM 1259 HE2 PHE A 103 32.998 34.043 36.545 1.00 0.11 A -ATOM 1260 HZ PHE A 103 35.301 34.169 35.630 1.00 0.10 A -ATOM 1261 N LYS A 104 32.896 41.432 38.742 1.00 0.09 A -ATOM 1262 CA LYS A 104 32.228 42.690 38.968 1.00 0.09 A -ATOM 1263 C LYS A 104 32.422 43.580 37.763 1.00 0.08 A -ATOM 1264 O LYS A 104 33.520 44.017 37.472 1.00 0.08 A -ATOM 1265 CB LYS A 104 32.642 43.452 40.217 1.00 0.09 A -ATOM 1266 CG LYS A 104 32.857 42.506 41.420 1.00 0.09 A -ATOM 1267 CD LYS A 104 34.239 41.818 41.348 1.00 0.09 A -ATOM 1268 CE LYS A 104 34.229 40.470 42.093 1.00 0.10 A -ATOM 1269 NZ LYS A 104 35.477 39.704 41.796 1.00 0.10 A -ATOM 1270 H LYS A 104 33.746 41.454 38.257 1.00 0.08 A -ATOM 1271 HA LYS A 104 31.169 42.492 39.039 1.00 0.09 A -ATOM 1272 1HB LYS A 104 33.563 43.985 40.022 1.00 0.09 A -ATOM 1273 2HB LYS A 104 31.870 44.167 40.468 1.00 0.09 A -ATOM 1274 1HG LYS A 104 32.807 43.090 42.329 1.00 0.10 A -ATOM 1275 2HG LYS A 104 32.079 41.764 41.431 1.00 0.10 A -ATOM 1276 1HD LYS A 104 34.494 41.649 40.334 1.00 0.09 A -ATOM 1277 2HD LYS A 104 34.984 42.460 41.795 1.00 0.09 A -ATOM 1278 1HE LYS A 104 34.168 40.647 43.153 1.00 0.10 A -ATOM 1279 2HE LYS A 104 33.376 39.889 41.775 1.00 0.10 A -ATOM 1280 1HZ LYS A 104 35.295 39.028 41.025 1.00 0.10 A -ATOM 1281 2HZ LYS A 104 35.773 39.182 42.648 1.00 0.10 A -ATOM 1282 3HZ LYS A 104 36.234 40.356 41.510 1.00 0.09 A -ATOM 1283 N ARG A 105 31.345 43.858 37.070 1.00 0.09 A -ATOM 1284 CA ARG A 105 31.422 44.722 35.913 1.00 0.08 A -ATOM 1285 C ARG A 105 31.755 46.083 36.329 1.00 0.08 A -ATOM 1286 O ARG A 105 31.069 46.672 37.144 1.00 0.09 A -ATOM 1287 CB ARG A 105 30.170 44.662 35.063 1.00 0.09 A -ATOM 1288 CG ARG A 105 29.981 45.853 34.129 1.00 0.09 A -ATOM 1289 CD ARG A 105 28.582 45.813 33.476 1.00 0.10 A -ATOM 1290 NE ARG A 105 28.176 44.391 33.193 1.00 0.10 A -ATOM 1291 CZ ARG A 105 27.284 44.106 32.274 1.00 0.11 A -ATOM 1292 NH1 ARG A 105 26.790 45.062 31.516 1.00 0.12 A -ATOM 1293 NH2 ARG A 105 26.890 42.873 32.087 1.00 0.12 A -ATOM 1294 H ARG A 105 30.481 43.483 37.339 1.00 0.09 A -ATOM 1295 HA ARG A 105 32.265 44.421 35.310 1.00 0.08 A -ATOM 1296 1HB ARG A 105 30.206 43.766 34.463 1.00 0.09 A -ATOM 1297 2HB ARG A 105 29.316 44.599 35.722 1.00 0.10 A -ATOM 1298 1HG ARG A 105 30.065 46.771 34.687 1.00 0.09 A -ATOM 1299 2HG ARG A 105 30.733 45.827 33.360 1.00 0.09 A -ATOM 1300 1HD ARG A 105 27.859 46.233 34.127 1.00 0.11 A -ATOM 1301 2HD ARG A 105 28.612 46.423 32.572 1.00 0.10 A -ATOM 1302 1HH1 ARG A 105 27.086 46.009 31.643 1.00 0.12 A -ATOM 1303 2HH1 ARG A 105 26.132 44.838 30.794 1.00 0.12 A -ATOM 1304 1HH2 ARG A 105 27.257 42.138 32.649 1.00 0.11 A -ATOM 1305 2HH2 ARG A 105 26.231 42.666 31.363 1.00 0.12 A -ATOM 1306 N ILE A 106 32.834 46.629 35.785 1.00 0.08 A -ATOM 1307 CA ILE A 106 33.127 47.940 36.226 1.00 0.08 A -ATOM 1308 C ILE A 106 32.774 48.896 35.118 1.00 0.09 A -ATOM 1309 O ILE A 106 32.323 49.999 35.369 1.00 0.09 A -ATOM 1310 CB ILE A 106 34.587 48.049 36.605 1.00 0.08 A -ATOM 1311 CG1 ILE A 106 34.931 47.101 37.746 1.00 0.08 A -ATOM 1312 CG2 ILE A 106 34.973 49.502 36.933 1.00 0.09 A -ATOM 1313 CD1 ILE A 106 34.335 47.554 39.080 1.00 0.08 A -ATOM 1314 H ILE A 106 33.386 46.148 35.134 1.00 0.08 A -ATOM 1315 HA ILE A 106 32.516 48.173 37.085 1.00 0.09 A -ATOM 1316 HB ILE A 106 35.170 47.753 35.740 1.00 0.08 A -ATOM 1317 1HG1 ILE A 106 34.560 46.115 37.510 1.00 0.08 A -ATOM 1318 2HG1 ILE A 106 35.995 47.072 37.830 1.00 0.08 A -ATOM 1319 1HG2 ILE A 106 35.221 50.026 36.018 1.00 0.09 A -ATOM 1320 2HG2 ILE A 106 35.834 49.509 37.588 1.00 0.09 A -ATOM 1321 3HG2 ILE A 106 34.149 50.000 37.418 1.00 0.09 A -ATOM 1322 1HD1 ILE A 106 34.447 48.618 39.195 1.00 0.09 A -ATOM 1323 2HD1 ILE A 106 34.859 47.055 39.883 1.00 0.09 A -ATOM 1324 3HD1 ILE A 106 33.291 47.291 39.115 1.00 0.09 A -ATOM 1325 N ALA A 107 32.968 48.498 33.880 1.00 0.09 A -ATOM 1326 CA ALA A 107 32.652 49.400 32.809 1.00 0.09 A -ATOM 1327 C ALA A 107 31.241 49.164 32.249 1.00 0.10 A -ATOM 1328 O ALA A 107 30.533 48.272 32.683 1.00 0.10 A -ATOM 1329 CB ALA A 107 33.688 49.282 31.697 1.00 0.09 A -ATOM 1330 H ALA A 107 33.335 47.607 33.700 1.00 0.08 A -ATOM 1331 HA ALA A 107 32.646 50.412 33.184 1.00 0.10 A -ATOM 1332 1HB ALA A 107 33.636 48.298 31.257 1.00 0.08 A -ATOM 1333 2HB ALA A 107 34.670 49.448 32.107 1.00 0.09 A -ATOM 1334 3HB ALA A 107 33.488 50.027 30.941 1.00 0.09 A -ATOM 1335 N GLU A 108 30.832 49.981 31.266 1.00 0.10 A -ATOM 1336 CA GLU A 108 29.516 49.819 30.654 1.00 0.11 A -ATOM 1337 C GLU A 108 29.598 49.502 29.161 1.00 0.12 A -ATOM 1338 O GLU A 108 30.503 49.943 28.485 1.00 0.11 A -ATOM 1339 CB GLU A 108 28.666 51.102 30.727 1.00 0.12 A -ATOM 1340 CG GLU A 108 28.699 51.805 32.080 1.00 0.12 A -ATOM 1341 CD GLU A 108 27.819 53.060 31.992 1.00 0.13 A -ATOM 1342 OE1 GLU A 108 27.467 53.447 30.883 1.00 0.14 A -ATOM 1343 OE2 GLU A 108 27.503 53.607 33.039 1.00 0.13 A -ATOM 1344 H GLU A 108 31.438 50.677 30.935 1.00 0.11 A -ATOM 1345 HA GLU A 108 28.991 49.027 31.167 1.00 0.11 A -ATOM 1346 1HB GLU A 108 29.017 51.801 29.981 1.00 0.13 A -ATOM 1347 2HB GLU A 108 27.642 50.842 30.499 1.00 0.13 A -ATOM 1348 1HG GLU A 108 28.313 51.151 32.845 1.00 0.12 A -ATOM 1349 2HG GLU A 108 29.710 52.096 32.318 1.00 0.12 A -ATOM 1350 N GLU A 109 28.613 48.790 28.621 1.00 0.12 A -ATOM 1351 CA GLU A 109 28.624 48.563 27.164 1.00 0.12 A -ATOM 1352 C GLU A 109 28.551 49.935 26.469 1.00 0.13 A -ATOM 1353 O GLU A 109 27.810 50.815 26.861 1.00 0.14 A -ATOM 1354 CB GLU A 109 27.573 47.598 26.537 1.00 0.13 A -ATOM 1355 CG GLU A 109 27.709 46.212 27.140 1.00 0.16 A -ATOM 1356 CD GLU A 109 26.631 45.298 26.557 1.00 1.02 A -ATOM 1357 OE1 GLU A 109 25.843 45.778 25.758 1.00 1.60 A -ATOM 1358 OE2 GLU A 109 26.604 44.137 26.926 1.00 1.25 A -ATOM 1359 H GLU A 109 27.882 48.441 29.174 1.00 0.12 A -ATOM 1360 HA GLU A 109 29.600 48.173 26.914 1.00 0.12 A -ATOM 1361 1HB GLU A 109 26.580 47.976 26.730 1.00 0.16 A -ATOM 1362 2HB GLU A 109 27.733 47.541 25.470 1.00 0.15 A -ATOM 1363 1HG GLU A 109 28.678 45.826 26.897 1.00 0.73 A -ATOM 1364 2HG GLU A 109 27.595 46.266 28.210 1.00 0.65 A -ATOM 1365 N GLY A 110 29.344 50.106 25.433 1.00 0.13 A -ATOM 1366 CA GLY A 110 29.399 51.366 24.668 1.00 0.14 A -ATOM 1367 C GLY A 110 30.417 52.318 25.239 1.00 0.14 A -ATOM 1368 O GLY A 110 30.672 53.377 24.691 1.00 0.14 A -ATOM 1369 H GLY A 110 29.916 49.366 25.145 1.00 0.13 A -ATOM 1370 1HA GLY A 110 29.657 51.137 23.645 1.00 0.14 A -ATOM 1371 2HA GLY A 110 28.425 51.831 24.698 1.00 0.15 A -ATOM 1372 N GLN A 111 31.000 51.967 26.333 1.00 0.13 A -ATOM 1373 CA GLN A 111 31.983 52.848 26.895 1.00 0.13 A -ATOM 1374 C GLN A 111 33.220 52.993 26.017 1.00 0.13 A -ATOM 1375 O GLN A 111 33.776 52.043 25.495 1.00 0.12 A -ATOM 1376 CB GLN A 111 32.432 52.339 28.287 1.00 0.12 A -ATOM 1377 CG GLN A 111 33.037 53.489 29.104 1.00 0.12 A -ATOM 1378 CD GLN A 111 33.268 53.040 30.542 1.00 0.11 A -ATOM 1379 OE1 GLN A 111 32.370 52.527 31.192 1.00 0.11 A -ATOM 1380 NE2 GLN A 111 34.451 53.223 31.064 1.00 0.11 A -ATOM 1381 H GLN A 111 30.772 51.120 26.767 1.00 0.12 A -ATOM 1382 HA GLN A 111 31.560 53.836 26.998 1.00 0.13 A -ATOM 1383 1HB GLN A 111 31.579 51.945 28.813 1.00 0.12 A -ATOM 1384 2HB GLN A 111 33.170 51.561 28.168 1.00 0.11 A -ATOM 1385 1HG GLN A 111 33.982 53.776 28.672 1.00 0.12 A -ATOM 1386 2HG GLN A 111 32.365 54.333 29.098 1.00 0.13 A -ATOM 1387 1HE2 GLN A 111 35.157 53.646 30.529 1.00 0.11 A -ATOM 1388 2HE2 GLN A 111 34.640 52.931 31.980 1.00 0.11 A -ATOM 1389 N ARG A 112 33.671 54.218 25.927 1.00 0.13 A -ATOM 1390 CA ARG A 112 34.866 54.540 25.229 1.00 0.14 A -ATOM 1391 C ARG A 112 35.998 54.363 26.183 1.00 0.13 A -ATOM 1392 O ARG A 112 35.928 54.792 27.322 1.00 0.13 A -ATOM 1393 CB ARG A 112 34.852 55.918 24.588 1.00 0.15 A -ATOM 1394 CG ARG A 112 35.198 55.803 23.085 1.00 0.15 A -ATOM 1395 CD ARG A 112 34.867 57.120 22.329 1.00 0.16 A -ATOM 1396 NE ARG A 112 36.005 57.637 21.512 1.00 0.17 A -ATOM 1397 CZ ARG A 112 36.794 56.891 20.836 1.00 0.16 A -ATOM 1398 NH1 ARG A 112 36.488 55.623 20.643 1.00 0.16 A -ATOM 1399 NH2 ARG A 112 37.852 57.402 20.268 1.00 0.17 A -ATOM 1400 H ARG A 112 33.186 54.932 26.392 1.00 0.14 A -ATOM 1401 HA ARG A 112 35.014 53.805 24.453 1.00 0.13 A -ATOM 1402 1HB ARG A 112 33.866 56.348 24.694 1.00 0.15 A -ATOM 1403 2HB ARG A 112 35.575 56.562 25.070 1.00 0.15 A -ATOM 1404 1HG ARG A 112 36.251 55.594 22.995 1.00 0.15 A -ATOM 1405 2HG ARG A 112 34.634 54.994 22.645 1.00 0.15 A -ATOM 1406 1HD ARG A 112 33.945 56.945 21.731 1.00 0.17 A -ATOM 1407 2HD ARG A 112 34.711 57.906 23.003 1.00 0.17 A -ATOM 1408 1HH1 ARG A 112 35.640 55.250 21.025 1.00 0.16 A -ATOM 1409 2HH1 ARG A 112 37.094 55.034 20.107 1.00 0.15 A -ATOM 1410 1HH2 ARG A 112 38.045 58.379 20.360 1.00 0.18 A -ATOM 1411 2HH2 ARG A 112 38.463 56.821 19.729 1.00 0.17 A -ATOM 1412 N VAL A 113 37.042 53.689 25.755 1.00 0.12 A -ATOM 1413 CA VAL A 113 38.113 53.455 26.693 1.00 0.12 A -ATOM 1414 C VAL A 113 39.448 53.595 26.089 1.00 0.12 A -ATOM 1415 O VAL A 113 39.660 53.456 24.897 1.00 0.12 A -ATOM 1416 CB VAL A 113 38.091 52.029 27.244 1.00 0.10 A -ATOM 1417 CG1 VAL A 113 36.789 51.764 27.999 1.00 0.10 A -ATOM 1418 CG2 VAL A 113 38.256 51.019 26.111 1.00 0.10 A -ATOM 1419 H VAL A 113 37.076 53.345 24.839 1.00 0.12 A -ATOM 1420 HA VAL A 113 38.014 54.149 27.516 1.00 0.12 A -ATOM 1421 HB VAL A 113 38.911 51.911 27.924 1.00 0.10 A -ATOM 1422 1HG1 VAL A 113 35.965 51.732 27.304 1.00 0.11 A -ATOM 1423 2HG1 VAL A 113 36.626 52.551 28.721 1.00 0.11 A -ATOM 1424 3HG1 VAL A 113 36.863 50.816 28.515 1.00 0.09 A -ATOM 1425 1HG2 VAL A 113 37.614 51.286 25.287 1.00 0.11 A -ATOM 1426 2HG2 VAL A 113 37.996 50.041 26.477 1.00 0.09 A -ATOM 1427 3HG2 VAL A 113 39.287 51.015 25.782 1.00 0.10 A -ATOM 1428 N LYS A 114 40.358 53.787 26.977 1.00 0.12 A -ATOM 1429 CA LYS A 114 41.739 53.839 26.635 1.00 0.12 A -ATOM 1430 C LYS A 114 42.414 52.614 27.195 1.00 0.11 A -ATOM 1431 O LYS A 114 41.971 52.030 28.169 1.00 0.10 A -ATOM 1432 CB LYS A 114 42.454 55.038 27.227 1.00 0.13 A -ATOM 1433 CG LYS A 114 41.910 56.369 26.670 1.00 0.14 A -ATOM 1434 CD LYS A 114 41.487 57.340 27.796 1.00 0.14 A -ATOM 1435 CE LYS A 114 40.492 56.687 28.779 1.00 0.14 A -ATOM 1436 NZ LYS A 114 40.461 57.426 30.075 1.00 0.14 A -ATOM 1437 H LYS A 114 40.094 53.874 27.917 1.00 0.11 A -ATOM 1438 HA LYS A 114 41.826 53.885 25.559 1.00 0.12 A -ATOM 1439 1HB LYS A 114 42.378 55.003 28.292 1.00 0.12 A -ATOM 1440 2HB LYS A 114 43.505 54.958 26.977 1.00 0.13 A -ATOM 1441 1HG LYS A 114 42.694 56.845 26.090 1.00 0.14 A -ATOM 1442 2HG LYS A 114 41.068 56.180 26.024 1.00 0.14 A -ATOM 1443 1HD LYS A 114 42.363 57.664 28.333 1.00 0.15 A -ATOM 1444 2HD LYS A 114 41.013 58.196 27.340 1.00 0.15 A -ATOM 1445 1HE LYS A 114 39.509 56.689 28.348 1.00 0.14 A -ATOM 1446 2HE LYS A 114 40.777 55.689 28.974 1.00 0.13 A -ATOM 1447 1HZ LYS A 114 39.564 57.939 30.159 1.00 0.14 A -ATOM 1448 2HZ LYS A 114 41.255 58.096 30.118 1.00 0.15 A -ATOM 1449 3HZ LYS A 114 40.541 56.745 30.860 1.00 0.13 A -ATOM 1450 N VAL A 115 43.507 52.259 26.616 1.00 0.11 A -ATOM 1451 CA VAL A 115 44.274 51.158 27.108 1.00 0.10 A -ATOM 1452 C VAL A 115 44.437 51.218 28.626 1.00 0.10 A -ATOM 1453 O VAL A 115 44.738 52.250 29.194 1.00 0.10 A -ATOM 1454 CB VAL A 115 45.653 51.216 26.494 1.00 0.10 A -ATOM 1455 CG1 VAL A 115 46.467 49.992 26.928 1.00 0.09 A -ATOM 1456 CG2 VAL A 115 45.512 51.219 24.954 1.00 0.10 A -ATOM 1457 H VAL A 115 43.827 52.763 25.840 1.00 0.11 A -ATOM 1458 HA VAL A 115 43.794 50.229 26.834 1.00 0.09 A -ATOM 1459 HB VAL A 115 46.156 52.115 26.821 1.00 0.11 A -ATOM 1460 1HG1 VAL A 115 45.901 49.094 26.727 1.00 0.08 A -ATOM 1461 2HG1 VAL A 115 46.691 50.054 27.979 1.00 0.09 A -ATOM 1462 3HG1 VAL A 115 47.387 49.965 26.365 1.00 0.10 A -ATOM 1463 1HG2 VAL A 115 44.474 51.088 24.677 1.00 0.10 A -ATOM 1464 2HG2 VAL A 115 46.090 50.412 24.526 1.00 0.10 A -ATOM 1465 3HG2 VAL A 115 45.866 52.158 24.559 1.00 0.11 A -ATOM 1466 N GLY A 116 44.263 50.094 29.283 1.00 0.09 A -ATOM 1467 CA GLY A 116 44.437 50.039 30.711 1.00 0.09 A -ATOM 1468 C GLY A 116 43.170 50.347 31.516 1.00 0.09 A -ATOM 1469 O GLY A 116 43.124 50.096 32.703 1.00 0.08 A -ATOM 1470 H GLY A 116 44.025 49.278 28.793 1.00 0.08 A -ATOM 1471 1HA GLY A 116 44.769 49.046 30.970 1.00 0.08 A -ATOM 1472 2HA GLY A 116 45.197 50.757 30.982 1.00 0.09 A -ATOM 1473 N ASP A 117 42.155 50.866 30.907 1.00 0.09 A -ATOM 1474 CA ASP A 117 40.906 51.163 31.638 1.00 0.09 A -ATOM 1475 C ASP A 117 40.301 49.874 32.169 1.00 0.08 A -ATOM 1476 O ASP A 117 40.273 48.866 31.494 1.00 0.07 A -ATOM 1477 CB ASP A 117 39.916 51.977 30.757 1.00 0.10 A -ATOM 1478 CG ASP A 117 40.290 53.445 30.606 1.00 0.11 A -ATOM 1479 OD1 ASP A 117 41.131 53.929 31.350 1.00 0.11 A -ATOM 1480 OD2 ASP A 117 39.689 54.066 29.741 1.00 0.11 A -ATOM 1481 H ASP A 117 42.211 51.061 29.949 1.00 0.09 A -ATOM 1482 HA ASP A 117 41.144 51.734 32.523 1.00 0.09 A -ATOM 1483 1HB ASP A 117 39.898 51.529 29.789 1.00 0.09 A -ATOM 1484 2HB ASP A 117 38.928 51.909 31.193 1.00 0.09 A -ATOM 1485 N THR A 118 39.840 49.898 33.418 1.00 0.08 A -ATOM 1486 CA THR A 118 39.283 48.667 34.016 1.00 0.07 A -ATOM 1487 C THR A 118 37.904 48.393 33.499 1.00 0.07 A -ATOM 1488 O THR A 118 37.035 49.247 33.442 1.00 0.08 A -ATOM 1489 CB THR A 118 39.280 48.644 35.577 1.00 0.08 A -ATOM 1490 OG1 THR A 118 40.573 48.983 36.052 1.00 0.08 A -ATOM 1491 CG2 THR A 118 38.881 47.270 36.127 1.00 0.07 A -ATOM 1492 H THR A 118 39.877 50.726 33.941 1.00 0.09 A -ATOM 1493 HA THR A 118 39.869 47.830 33.668 1.00 0.07 A -ATOM 1494 HB THR A 118 38.571 49.377 35.935 1.00 0.08 A -ATOM 1495 HG1 THR A 118 40.475 49.380 36.920 1.00 0.08 A -ATOM 1496 1HG2 THR A 118 37.833 47.093 35.933 1.00 0.07 A -ATOM 1497 2HG2 THR A 118 39.052 47.253 37.196 1.00 0.07 A -ATOM 1498 3HG2 THR A 118 39.472 46.501 35.658 1.00 0.06 A -ATOM 1499 N VAL A 119 37.729 47.154 33.115 1.00 0.06 A -ATOM 1500 CA VAL A 119 36.503 46.699 32.601 1.00 0.07 A -ATOM 1501 C VAL A 119 35.812 45.846 33.639 1.00 0.06 A -ATOM 1502 O VAL A 119 34.637 46.013 33.916 1.00 0.07 A -ATOM 1503 CB VAL A 119 36.746 45.897 31.302 1.00 0.06 A -ATOM 1504 CG1 VAL A 119 35.407 45.478 30.686 1.00 0.07 A -ATOM 1505 CG2 VAL A 119 37.548 46.716 30.287 1.00 0.06 A -ATOM 1506 H VAL A 119 38.477 46.527 33.195 1.00 0.06 A -ATOM 1507 HA VAL A 119 35.866 47.546 32.386 1.00 0.07 A -ATOM 1508 HB VAL A 119 37.307 45.005 31.548 1.00 0.06 A -ATOM 1509 1HG1 VAL A 119 34.789 46.348 30.529 1.00 0.07 A -ATOM 1510 2HG1 VAL A 119 34.903 44.794 31.352 1.00 0.07 A -ATOM 1511 3HG1 VAL A 119 35.584 44.987 29.739 1.00 0.07 A -ATOM 1512 1HG2 VAL A 119 37.742 46.108 29.413 1.00 0.06 A -ATOM 1513 2HG2 VAL A 119 38.486 47.017 30.726 1.00 0.06 A -ATOM 1514 3HG2 VAL A 119 36.987 47.590 29.997 1.00 0.07 A -ATOM 1515 N ILE A 120 36.539 44.928 34.199 1.00 0.06 A -ATOM 1516 CA ILE A 120 35.997 44.014 35.157 1.00 0.06 A -ATOM 1517 C ILE A 120 36.964 43.577 36.189 1.00 0.06 A -ATOM 1518 O ILE A 120 38.118 43.318 35.893 1.00 0.06 A -ATOM 1519 CB ILE A 120 35.564 42.765 34.443 1.00 0.06 A -ATOM 1520 CG1 ILE A 120 34.228 42.991 33.688 1.00 0.07 A -ATOM 1521 CG2 ILE A 120 35.419 41.584 35.433 1.00 0.07 A -ATOM 1522 CD1 ILE A 120 34.138 42.129 32.422 1.00 0.07 A -ATOM 1523 H ILE A 120 37.483 44.857 33.945 1.00 0.06 A -ATOM 1524 HA ILE A 120 35.147 44.465 35.649 1.00 0.07 A -ATOM 1525 HB ILE A 120 36.328 42.511 33.727 1.00 0.06 A -ATOM 1526 1HG1 ILE A 120 33.409 42.739 34.331 1.00 0.07 A -ATOM 1527 2HG1 ILE A 120 34.139 44.009 33.400 1.00 0.07 A -ATOM 1528 1HG2 ILE A 120 34.970 41.937 36.350 1.00 0.07 A -ATOM 1529 2HG2 ILE A 120 36.399 41.172 35.646 1.00 0.06 A -ATOM 1530 3HG2 ILE A 120 34.801 40.818 35.000 1.00 0.07 A -ATOM 1531 1HD1 ILE A 120 33.226 42.375 31.894 1.00 0.07 A -ATOM 1532 2HD1 ILE A 120 34.126 41.086 32.691 1.00 0.07 A -ATOM 1533 3HD1 ILE A 120 34.984 42.331 31.781 1.00 0.06 A -ATOM 1534 N GLU A 121 36.480 43.404 37.412 1.00 0.07 A -ATOM 1535 CA GLU A 121 37.392 42.893 38.402 1.00 0.07 A -ATOM 1536 C GLU A 121 36.933 41.529 38.763 1.00 0.07 A -ATOM 1537 O GLU A 121 35.761 41.230 38.715 1.00 0.08 A -ATOM 1538 CB GLU A 121 37.539 43.810 39.621 1.00 0.08 A -ATOM 1539 CG GLU A 121 37.782 45.230 39.136 1.00 0.08 A -ATOM 1540 CD GLU A 121 37.721 46.193 40.316 1.00 0.08 A -ATOM 1541 OE1 GLU A 121 37.022 45.874 41.268 1.00 0.09 A -ATOM 1542 OE2 GLU A 121 38.371 47.225 40.255 1.00 0.09 A -ATOM 1543 H GLU A 121 35.546 43.613 37.626 1.00 0.07 A -ATOM 1544 HA GLU A 121 38.362 42.770 37.944 1.00 0.07 A -ATOM 1545 1HB GLU A 121 36.638 43.773 40.214 1.00 0.08 A -ATOM 1546 2HB GLU A 121 38.380 43.487 40.217 1.00 0.08 A -ATOM 1547 1HG GLU A 121 38.747 45.294 38.658 1.00 0.07 A -ATOM 1548 2HG GLU A 121 37.023 45.479 38.432 1.00 0.07 A -ATOM 1549 N PHE A 122 37.864 40.682 39.079 1.00 0.08 A -ATOM 1550 CA PHE A 122 37.530 39.336 39.427 1.00 0.08 A -ATOM 1551 C PHE A 122 38.257 38.884 40.709 1.00 0.09 A -ATOM 1552 O PHE A 122 39.232 39.469 41.138 1.00 0.09 A -ATOM 1553 CB PHE A 122 37.927 38.408 38.240 1.00 0.08 A -ATOM 1554 CG PHE A 122 39.362 38.595 37.783 1.00 0.07 A -ATOM 1555 CD1 PHE A 122 40.398 37.866 38.379 1.00 0.08 A -ATOM 1556 CD2 PHE A 122 39.645 39.440 36.703 1.00 0.07 A -ATOM 1557 CE1 PHE A 122 41.710 37.983 37.898 1.00 0.08 A -ATOM 1558 CE2 PHE A 122 40.956 39.562 36.229 1.00 0.06 A -ATOM 1559 CZ PHE A 122 41.988 38.832 36.823 1.00 0.07 A -ATOM 1560 H PHE A 122 38.801 40.967 39.071 1.00 0.08 A -ATOM 1561 HA PHE A 122 36.468 39.258 39.611 1.00 0.09 A -ATOM 1562 1HB PHE A 122 37.799 37.386 38.546 1.00 0.09 A -ATOM 1563 2HB PHE A 122 37.270 38.608 37.412 1.00 0.08 A -ATOM 1564 HD1 PHE A 122 40.188 37.217 39.213 1.00 0.09 A -ATOM 1565 HD2 PHE A 122 38.853 40.011 36.247 1.00 0.06 A -ATOM 1566 HE1 PHE A 122 42.507 37.412 38.352 1.00 0.08 A -ATOM 1567 HE2 PHE A 122 41.167 40.200 35.392 1.00 0.06 A -ATOM 1568 HZ PHE A 122 43.000 38.926 36.452 1.00 0.07 A -ATOM 1569 N ASP A 123 37.753 37.805 41.274 1.00 0.10 A -ATOM 1570 CA ASP A 123 38.306 37.148 42.458 1.00 0.11 A -ATOM 1571 C ASP A 123 39.124 35.922 42.037 1.00 0.11 A -ATOM 1572 O ASP A 123 38.567 34.873 41.780 1.00 0.12 A -ATOM 1573 CB ASP A 123 37.167 36.627 43.320 1.00 0.12 A -ATOM 1574 CG ASP A 123 37.636 36.259 44.727 1.00 0.13 A -ATOM 1575 OD1 ASP A 123 38.572 35.494 44.837 1.00 0.13 A -ATOM 1576 OD2 ASP A 123 37.024 36.726 45.676 1.00 0.13 A -ATOM 1577 H ASP A 123 36.968 37.393 40.858 1.00 0.10 A -ATOM 1578 HA ASP A 123 38.894 37.856 43.024 1.00 0.11 A -ATOM 1579 1HB ASP A 123 36.414 37.397 43.394 1.00 0.11 A -ATOM 1580 2HB ASP A 123 36.725 35.769 42.846 1.00 0.12 A -ATOM 1581 N LEU A 124 40.408 36.025 41.937 1.00 0.11 A -ATOM 1582 CA LEU A 124 41.177 34.891 41.456 1.00 0.11 A -ATOM 1583 C LEU A 124 41.061 33.622 42.262 1.00 0.12 A -ATOM 1584 O LEU A 124 40.787 32.556 41.727 1.00 0.13 A -ATOM 1585 CB LEU A 124 42.671 35.275 41.319 1.00 0.11 A -ATOM 1586 CG LEU A 124 43.506 34.374 40.342 1.00 0.11 A -ATOM 1587 CD1 LEU A 124 42.709 33.855 39.142 1.00 0.11 A -ATOM 1588 CD2 LEU A 124 44.698 35.182 39.800 1.00 0.11 A -ATOM 1589 H LEU A 124 40.855 36.872 42.140 1.00 0.11 A -ATOM 1590 HA LEU A 124 40.798 34.586 40.491 1.00 0.11 A -ATOM 1591 1HB LEU A 124 42.724 36.293 40.971 1.00 0.11 A -ATOM 1592 2HB LEU A 124 43.148 35.227 42.271 1.00 0.12 A -ATOM 1593 HG LEU A 124 43.893 33.530 40.893 1.00 0.12 A -ATOM 1594 1HD1 LEU A 124 42.184 34.670 38.673 1.00 0.10 A -ATOM 1595 2HD1 LEU A 124 42.008 33.110 39.467 1.00 0.11 A -ATOM 1596 3HD1 LEU A 124 43.389 33.411 38.430 1.00 0.11 A -ATOM 1597 1HD2 LEU A 124 44.335 35.994 39.186 1.00 0.10 A -ATOM 1598 2HD2 LEU A 124 45.327 34.536 39.204 1.00 0.11 A -ATOM 1599 3HD2 LEU A 124 45.272 35.581 40.622 1.00 0.11 A -ATOM 1600 N PRO A 125 41.317 33.692 43.480 1.00 0.13 A -ATOM 1601 CA PRO A 125 41.324 32.514 44.319 1.00 0.14 A -ATOM 1602 C PRO A 125 39.962 31.809 44.233 1.00 0.15 A -ATOM 1603 O PRO A 125 39.886 30.604 44.076 1.00 0.15 A -ATOM 1604 CB PRO A 125 41.611 33.060 45.712 1.00 0.15 A -ATOM 1605 CG PRO A 125 42.125 34.455 45.560 1.00 0.14 A -ATOM 1606 CD PRO A 125 41.571 34.943 44.249 1.00 0.13 A -ATOM 1607 HA PRO A 125 42.097 31.826 44.010 1.00 0.15 A -ATOM 1608 1HB PRO A 125 40.703 33.064 46.305 1.00 0.15 A -ATOM 1609 2HB PRO A 125 42.358 32.448 46.203 1.00 0.16 A -ATOM 1610 1HG PRO A 125 41.773 35.081 46.374 1.00 0.14 A -ATOM 1611 2HG PRO A 125 43.206 34.463 45.527 1.00 0.14 A -ATOM 1612 1HD PRO A 125 40.659 35.485 44.405 1.00 0.13 A -ATOM 1613 2HD PRO A 125 42.273 35.568 43.768 1.00 0.13 A -ATOM 1614 N LEU A 126 38.891 32.568 44.304 1.00 0.14 A -ATOM 1615 CA LEU A 126 37.557 31.995 44.183 1.00 0.14 A -ATOM 1616 C LEU A 126 37.449 31.246 42.841 1.00 0.14 A -ATOM 1617 O LEU A 126 37.058 30.091 42.795 1.00 0.15 A -ATOM 1618 CB LEU A 126 36.423 33.047 44.393 1.00 0.14 A -ATOM 1619 CG LEU A 126 35.045 32.742 43.758 1.00 0.14 A -ATOM 1620 CD1 LEU A 126 34.663 31.304 43.892 1.00 0.15 A -ATOM 1621 CD2 LEU A 126 33.954 33.569 44.457 1.00 0.14 A -ATOM 1622 H LEU A 126 38.991 33.536 44.426 1.00 0.14 A -ATOM 1623 HA LEU A 126 37.448 31.218 44.925 1.00 0.15 A -ATOM 1624 1HB LEU A 126 36.280 33.173 45.454 1.00 0.15 A -ATOM 1625 2HB LEU A 126 36.775 33.970 43.998 1.00 0.13 A -ATOM 1626 HG LEU A 126 35.066 33.005 42.714 1.00 0.13 A -ATOM 1627 1HD1 LEU A 126 33.596 31.199 43.721 1.00 0.15 A -ATOM 1628 2HD1 LEU A 126 34.912 30.933 44.874 1.00 0.16 A -ATOM 1629 3HD1 LEU A 126 35.179 30.758 43.155 1.00 0.15 A -ATOM 1630 1HD2 LEU A 126 33.094 33.638 43.807 1.00 0.14 A -ATOM 1631 2HD2 LEU A 126 34.327 34.553 44.674 1.00 0.14 A -ATOM 1632 3HD2 LEU A 126 33.664 33.080 45.381 1.00 0.15 A -ATOM 1633 N LEU A 127 37.800 31.870 41.779 1.00 0.13 A -ATOM 1634 CA LEU A 127 37.708 31.261 40.455 1.00 0.13 A -ATOM 1635 C LEU A 127 38.689 30.140 40.281 1.00 0.14 A -ATOM 1636 O LEU A 127 38.451 29.195 39.551 1.00 0.14 A -ATOM 1637 CB LEU A 127 38.013 32.319 39.392 1.00 0.12 A -ATOM 1638 CG LEU A 127 37.016 33.458 39.454 1.00 0.11 A -ATOM 1639 CD1 LEU A 127 37.561 34.632 38.642 1.00 0.10 A -ATOM 1640 CD2 LEU A 127 35.699 32.990 38.839 1.00 0.12 A -ATOM 1641 H LEU A 127 38.140 32.784 41.860 1.00 0.13 A -ATOM 1642 HA LEU A 127 36.711 30.873 40.303 1.00 0.13 A -ATOM 1643 1HB LEU A 127 39.009 32.705 39.561 1.00 0.12 A -ATOM 1644 2HB LEU A 127 37.980 31.859 38.415 1.00 0.12 A -ATOM 1645 HG LEU A 127 36.868 33.760 40.482 1.00 0.12 A -ATOM 1646 1HD1 LEU A 127 37.930 34.272 37.694 1.00 0.10 A -ATOM 1647 2HD1 LEU A 127 38.367 35.105 39.186 1.00 0.10 A -ATOM 1648 3HD1 LEU A 127 36.770 35.343 38.473 1.00 0.10 A -ATOM 1649 1HD2 LEU A 127 35.043 33.832 38.705 1.00 0.11 A -ATOM 1650 2HD2 LEU A 127 35.234 32.275 39.491 1.00 0.13 A -ATOM 1651 3HD2 LEU A 127 35.893 32.531 37.879 1.00 0.12 A -ATOM 1652 N GLU A 128 39.796 30.230 40.913 1.00 0.14 A -ATOM 1653 CA GLU A 128 40.757 29.171 40.770 1.00 0.14 A -ATOM 1654 C GLU A 128 40.135 27.936 41.376 1.00 0.16 A -ATOM 1655 O GLU A 128 40.266 26.837 40.872 1.00 0.16 A -ATOM 1656 CB GLU A 128 42.055 29.531 41.454 1.00 0.14 A -ATOM 1657 CG GLU A 128 43.001 30.188 40.444 1.00 0.14 A -ATOM 1658 CD GLU A 128 44.366 30.420 41.068 1.00 0.14 A -ATOM 1659 OE1 GLU A 128 44.452 30.421 42.286 1.00 0.15 A -ATOM 1660 OE2 GLU A 128 45.311 30.582 40.306 1.00 0.14 A -ATOM 1661 H GLU A 128 39.982 31.005 41.485 1.00 0.14 A -ATOM 1662 HA GLU A 128 40.944 29.001 39.721 1.00 0.14 A -ATOM 1663 1HB GLU A 128 41.856 30.220 42.262 1.00 0.14 A -ATOM 1664 2HB GLU A 128 42.525 28.640 41.849 1.00 0.15 A -ATOM 1665 1HG GLU A 128 43.119 29.545 39.585 1.00 0.14 A -ATOM 1666 2HG GLU A 128 42.589 31.122 40.134 1.00 0.13 A -ATOM 1667 N GLU A 129 39.423 28.142 42.446 1.00 0.16 A -ATOM 1668 CA GLU A 129 38.732 27.050 43.099 1.00 0.17 A -ATOM 1669 C GLU A 129 37.481 26.600 42.359 1.00 0.17 A -ATOM 1670 O GLU A 129 37.204 25.416 42.284 1.00 0.18 A -ATOM 1671 CB GLU A 129 38.267 27.444 44.497 1.00 0.17 A -ATOM 1672 CG GLU A 129 37.519 26.265 45.158 1.00 0.19 A -ATOM 1673 CD GLU A 129 37.663 26.311 46.681 1.00 0.19 A -ATOM 1674 OE1 GLU A 129 38.697 25.888 47.180 1.00 0.20 A -ATOM 1675 OE2 GLU A 129 36.720 26.756 47.321 1.00 0.19 A -ATOM 1676 H GLU A 129 39.337 29.051 42.805 1.00 0.16 A -ATOM 1677 HA GLU A 129 39.401 26.205 43.176 1.00 0.18 A -ATOM 1678 1HB GLU A 129 39.128 27.712 45.093 1.00 0.18 A -ATOM 1679 2HB GLU A 129 37.603 28.294 44.426 1.00 0.17 A -ATOM 1680 1HG GLU A 129 36.471 26.329 44.910 1.00 0.19 A -ATOM 1681 2HG GLU A 129 37.916 25.329 44.791 1.00 0.19 A -ATOM 1682 N LYS A 130 36.688 27.514 41.863 1.00 0.16 A -ATOM 1683 CA LYS A 130 35.447 27.115 41.235 1.00 0.17 A -ATOM 1684 C LYS A 130 35.480 26.941 39.729 1.00 0.16 A -ATOM 1685 O LYS A 130 34.707 26.168 39.194 1.00 0.17 A -ATOM 1686 CB LYS A 130 34.311 28.041 41.596 1.00 0.16 A -ATOM 1687 CG LYS A 130 34.255 28.297 43.102 1.00 0.17 A -ATOM 1688 CD LYS A 130 32.902 27.866 43.741 1.00 0.18 A -ATOM 1689 CE LYS A 130 33.114 26.771 44.808 1.00 0.19 A -ATOM 1690 NZ LYS A 130 32.239 25.609 44.524 1.00 0.20 A -ATOM 1691 H LYS A 130 36.927 28.461 41.934 1.00 0.16 A -ATOM 1692 HA LYS A 130 35.199 26.114 41.557 1.00 0.18 A -ATOM 1693 1HB LYS A 130 34.446 28.976 41.062 1.00 0.16 A -ATOM 1694 2HB LYS A 130 33.395 27.587 41.260 1.00 0.17 A -ATOM 1695 1HG LYS A 130 35.082 27.828 43.594 1.00 0.17 A -ATOM 1696 2HG LYS A 130 34.354 29.301 43.234 1.00 0.16 A -ATOM 1697 1HD LYS A 130 32.443 28.733 44.211 1.00 0.17 A -ATOM 1698 2HD LYS A 130 32.228 27.498 42.987 1.00 0.18 A -ATOM 1699 1HE LYS A 130 34.135 26.432 44.809 1.00 0.19 A -ATOM 1700 2HE LYS A 130 32.873 27.168 45.780 1.00 0.19 A -ATOM 1701 1HZ LYS A 130 31.244 25.903 44.564 1.00 0.20 A -ATOM 1702 2HZ LYS A 130 32.416 24.873 45.237 1.00 0.20 A -ATOM 1703 3HZ LYS A 130 32.453 25.235 43.577 1.00 0.20 A -ATOM 1704 N ALA A 131 36.285 27.625 39.039 1.00 0.15 A -ATOM 1705 CA ALA A 131 36.276 27.522 37.604 1.00 0.15 A -ATOM 1706 C ALA A 131 36.974 26.294 37.033 1.00 0.16 A -ATOM 1707 O ALA A 131 37.992 25.851 37.521 1.00 0.16 A -ATOM 1708 CB ALA A 131 36.850 28.805 37.039 1.00 0.14 A -ATOM 1709 H ALA A 131 36.895 28.253 39.481 1.00 0.15 A -ATOM 1710 HA ALA A 131 35.265 27.386 37.251 1.00 0.15 A -ATOM 1711 1HB ALA A 131 36.697 28.828 35.970 1.00 0.13 A -ATOM 1712 2HB ALA A 131 37.907 28.850 37.253 1.00 0.14 A -ATOM 1713 3HB ALA A 131 36.354 29.651 37.491 1.00 0.13 A -ATOM 1714 N LYS A 132 36.390 25.746 35.944 1.00 0.16 A -ATOM 1715 CA LYS A 132 36.988 24.567 35.292 1.00 0.17 A -ATOM 1716 C LYS A 132 38.448 24.904 34.918 1.00 0.16 A -ATOM 1717 O LYS A 132 39.345 24.091 35.030 1.00 0.16 A -ATOM 1718 CB LYS A 132 36.184 24.095 34.078 1.00 0.17 A -ATOM 1719 CG LYS A 132 36.069 22.541 33.942 1.00 0.18 A -ATOM 1720 CD LYS A 132 36.634 21.736 35.167 1.00 0.19 A -ATOM 1721 CE LYS A 132 37.474 20.526 34.743 1.00 0.19 A -ATOM 1722 NZ LYS A 132 38.781 20.535 35.478 1.00 0.19 A -ATOM 1723 H LYS A 132 35.572 26.137 35.569 1.00 0.16 A -ATOM 1724 HA LYS A 132 37.037 23.763 36.009 1.00 0.17 A -ATOM 1725 1HB LYS A 132 35.190 24.513 34.151 1.00 0.17 A -ATOM 1726 2HB LYS A 132 36.648 24.490 33.181 1.00 0.16 A -ATOM 1727 1HG LYS A 132 35.020 22.291 33.828 1.00 0.19 A -ATOM 1728 2HG LYS A 132 36.581 22.246 33.042 1.00 0.18 A -ATOM 1729 1HD LYS A 132 37.267 22.343 35.757 1.00 0.18 A -ATOM 1730 2HD LYS A 132 35.808 21.405 35.778 1.00 0.19 A -ATOM 1731 1HE LYS A 132 36.942 19.625 34.982 1.00 0.20 A -ATOM 1732 2HE LYS A 132 37.674 20.557 33.689 1.00 0.19 A -ATOM 1733 1HZ LYS A 132 39.407 19.816 35.066 1.00 0.20 A -ATOM 1734 2HZ LYS A 132 38.619 20.319 36.484 1.00 0.20 A -ATOM 1735 3HZ LYS A 132 39.230 21.470 35.394 1.00 0.18 A -ATOM 1736 N SER A 133 38.647 26.115 34.502 1.00 0.15 A -ATOM 1737 CA SER A 133 39.931 26.663 34.132 1.00 0.14 A -ATOM 1738 C SER A 133 39.870 28.195 34.077 1.00 0.13 A -ATOM 1739 O SER A 133 38.878 28.786 33.696 1.00 0.12 A -ATOM 1740 CB SER A 133 40.509 26.060 32.859 1.00 0.14 A -ATOM 1741 OG SER A 133 41.475 26.946 32.315 1.00 0.13 A -ATOM 1742 H SER A 133 37.871 26.707 34.436 1.00 0.14 A -ATOM 1743 HA SER A 133 40.624 26.484 34.941 1.00 0.14 A -ATOM 1744 1HB SER A 133 40.984 25.119 33.087 1.00 0.15 A -ATOM 1745 2HB SER A 133 39.720 25.893 32.149 1.00 0.14 A -ATOM 1746 HG SER A 133 41.725 26.614 31.450 1.00 0.13 A -ATOM 1747 N THR A 134 40.979 28.815 34.491 1.00 0.12 A -ATOM 1748 CA THR A 134 41.150 30.260 34.516 1.00 0.11 A -ATOM 1749 C THR A 134 41.865 30.736 33.256 1.00 0.10 A -ATOM 1750 O THR A 134 42.072 31.925 33.054 1.00 0.09 A -ATOM 1751 CB THR A 134 41.874 30.775 35.794 1.00 0.11 A -ATOM 1752 OG1 THR A 134 43.184 30.245 35.892 1.00 0.11 A -ATOM 1753 CG2 THR A 134 41.063 30.398 37.029 1.00 0.12 A -ATOM 1754 H THR A 134 41.737 28.267 34.779 1.00 0.13 A -ATOM 1755 HA THR A 134 40.174 30.721 34.467 1.00 0.11 A -ATOM 1756 HB THR A 134 41.926 31.838 35.746 1.00 0.10 A -ATOM 1757 HG1 THR A 134 43.686 30.814 36.488 1.00 0.11 A -ATOM 1758 1HG2 THR A 134 40.051 30.762 36.916 1.00 0.12 A -ATOM 1759 2HG2 THR A 134 41.509 30.853 37.902 1.00 0.12 A -ATOM 1760 3HG2 THR A 134 41.051 29.327 37.145 1.00 0.13 A -ATOM 1761 N LEU A 135 42.206 29.818 32.401 1.00 0.11 A -ATOM 1762 CA LEU A 135 42.851 30.172 31.114 1.00 0.10 A -ATOM 1763 C LEU A 135 41.913 31.153 30.389 1.00 0.09 A -ATOM 1764 O LEU A 135 40.726 30.939 30.301 1.00 0.10 A -ATOM 1765 CB LEU A 135 43.095 28.940 30.251 1.00 0.11 A -ATOM 1766 CG LEU A 135 44.416 28.300 30.651 1.00 0.11 A -ATOM 1767 CD1 LEU A 135 44.591 26.988 29.885 1.00 0.12 A -ATOM 1768 CD2 LEU A 135 45.557 29.279 30.307 1.00 0.10 A -ATOM 1769 H LEU A 135 42.028 28.877 32.613 1.00 0.11 A -ATOM 1770 HA LEU A 135 43.797 30.651 31.317 1.00 0.09 A -ATOM 1771 1HB LEU A 135 42.291 28.233 30.401 1.00 0.11 A -ATOM 1772 2HB LEU A 135 43.131 29.221 29.208 1.00 0.10 A -ATOM 1773 HG LEU A 135 44.409 28.100 31.714 1.00 0.12 A -ATOM 1774 1HD1 LEU A 135 43.843 26.280 30.210 1.00 0.13 A -ATOM 1775 2HD1 LEU A 135 45.574 26.590 30.079 1.00 0.12 A -ATOM 1776 3HD1 LEU A 135 44.477 27.175 28.828 1.00 0.12 A -ATOM 1777 1HD2 LEU A 135 45.250 29.938 29.503 1.00 0.10 A -ATOM 1778 2HD2 LEU A 135 46.433 28.738 30.008 1.00 0.11 A -ATOM 1779 3HD2 LEU A 135 45.791 29.873 31.175 1.00 0.10 A -ATOM 1780 N THR A 136 42.473 32.242 29.937 1.00 0.08 A -ATOM 1781 CA THR A 136 41.782 33.346 29.344 1.00 0.07 A -ATOM 1782 C THR A 136 42.107 33.703 27.925 1.00 0.07 A -ATOM 1783 O THR A 136 43.071 34.393 27.654 1.00 0.06 A -ATOM 1784 CB THR A 136 41.979 34.564 30.264 1.00 0.07 A -ATOM 1785 OG1 THR A 136 41.442 34.245 31.535 1.00 0.07 A -ATOM 1786 CG2 THR A 136 41.284 35.808 29.710 1.00 0.06 A -ATOM 1787 H THR A 136 43.440 32.338 30.048 1.00 0.08 A -ATOM 1788 HA THR A 136 40.731 33.119 29.255 1.00 0.08 A -ATOM 1789 HB THR A 136 43.036 34.767 30.368 1.00 0.06 A -ATOM 1790 HG1 THR A 136 41.946 33.506 31.887 1.00 0.08 A -ATOM 1791 1HG2 THR A 136 41.915 36.273 28.969 1.00 0.05 A -ATOM 1792 2HG2 THR A 136 41.107 36.503 30.513 1.00 0.05 A -ATOM 1793 3HG2 THR A 136 40.343 35.532 29.264 1.00 0.06 A -ATOM 1794 N PRO A 137 41.300 33.226 26.972 1.00 0.08 A -ATOM 1795 CA PRO A 137 41.627 33.557 25.602 1.00 0.07 A -ATOM 1796 C PRO A 137 41.482 35.037 25.259 1.00 0.07 A -ATOM 1797 O PRO A 137 40.543 35.699 25.661 1.00 0.06 A -ATOM 1798 CB PRO A 137 40.575 32.831 24.752 1.00 0.08 A -ATOM 1799 CG PRO A 137 39.806 31.908 25.652 1.00 0.09 A -ATOM 1800 CD PRO A 137 40.193 32.244 27.090 1.00 0.09 A -ATOM 1801 HA PRO A 137 42.621 33.210 25.355 1.00 0.07 A -ATOM 1802 1HB PRO A 137 39.894 33.542 24.291 1.00 0.08 A -ATOM 1803 2HB PRO A 137 41.066 32.259 23.974 1.00 0.09 A -ATOM 1804 1HG PRO A 137 38.738 32.056 25.514 1.00 0.10 A -ATOM 1805 2HG PRO A 137 40.053 30.875 25.434 1.00 0.10 A -ATOM 1806 1HD PRO A 137 39.359 32.640 27.615 1.00 0.09 A -ATOM 1807 2HD PRO A 137 40.562 31.352 27.586 1.00 0.09 A -ATOM 1808 N VAL A 138 42.378 35.502 24.445 1.00 0.06 A -ATOM 1809 CA VAL A 138 42.320 36.835 23.901 1.00 0.06 A -ATOM 1810 C VAL A 138 42.399 36.658 22.428 1.00 0.06 A -ATOM 1811 O VAL A 138 43.421 36.318 21.880 1.00 0.06 A -ATOM 1812 CB VAL A 138 43.214 37.878 24.539 1.00 0.05 A -ATOM 1813 CG1 VAL A 138 43.769 37.357 25.865 1.00 0.04 A -ATOM 1814 CG2 VAL A 138 44.313 38.336 23.583 1.00 0.05 A -ATOM 1815 H VAL A 138 43.114 34.918 24.169 1.00 0.06 A -ATOM 1816 HA VAL A 138 41.301 37.179 23.991 1.00 0.06 A -ATOM 1817 HB VAL A 138 42.608 38.752 24.768 1.00 0.05 A -ATOM 1818 1HG1 VAL A 138 42.970 37.330 26.595 1.00 0.04 A -ATOM 1819 2HG1 VAL A 138 44.550 38.012 26.217 1.00 0.04 A -ATOM 1820 3HG1 VAL A 138 44.152 36.366 25.737 1.00 0.05 A -ATOM 1821 1HG2 VAL A 138 43.854 38.782 22.708 1.00 0.05 A -ATOM 1822 2HG2 VAL A 138 44.905 37.499 23.286 1.00 0.05 A -ATOM 1823 3HG2 VAL A 138 44.930 39.074 24.070 1.00 0.04 A -ATOM 1824 N VAL A 139 41.243 36.821 21.765 1.00 0.07 A -ATOM 1825 CA VAL A 139 41.244 36.590 20.358 1.00 0.08 A -ATOM 1826 C VAL A 139 40.768 37.743 19.486 1.00 0.08 A -ATOM 1827 O VAL A 139 40.067 38.649 19.901 1.00 0.08 A -ATOM 1828 CB VAL A 139 40.539 35.280 19.995 1.00 0.09 A -ATOM 1829 CG1 VAL A 139 41.143 34.120 20.758 1.00 0.09 A -ATOM 1830 CG2 VAL A 139 39.051 35.382 20.312 1.00 0.10 A -ATOM 1831 H VAL A 139 40.422 37.066 22.240 1.00 0.07 A -ATOM 1832 HA VAL A 139 42.266 36.545 20.012 1.00 0.08 A -ATOM 1833 HB VAL A 139 40.659 35.103 18.935 1.00 0.10 A -ATOM 1834 1HG1 VAL A 139 40.849 33.202 20.276 1.00 0.10 A -ATOM 1835 2HG1 VAL A 139 40.788 34.128 21.780 1.00 0.09 A -ATOM 1836 3HG1 VAL A 139 42.218 34.207 20.748 1.00 0.08 A -ATOM 1837 1HG2 VAL A 139 38.584 36.071 19.625 1.00 0.10 A -ATOM 1838 2HG2 VAL A 139 38.920 35.734 21.323 1.00 0.09 A -ATOM 1839 3HG2 VAL A 139 38.597 34.407 20.207 1.00 0.10 A -ATOM 1840 N ILE A 140 41.200 37.661 18.208 1.00 0.09 A -ATOM 1841 CA ILE A 140 40.839 38.640 17.215 1.00 0.10 A -ATOM 1842 C ILE A 140 39.691 38.029 16.485 1.00 0.11 A -ATOM 1843 O ILE A 140 39.773 36.909 16.028 1.00 0.11 A -ATOM 1844 CB ILE A 140 41.989 39.038 16.255 1.00 0.10 A -ATOM 1845 CG1 ILE A 140 42.891 40.102 16.887 1.00 0.09 A -ATOM 1846 CG2 ILE A 140 41.420 39.645 14.972 1.00 0.11 A -ATOM 1847 CD1 ILE A 140 43.617 39.570 18.119 1.00 0.08 A -ATOM 1848 H ILE A 140 41.740 36.889 17.938 1.00 0.09 A -ATOM 1849 HA ILE A 140 40.503 39.530 17.726 1.00 0.10 A -ATOM 1850 HB ILE A 140 42.576 38.164 16.014 1.00 0.10 A -ATOM 1851 1HG1 ILE A 140 43.621 40.416 16.159 1.00 0.09 A -ATOM 1852 2HG1 ILE A 140 42.291 40.943 17.157 1.00 0.09 A -ATOM 1853 1HG2 ILE A 140 40.957 38.875 14.375 1.00 0.12 A -ATOM 1854 2HG2 ILE A 140 42.214 40.113 14.405 1.00 0.11 A -ATOM 1855 3HG2 ILE A 140 40.690 40.382 15.240 1.00 0.11 A -ATOM 1856 1HD1 ILE A 140 42.914 39.416 18.916 1.00 0.08 A -ATOM 1857 2HD1 ILE A 140 44.360 40.292 18.429 1.00 0.08 A -ATOM 1858 3HD1 ILE A 140 44.101 38.637 17.881 1.00 0.08 A -ATOM 1859 N SER A 141 38.606 38.735 16.420 1.00 0.11 A -ATOM 1860 CA SER A 141 37.412 38.192 15.816 1.00 0.12 A -ATOM 1861 C SER A 141 37.215 38.653 14.333 1.00 0.13 A -ATOM 1862 O SER A 141 36.312 38.250 13.626 1.00 0.14 A -ATOM 1863 CB SER A 141 36.167 38.436 16.665 1.00 0.12 A -ATOM 1864 OG SER A 141 35.786 39.801 16.558 1.00 0.12 A -ATOM 1865 H SER A 141 38.594 39.637 16.804 1.00 0.11 A -ATOM 1866 HA SER A 141 37.542 37.128 15.687 1.00 0.13 A -ATOM 1867 1HB SER A 141 35.361 37.814 16.313 1.00 0.13 A -ATOM 1868 2HB SER A 141 36.383 38.192 17.697 1.00 0.12 A -ATOM 1869 HG SER A 141 34.903 39.834 16.182 1.00 0.12 A -ATOM 1870 N ASN A 142 38.075 39.484 13.944 1.00 0.13 A -ATOM 1871 CA ASN A 142 38.226 40.144 12.655 1.00 0.14 A -ATOM 1872 C ASN A 142 39.261 39.480 11.712 1.00 0.14 A -ATOM 1873 O ASN A 142 39.740 40.123 10.795 1.00 0.15 A -ATOM 1874 CB ASN A 142 39.006 41.423 13.072 1.00 0.13 A -ATOM 1875 CG ASN A 142 38.203 42.661 12.706 1.00 0.14 A -ATOM 1876 OD1 ASN A 142 38.670 43.768 12.863 1.00 0.14 A -ATOM 1877 ND2 ASN A 142 36.997 42.519 12.235 1.00 0.15 A -ATOM 1878 H ASN A 142 38.712 39.778 14.620 1.00 0.12 A -ATOM 1879 HA ASN A 142 37.270 40.388 12.218 1.00 0.15 A -ATOM 1880 1HB ASN A 142 39.149 41.435 14.137 1.00 0.13 A -ATOM 1881 2HB ASN A 142 39.975 41.485 12.592 1.00 0.13 A -ATOM 1882 N MET A 143 39.670 38.294 11.973 1.00 0.14 A -ATOM 1883 CA MET A 143 40.724 37.675 11.198 1.00 0.14 A -ATOM 1884 C MET A 143 40.762 38.056 9.693 1.00 0.15 A -ATOM 1885 O MET A 143 41.817 38.359 9.160 1.00 0.15 A -ATOM 1886 CB MET A 143 40.833 36.159 11.443 1.00 0.14 A -ATOM 1887 CG MET A 143 41.387 35.772 12.829 1.00 0.13 A -ATOM 1888 SD MET A 143 42.837 36.758 13.309 1.00 0.12 A -ATOM 1889 CE MET A 143 44.113 35.861 12.380 1.00 0.12 A -ATOM 1890 H MET A 143 39.276 37.802 12.724 1.00 0.13 A -ATOM 1891 HA MET A 143 41.663 38.135 11.463 1.00 0.13 A -ATOM 1892 1HB MET A 143 39.850 35.728 11.341 1.00 0.14 A -ATOM 1893 2HB MET A 143 41.473 35.736 10.681 1.00 0.14 A -ATOM 1894 1HG MET A 143 40.615 35.894 13.566 1.00 0.13 A -ATOM 1895 2HG MET A 143 41.673 34.727 12.793 1.00 0.13 A -ATOM 1896 1HE MET A 143 43.742 35.616 11.400 1.00 0.13 A -ATOM 1897 2HE MET A 143 44.377 34.956 12.897 1.00 0.12 A -ATOM 1898 3HE MET A 143 44.990 36.479 12.290 1.00 0.12 A -ATOM 1899 N ASP A 144 39.701 38.073 9.029 1.00 0.16 A -ATOM 1900 CA ASP A 144 39.682 38.433 7.618 1.00 0.17 A -ATOM 1901 C ASP A 144 40.100 39.857 7.366 1.00 0.17 A -ATOM 1902 O ASP A 144 40.334 40.192 6.221 1.00 0.17 A -ATOM 1903 CB ASP A 144 38.320 38.115 6.946 1.00 0.18 A -ATOM 1904 CG ASP A 144 38.117 36.599 6.895 1.00 0.19 A -ATOM 1905 OD1 ASP A 144 39.075 35.885 7.142 1.00 0.18 A -ATOM 1906 OD2 ASP A 144 37.008 36.179 6.609 1.00 0.24 A -ATOM 1907 H ASP A 144 38.864 37.820 9.475 1.00 0.16 A -ATOM 1908 HA ASP A 144 40.458 37.881 7.109 1.00 0.17 A -ATOM 1909 1HB ASP A 144 37.522 38.566 7.518 1.00 0.17 A -ATOM 1910 2HB ASP A 144 38.312 38.512 5.942 1.00 0.19 A -ATOM 1911 N GLU A 145 40.218 40.717 8.354 1.00 0.16 A -ATOM 1912 CA GLU A 145 40.632 42.069 8.015 1.00 0.16 A -ATOM 1913 C GLU A 145 42.035 42.322 8.408 1.00 0.16 A -ATOM 1914 O GLU A 145 42.451 43.469 8.423 1.00 0.16 A -ATOM 1915 CB GLU A 145 39.708 43.156 8.624 1.00 0.16 A -ATOM 1916 CG GLU A 145 38.232 42.752 8.480 1.00 0.17 A -ATOM 1917 CD GLU A 145 37.345 43.689 9.311 1.00 0.17 A -ATOM 1918 OE1 GLU A 145 37.840 44.728 9.730 1.00 0.17 A -ATOM 1919 OE2 GLU A 145 36.188 43.349 9.521 1.00 0.17 A -ATOM 1920 H GLU A 145 40.013 40.450 9.274 1.00 0.16 A -ATOM 1921 HA GLU A 145 40.623 42.172 6.940 1.00 0.17 A -ATOM 1922 1HB GLU A 145 39.944 43.278 9.671 1.00 0.16 A -ATOM 1923 2HB GLU A 145 39.873 44.091 8.109 1.00 0.17 A -ATOM 1924 1HG GLU A 145 37.943 42.820 7.444 1.00 0.18 A -ATOM 1925 2HG GLU A 145 38.101 41.740 8.826 1.00 0.17 A -ATOM 1926 N ILE A 146 42.798 41.309 8.750 1.00 0.15 A -ATOM 1927 CA ILE A 146 44.132 41.641 9.181 1.00 0.14 A -ATOM 1928 C ILE A 146 45.224 41.015 8.339 1.00 0.14 A -ATOM 1929 O ILE A 146 45.151 39.886 7.894 1.00 0.15 A -ATOM 1930 CB ILE A 146 44.322 41.388 10.685 1.00 0.13 A -ATOM 1931 CG1 ILE A 146 44.518 39.888 10.947 1.00 0.13 A -ATOM 1932 CG2 ILE A 146 43.131 41.888 11.516 1.00 0.13 A -ATOM 1933 CD1 ILE A 146 45.441 39.715 12.134 1.00 0.12 A -ATOM 1934 H ILE A 146 42.454 40.391 8.756 1.00 0.15 A -ATOM 1935 HA ILE A 146 44.316 42.685 8.976 1.00 0.15 A -ATOM 1936 HB ILE A 146 45.204 41.926 11.006 1.00 0.13 A -ATOM 1937 1HG1 ILE A 146 43.570 39.425 11.162 1.00 0.13 A -ATOM 1938 2HG1 ILE A 146 44.958 39.400 10.101 1.00 0.13 A -ATOM 1939 1HG2 ILE A 146 42.988 42.943 11.352 1.00 0.13 A -ATOM 1940 2HG2 ILE A 146 43.340 41.713 12.565 1.00 0.12 A -ATOM 1941 3HG2 ILE A 146 42.241 41.348 11.236 1.00 0.13 A -ATOM 1942 1HD1 ILE A 146 46.426 40.087 11.883 1.00 0.12 A -ATOM 1943 2HD1 ILE A 146 45.495 38.679 12.359 1.00 0.11 A -ATOM 1944 3HD1 ILE A 146 45.052 40.259 12.979 1.00 0.11 A -ATOM 1945 N LYS A 147 46.267 41.806 8.113 1.00 0.15 A -ATOM 1946 CA LYS A 147 47.392 41.323 7.309 1.00 0.15 A -ATOM 1947 C LYS A 147 48.220 40.338 8.121 1.00 0.14 A -ATOM 1948 O LYS A 147 48.397 39.207 7.693 1.00 0.14 A -ATOM 1949 CB LYS A 147 48.194 42.424 6.592 1.00 0.15 A -ATOM 1950 CG LYS A 147 48.813 41.956 5.239 1.00 0.16 A -ATOM 1951 CD LYS A 147 47.756 41.372 4.248 1.00 0.17 A -ATOM 1952 CE LYS A 147 48.376 41.134 2.853 1.00 0.18 A -ATOM 1953 NZ LYS A 147 47.694 39.996 2.150 1.00 0.18 A -ATOM 1954 H LYS A 147 46.288 42.715 8.482 1.00 0.14 A -ATOM 1955 HA LYS A 147 47.005 40.648 6.559 1.00 0.15 A -ATOM 1956 1HB LYS A 147 47.569 43.226 6.397 1.00 0.16 A -ATOM 1957 2HB LYS A 147 48.994 42.748 7.240 1.00 0.15 A -ATOM 1958 1HG LYS A 147 49.272 42.816 4.770 1.00 0.17 A -ATOM 1959 2HG LYS A 147 49.571 41.218 5.432 1.00 0.16 A -ATOM 1960 1HD LYS A 147 47.398 40.430 4.614 1.00 0.16 A -ATOM 1961 2HD LYS A 147 46.932 42.063 4.158 1.00 0.17 A -ATOM 1962 1HE LYS A 147 48.270 42.025 2.257 1.00 0.18 A -ATOM 1963 2HE LYS A 147 49.423 40.899 2.962 1.00 0.17 A -ATOM 1964 1HZ LYS A 147 46.689 39.964 2.413 1.00 0.18 A -ATOM 1965 2HZ LYS A 147 48.150 39.098 2.413 1.00 0.18 A -ATOM 1966 3HZ LYS A 147 47.774 40.131 1.120 1.00 0.19 A -ATOM 1967 N GLU A 148 48.692 40.671 9.274 1.00 0.13 A -ATOM 1968 CA GLU A 148 49.415 39.676 10.028 1.00 0.12 A -ATOM 1969 C GLU A 148 49.258 39.805 11.526 1.00 0.11 A -ATOM 1970 O GLU A 148 49.166 40.857 12.099 1.00 0.11 A -ATOM 1971 CB GLU A 148 50.905 39.513 9.649 1.00 0.12 A -ATOM 1972 CG GLU A 148 51.255 38.040 9.229 1.00 0.12 A -ATOM 1973 CD GLU A 148 51.972 37.967 7.866 1.00 0.13 A -ATOM 1974 OE1 GLU A 148 52.606 38.936 7.475 1.00 0.14 A -ATOM 1975 OE2 GLU A 148 51.868 36.915 7.238 1.00 0.14 A -ATOM 1976 H GLU A 148 48.552 41.575 9.624 1.00 0.13 A -ATOM 1977 HA GLU A 148 48.927 38.725 9.878 1.00 0.12 A -ATOM 1978 1HB GLU A 148 51.124 40.180 8.827 1.00 0.13 A -ATOM 1979 2HB GLU A 148 51.526 39.795 10.492 1.00 0.12 A -ATOM 1980 1HG GLU A 148 51.899 37.603 9.974 1.00 0.12 A -ATOM 1981 2HG GLU A 148 50.359 37.446 9.162 1.00 0.13 A -ATOM 1982 N LEU A 149 49.258 38.620 12.107 1.00 0.11 A -ATOM 1983 CA LEU A 149 49.183 38.379 13.500 1.00 0.10 A -ATOM 1984 C LEU A 149 50.482 37.710 13.986 1.00 0.09 A -ATOM 1985 O LEU A 149 50.785 36.571 13.679 1.00 0.10 A -ATOM 1986 CB LEU A 149 47.959 37.504 13.799 1.00 0.10 A -ATOM 1987 CG LEU A 149 47.313 37.817 15.166 1.00 0.09 A -ATOM 1988 CD1 LEU A 149 45.790 37.715 15.048 1.00 0.09 A -ATOM 1989 CD2 LEU A 149 47.794 36.801 16.198 1.00 0.08 A -ATOM 1990 H LEU A 149 49.339 37.839 11.521 1.00 0.11 A -ATOM 1991 HA LEU A 149 49.091 39.319 14.024 1.00 0.10 A -ATOM 1992 1HB LEU A 149 47.245 37.656 13.017 1.00 0.10 A -ATOM 1993 2HB LEU A 149 48.261 36.463 13.775 1.00 0.10 A -ATOM 1994 HG LEU A 149 47.573 38.812 15.489 1.00 0.09 A -ATOM 1995 1HD1 LEU A 149 45.412 38.584 14.544 1.00 0.10 A -ATOM 1996 2HD1 LEU A 149 45.351 37.658 16.030 1.00 0.09 A -ATOM 1997 3HD1 LEU A 149 45.533 36.831 14.485 1.00 0.10 A -ATOM 1998 1HD2 LEU A 149 47.343 35.842 15.989 1.00 0.09 A -ATOM 1999 2HD2 LEU A 149 47.507 37.129 17.183 1.00 0.08 A -ATOM 2000 3HD2 LEU A 149 48.867 36.714 16.140 1.00 0.08 A -ATOM 2001 N ILE A 150 51.214 38.454 14.774 1.00 0.09 A -ATOM 2002 CA ILE A 150 52.468 38.014 15.396 1.00 0.09 A -ATOM 2003 C ILE A 150 52.210 37.832 16.902 1.00 0.08 A -ATOM 2004 O ILE A 150 51.965 38.778 17.624 1.00 0.08 A -ATOM 2005 CB ILE A 150 53.556 39.060 15.182 1.00 0.09 A -ATOM 2006 CG1 ILE A 150 53.688 39.309 13.671 1.00 0.10 A -ATOM 2007 CG2 ILE A 150 54.891 38.628 15.810 1.00 0.09 A -ATOM 2008 CD1 ILE A 150 54.722 40.399 13.371 1.00 0.11 A -ATOM 2009 H ILE A 150 50.898 39.358 14.974 1.00 0.09 A -ATOM 2010 HA ILE A 150 52.779 37.081 14.952 1.00 0.09 A -ATOM 2011 HB ILE A 150 53.249 39.978 15.661 1.00 0.09 A -ATOM 2012 1HG1 ILE A 150 53.980 38.396 13.181 1.00 0.10 A -ATOM 2013 2HG1 ILE A 150 52.727 39.626 13.287 1.00 0.10 A -ATOM 2014 1HG2 ILE A 150 55.175 37.655 15.444 1.00 0.09 A -ATOM 2015 2HG2 ILE A 150 54.785 38.591 16.886 1.00 0.09 A -ATOM 2016 3HG2 ILE A 150 55.658 39.348 15.557 1.00 0.10 A -ATOM 2017 1HD1 ILE A 150 54.778 40.551 12.301 1.00 0.11 A -ATOM 2018 2HD1 ILE A 150 55.688 40.094 13.740 1.00 0.11 A -ATOM 2019 3HD1 ILE A 150 54.427 41.322 13.847 1.00 0.11 A -ATOM 2020 N LYS A 151 52.260 36.604 17.342 1.00 0.08 A -ATOM 2021 CA LYS A 151 52.029 36.215 18.723 1.00 0.07 A -ATOM 2022 C LYS A 151 53.252 36.322 19.582 1.00 0.07 A -ATOM 2023 O LYS A 151 54.316 35.829 19.253 1.00 0.08 A -ATOM 2024 CB LYS A 151 51.425 34.806 18.827 1.00 0.07 A -ATOM 2025 CG LYS A 151 50.160 34.638 17.970 1.00 0.08 A -ATOM 2026 CD LYS A 151 49.438 33.319 18.349 1.00 0.08 A -ATOM 2027 CE LYS A 151 48.354 32.961 17.303 1.00 0.09 A -ATOM 2028 NZ LYS A 151 48.243 31.478 17.148 1.00 0.09 A -ATOM 2029 H LYS A 151 52.460 35.892 16.702 1.00 0.08 A -ATOM 2030 HA LYS A 151 51.350 36.921 19.176 1.00 0.07 A -ATOM 2031 1HB LYS A 151 52.162 34.088 18.502 1.00 0.08 A -ATOM 2032 2HB LYS A 151 51.179 34.610 19.860 1.00 0.07 A -ATOM 2033 1HG LYS A 151 49.497 35.471 18.137 1.00 0.07 A -ATOM 2034 2HG LYS A 151 50.442 34.601 16.931 1.00 0.08 A -ATOM 2035 1HD LYS A 151 50.156 32.518 18.409 1.00 0.08 A -ATOM 2036 2HD LYS A 151 48.965 33.445 19.315 1.00 0.08 A -ATOM 2037 1HE LYS A 151 47.401 33.349 17.625 1.00 0.09 A -ATOM 2038 2HE LYS A 151 48.608 33.392 16.349 1.00 0.09 A -ATOM 2039 1HZ LYS A 151 47.291 31.240 16.800 1.00 0.10 A -ATOM 2040 2HZ LYS A 151 48.404 31.014 18.064 1.00 0.09 A -ATOM 2041 3HZ LYS A 151 48.949 31.146 16.460 1.00 0.10 A -ATOM 2042 N LEU A 152 53.085 36.989 20.730 1.00 0.07 A -ATOM 2043 CA LEU A 152 54.188 37.156 21.603 1.00 0.07 A -ATOM 2044 C LEU A 152 54.241 36.105 22.653 1.00 0.07 A -ATOM 2045 O LEU A 152 53.429 35.204 22.721 1.00 0.07 A -ATOM 2046 CB LEU A 152 54.404 38.574 22.119 1.00 0.07 A -ATOM 2047 CG LEU A 152 54.400 39.558 20.974 1.00 0.08 A -ATOM 2048 CD1 LEU A 152 54.413 40.975 21.550 1.00 0.08 A -ATOM 2049 CD2 LEU A 152 55.651 39.314 20.125 1.00 0.08 A -ATOM 2050 H LEU A 152 52.208 37.362 20.961 1.00 0.06 A -ATOM 2051 HA LEU A 152 55.079 36.854 21.076 1.00 0.08 A -ATOM 2052 1HB LEU A 152 53.612 38.822 22.810 1.00 0.07 A -ATOM 2053 2HB LEU A 152 55.351 38.624 22.634 1.00 0.08 A -ATOM 2054 HG LEU A 152 53.511 39.415 20.376 1.00 0.07 A -ATOM 2055 1HD1 LEU A 152 54.266 41.690 20.757 1.00 0.08 A -ATOM 2056 2HD1 LEU A 152 55.362 41.159 22.032 1.00 0.08 A -ATOM 2057 3HD1 LEU A 152 53.618 41.077 22.277 1.00 0.07 A -ATOM 2058 1HD2 LEU A 152 55.544 38.387 19.584 1.00 0.08 A -ATOM 2059 2HD2 LEU A 152 56.518 39.257 20.767 1.00 0.09 A -ATOM 2060 3HD2 LEU A 152 55.776 40.120 19.426 1.00 0.09 A -ATOM 2061 N SER A 153 55.289 36.184 23.411 1.00 0.08 A -ATOM 2062 CA SER A 153 55.585 35.175 24.419 1.00 0.08 A -ATOM 2063 C SER A 153 55.921 35.736 25.815 1.00 0.09 A -ATOM 2064 O SER A 153 56.357 36.865 25.956 1.00 0.09 A -ATOM 2065 CB SER A 153 56.882 34.538 23.944 1.00 0.09 A -ATOM 2066 OG SER A 153 56.605 33.262 23.391 1.00 0.09 A -ATOM 2067 H SER A 153 55.904 36.940 23.305 1.00 0.08 A -ATOM 2068 HA SER A 153 54.795 34.441 24.469 1.00 0.08 A -ATOM 2069 1HB SER A 153 57.341 35.153 23.186 1.00 0.09 A -ATOM 2070 2HB SER A 153 57.582 34.423 24.768 1.00 0.10 A -ATOM 2071 HG SER A 153 56.013 33.384 22.649 1.00 0.09 A -ATOM 2072 N GLY A 154 55.803 34.890 26.850 1.00 0.09 A -ATOM 2073 CA GLY A 154 56.217 35.305 28.186 1.00 0.09 A -ATOM 2074 C GLY A 154 55.149 35.758 29.183 1.00 0.09 A -ATOM 2075 O GLY A 154 53.973 35.453 29.106 1.00 0.08 A -ATOM 2076 H GLY A 154 55.455 33.987 26.705 1.00 0.09 A -ATOM 2077 1HA GLY A 154 56.734 34.469 28.630 1.00 0.10 A -ATOM 2078 2HA GLY A 154 56.901 36.129 28.064 1.00 0.10 A -ATOM 2079 N SER A 155 55.657 36.509 30.152 1.00 0.10 A -ATOM 2080 CA SER A 155 54.883 37.062 31.250 1.00 0.10 A -ATOM 2081 C SER A 155 54.448 38.474 30.916 1.00 0.09 A -ATOM 2082 O SER A 155 55.174 39.219 30.291 1.00 0.09 A -ATOM 2083 CB SER A 155 55.730 37.023 32.509 1.00 0.11 A -ATOM 2084 OG SER A 155 56.849 36.179 32.280 1.00 0.11 A -ATOM 2085 H SER A 155 56.615 36.709 30.122 1.00 0.10 A -ATOM 2086 HA SER A 155 53.988 36.476 31.396 1.00 0.09 A -ATOM 2087 1HB SER A 155 56.084 38.013 32.757 1.00 0.11 A -ATOM 2088 2HB SER A 155 55.145 36.639 33.336 1.00 0.11 A -ATOM 2089 HG SER A 155 56.525 35.282 32.170 1.00 0.11 A -ATOM 2090 N VAL A 156 53.244 38.841 31.305 1.00 0.08 A -ATOM 2091 CA VAL A 156 52.757 40.152 30.971 1.00 0.08 A -ATOM 2092 C VAL A 156 52.195 40.793 32.155 1.00 0.08 A -ATOM 2093 O VAL A 156 51.825 40.167 33.132 1.00 0.08 A -ATOM 2094 CB VAL A 156 51.662 40.111 29.908 1.00 0.07 A -ATOM 2095 CG1 VAL A 156 52.306 39.681 28.564 1.00 0.07 A -ATOM 2096 CG2 VAL A 156 50.615 39.061 30.319 1.00 0.06 A -ATOM 2097 H VAL A 156 52.673 38.214 31.795 1.00 0.08 A -ATOM 2098 HA VAL A 156 53.580 40.744 30.600 1.00 0.08 A -ATOM 2099 HB VAL A 156 51.191 41.071 29.817 1.00 0.07 A -ATOM 2100 1HG1 VAL A 156 51.947 40.313 27.780 1.00 0.06 A -ATOM 2101 2HG1 VAL A 156 52.056 38.651 28.344 1.00 0.07 A -ATOM 2102 3HG1 VAL A 156 53.383 39.765 28.613 1.00 0.08 A -ATOM 2103 1HG2 VAL A 156 49.818 39.044 29.590 1.00 0.06 A -ATOM 2104 2HG2 VAL A 156 50.215 39.305 31.289 1.00 0.07 A -ATOM 2105 3HG2 VAL A 156 51.085 38.087 30.357 1.00 0.07 A -ATOM 2106 N THR A 157 52.128 42.060 32.043 1.00 0.08 A -ATOM 2107 CA THR A 157 51.621 42.854 33.086 1.00 0.09 A -ATOM 2108 C THR A 157 50.437 43.677 32.535 1.00 0.08 A -ATOM 2109 O THR A 157 50.551 44.402 31.568 1.00 0.08 A -ATOM 2110 CB THR A 157 52.814 43.687 33.679 1.00 0.10 A -ATOM 2111 OG1 THR A 157 53.704 42.823 34.376 1.00 0.11 A -ATOM 2112 CG2 THR A 157 52.306 44.782 34.617 1.00 0.10 A -ATOM 2113 H THR A 157 52.444 42.484 31.218 1.00 0.08 A -ATOM 2114 HA THR A 157 51.195 42.225 33.852 1.00 0.09 A -ATOM 2115 HB THR A 157 53.349 44.155 32.865 1.00 0.10 A -ATOM 2116 HG1 THR A 157 54.306 42.435 33.733 1.00 0.11 A -ATOM 2117 1HG2 THR A 157 51.697 45.478 34.059 1.00 0.10 A -ATOM 2118 2HG2 THR A 157 53.150 45.306 35.042 1.00 0.11 A -ATOM 2119 3HG2 THR A 157 51.721 44.342 35.408 1.00 0.10 A -ATOM 2120 N VAL A 158 49.287 43.519 33.190 1.00 0.08 A -ATOM 2121 CA VAL A 158 48.065 44.213 32.842 1.00 0.07 A -ATOM 2122 C VAL A 158 48.280 45.658 32.379 1.00 0.08 A -ATOM 2123 O VAL A 158 48.818 46.512 33.059 1.00 0.08 A -ATOM 2124 CB VAL A 158 47.008 44.118 33.989 1.00 0.07 A -ATOM 2125 CG1 VAL A 158 47.440 44.858 35.261 1.00 0.08 A -ATOM 2126 CG2 VAL A 158 45.663 44.681 33.534 1.00 0.06 A -ATOM 2127 H VAL A 158 49.271 42.917 33.962 1.00 0.08 A -ATOM 2128 HA VAL A 158 47.653 43.771 31.947 1.00 0.06 A -ATOM 2129 HB VAL A 158 46.872 43.074 34.234 1.00 0.07 A -ATOM 2130 1HG1 VAL A 158 47.578 45.905 35.048 1.00 0.08 A -ATOM 2131 2HG1 VAL A 158 48.360 44.437 35.635 1.00 0.08 A -ATOM 2132 3HG1 VAL A 158 46.666 44.745 36.013 1.00 0.08 A -ATOM 2133 1HG2 VAL A 158 45.734 45.752 33.431 1.00 0.07 A -ATOM 2134 2HG2 VAL A 158 44.913 44.441 34.276 1.00 0.06 A -ATOM 2135 3HG2 VAL A 158 45.386 44.240 32.589 1.00 0.06 A -ATOM 2136 N GLY A 159 47.774 45.894 31.171 1.00 0.07 A -ATOM 2137 CA GLY A 159 47.775 47.199 30.555 1.00 0.08 A -ATOM 2138 C GLY A 159 49.132 47.767 30.333 1.00 0.09 A -ATOM 2139 O GLY A 159 49.292 48.974 30.246 1.00 0.10 A -ATOM 2140 H GLY A 159 47.348 45.154 30.690 1.00 0.06 A -ATOM 2141 1HA GLY A 159 47.295 47.113 29.591 1.00 0.07 A -ATOM 2142 2HA GLY A 159 47.206 47.865 31.184 1.00 0.08 A -ATOM 2143 N GLU A 160 50.102 46.930 30.208 1.00 0.09 A -ATOM 2144 CA GLU A 160 51.429 47.415 29.968 1.00 0.10 A -ATOM 2145 C GLU A 160 52.148 46.603 28.893 1.00 0.09 A -ATOM 2146 O GLU A 160 52.697 47.132 27.949 1.00 0.10 A -ATOM 2147 CB GLU A 160 52.248 47.340 31.282 1.00 0.10 A -ATOM 2148 CG GLU A 160 53.327 48.453 31.361 1.00 0.12 A -ATOM 2149 CD GLU A 160 52.979 49.457 32.467 1.00 0.12 A -ATOM 2150 OE1 GLU A 160 53.191 49.135 33.627 1.00 0.13 A -ATOM 2151 OE2 GLU A 160 52.500 50.530 32.126 1.00 0.13 A -ATOM 2152 H GLU A 160 49.925 45.968 30.268 1.00 0.08 A -ATOM 2153 HA GLU A 160 51.383 48.439 29.628 1.00 0.10 A -ATOM 2154 1HB GLU A 160 51.566 47.432 32.116 1.00 0.10 A -ATOM 2155 2HB GLU A 160 52.731 46.372 31.344 1.00 0.10 A -ATOM 2156 1HG GLU A 160 54.285 48.006 31.585 1.00 0.12 A -ATOM 2157 2HG GLU A 160 53.395 48.977 30.423 1.00 0.12 A -ATOM 2158 N THR A 161 52.183 45.334 29.072 1.00 0.09 A -ATOM 2159 CA THR A 161 52.912 44.455 28.174 1.00 0.09 A -ATOM 2160 C THR A 161 52.121 44.024 26.943 1.00 0.08 A -ATOM 2161 O THR A 161 51.070 43.422 27.059 1.00 0.07 A -ATOM 2162 CB THR A 161 53.310 43.175 28.940 1.00 0.08 A -ATOM 2163 OG1 THR A 161 53.855 43.524 30.205 1.00 0.09 A -ATOM 2164 CG2 THR A 161 54.362 42.425 28.121 1.00 0.09 A -ATOM 2165 H THR A 161 51.729 44.949 29.849 1.00 0.08 A -ATOM 2166 HA THR A 161 53.800 44.957 27.819 1.00 0.09 A -ATOM 2167 HB THR A 161 52.453 42.561 29.072 1.00 0.08 A -ATOM 2168 HG1 THR A 161 53.956 44.478 30.232 1.00 0.10 A -ATOM 2169 1HG2 THR A 161 53.906 42.035 27.223 1.00 0.08 A -ATOM 2170 2HG2 THR A 161 54.765 41.614 28.705 1.00 0.09 A -ATOM 2171 3HG2 THR A 161 55.160 43.102 27.853 1.00 0.09 A -ATOM 2172 N PRO A 162 52.667 44.304 25.759 1.00 0.08 A -ATOM 2173 CA PRO A 162 52.054 43.911 24.481 1.00 0.08 A -ATOM 2174 C PRO A 162 51.973 42.376 24.394 1.00 0.07 A -ATOM 2175 O PRO A 162 52.879 41.690 24.826 1.00 0.07 A -ATOM 2176 CB PRO A 162 52.967 44.464 23.369 1.00 0.08 A -ATOM 2177 CG PRO A 162 54.053 45.268 24.027 1.00 0.09 A -ATOM 2178 CD PRO A 162 53.914 45.097 25.539 1.00 0.09 A -ATOM 2179 HA PRO A 162 51.064 44.334 24.397 1.00 0.07 A -ATOM 2180 1HB PRO A 162 53.402 43.650 22.797 1.00 0.08 A -ATOM 2181 2HB PRO A 162 52.390 45.096 22.709 1.00 0.09 A -ATOM 2182 1HG PRO A 162 55.029 44.913 23.706 1.00 0.10 A -ATOM 2183 2HG PRO A 162 53.954 46.317 23.768 1.00 0.10 A -ATOM 2184 1HD PRO A 162 54.778 44.578 25.936 1.00 0.09 A -ATOM 2185 2HD PRO A 162 53.813 46.075 26.003 1.00 0.10 A -ATOM 2186 N VAL A 163 50.898 41.839 23.845 1.00 0.06 A -ATOM 2187 CA VAL A 163 50.741 40.376 23.721 1.00 0.06 A -ATOM 2188 C VAL A 163 50.675 39.921 22.255 1.00 0.06 A -ATOM 2189 O VAL A 163 51.040 38.807 21.920 1.00 0.06 A -ATOM 2190 CB VAL A 163 49.513 39.870 24.450 1.00 0.05 A -ATOM 2191 CG1 VAL A 163 49.604 40.237 25.923 1.00 0.05 A -ATOM 2192 CG2 VAL A 163 48.247 40.480 23.839 1.00 0.05 A -ATOM 2193 H VAL A 163 50.183 42.421 23.515 1.00 0.06 A -ATOM 2194 HA VAL A 163 51.615 39.895 24.137 1.00 0.06 A -ATOM 2195 HB VAL A 163 49.465 38.795 24.356 1.00 0.05 A -ATOM 2196 1HG1 VAL A 163 49.658 41.309 26.028 1.00 0.05 A -ATOM 2197 2HG1 VAL A 163 50.483 39.791 26.331 1.00 0.05 A -ATOM 2198 3HG1 VAL A 163 48.738 39.863 26.444 1.00 0.04 A -ATOM 2199 1HG2 VAL A 163 48.333 41.556 23.821 1.00 0.05 A -ATOM 2200 2HG2 VAL A 163 47.389 40.198 24.433 1.00 0.04 A -ATOM 2201 3HG2 VAL A 163 48.118 40.113 22.833 1.00 0.05 A -ATOM 2202 N ILE A 164 50.212 40.773 21.405 1.00 0.06 A -ATOM 2203 CA ILE A 164 50.093 40.513 19.989 1.00 0.07 A -ATOM 2204 C ILE A 164 50.470 41.796 19.222 1.00 0.07 A -ATOM 2205 O ILE A 164 50.278 42.899 19.692 1.00 0.08 A -ATOM 2206 CB ILE A 164 48.668 40.084 19.615 1.00 0.06 A -ATOM 2207 CG1 ILE A 164 48.288 38.723 20.251 1.00 0.06 A -ATOM 2208 CG2 ILE A 164 48.507 39.982 18.100 1.00 0.07 A -ATOM 2209 CD1 ILE A 164 46.759 38.615 20.451 1.00 0.06 A -ATOM 2210 H ILE A 164 49.933 41.651 21.742 1.00 0.06 A -ATOM 2211 HA ILE A 164 50.779 39.724 19.718 1.00 0.07 A -ATOM 2212 HB ILE A 164 47.984 40.836 19.969 1.00 0.06 A -ATOM 2213 1HG1 ILE A 164 48.612 37.922 19.604 1.00 0.06 A -ATOM 2214 2HG1 ILE A 164 48.771 38.621 21.202 1.00 0.06 A -ATOM 2215 1HG2 ILE A 164 47.541 39.549 17.877 1.00 0.07 A -ATOM 2216 2HG2 ILE A 164 49.283 39.353 17.695 1.00 0.07 A -ATOM 2217 3HG2 ILE A 164 48.568 40.966 17.663 1.00 0.08 A -ATOM 2218 1HD1 ILE A 164 46.245 39.038 19.600 1.00 0.06 A -ATOM 2219 2HD1 ILE A 164 46.470 39.149 21.345 1.00 0.05 A -ATOM 2220 3HD1 ILE A 164 46.484 37.574 20.555 1.00 0.06 A -ATOM 2221 N ARG A 165 50.980 41.619 18.033 1.00 0.08 A -ATOM 2222 CA ARG A 165 51.338 42.683 17.127 1.00 0.09 A -ATOM 2223 C ARG A 165 50.615 42.385 15.841 1.00 0.09 A -ATOM 2224 O ARG A 165 50.642 41.263 15.363 1.00 0.09 A -ATOM 2225 CB ARG A 165 52.843 42.705 16.939 1.00 0.09 A -ATOM 2226 CG ARG A 165 53.457 43.926 17.644 1.00 0.10 A -ATOM 2227 CD ARG A 165 54.977 43.775 17.826 1.00 0.10 A -ATOM 2228 NE ARG A 165 55.430 44.678 18.923 1.00 0.10 A -ATOM 2229 CZ ARG A 165 56.251 44.285 19.856 1.00 0.10 A -ATOM 2230 NH1 ARG A 165 56.703 43.062 19.885 1.00 0.10 A -ATOM 2231 NH2 ARG A 165 56.599 45.114 20.801 1.00 0.11 A -ATOM 2232 H ARG A 165 51.111 40.700 17.722 1.00 0.08 A -ATOM 2233 HA ARG A 165 51.013 43.629 17.538 1.00 0.09 A -ATOM 2234 1HB ARG A 165 53.260 41.799 17.353 1.00 0.09 A -ATOM 2235 2HB ARG A 165 53.084 42.754 15.884 1.00 0.10 A -ATOM 2236 1HG ARG A 165 53.255 44.809 17.062 1.00 0.10 A -ATOM 2237 2HG ARG A 165 53.005 44.031 18.619 1.00 0.09 A -ATOM 2238 1HD ARG A 165 55.203 42.719 18.041 1.00 0.10 A -ATOM 2239 2HD ARG A 165 55.489 44.106 16.950 1.00 0.11 A -ATOM 2240 1HH1 ARG A 165 56.434 42.408 19.184 1.00 0.10 A -ATOM 2241 2HH1 ARG A 165 57.306 42.776 20.630 1.00 0.10 A -ATOM 2242 1HH2 ARG A 165 56.245 46.048 20.804 1.00 0.11 A -ATOM 2243 2HH2 ARG A 165 57.204 44.806 21.536 1.00 0.11 A -ATOM 2244 N ILE A 166 49.937 43.347 15.290 1.00 0.10 A -ATOM 2245 CA ILE A 166 49.193 43.076 14.070 1.00 0.11 A -ATOM 2246 C ILE A 166 49.545 44.092 13.025 1.00 0.12 A -ATOM 2247 O ILE A 166 49.914 45.199 13.332 1.00 0.12 A -ATOM 2248 CB ILE A 166 47.658 43.137 14.227 1.00 0.11 A -ATOM 2249 CG1 ILE A 166 47.271 44.427 14.763 1.00 0.11 A -ATOM 2250 CG2 ILE A 166 47.108 42.037 15.148 1.00 0.10 A -ATOM 2251 CD1 ILE A 166 45.762 44.553 14.734 1.00 0.11 A -ATOM 2252 H ILE A 166 49.915 44.234 15.707 1.00 0.10 A -ATOM 2253 HA ILE A 166 49.458 42.088 13.727 1.00 0.10 A -ATOM 2254 HB ILE A 166 47.207 43.007 13.252 1.00 0.11 A -ATOM 2255 1HG1 ILE A 166 47.632 44.502 15.778 1.00 0.10 A -ATOM 2256 2HG1 ILE A 166 47.704 45.181 14.156 1.00 0.11 A -ATOM 2257 1HG2 ILE A 166 46.036 41.962 14.990 1.00 0.10 A -ATOM 2258 2HG2 ILE A 166 47.293 42.295 16.181 1.00 0.09 A -ATOM 2259 3HG2 ILE A 166 47.569 41.094 14.916 1.00 0.10 A -ATOM 2260 1HD1 ILE A 166 45.441 44.642 13.702 1.00 0.12 A -ATOM 2261 2HD1 ILE A 166 45.474 45.419 15.288 1.00 0.11 A -ATOM 2262 3HD1 ILE A 166 45.297 43.698 15.177 1.00 0.10 A -ATOM 2263 N LYS A 167 49.368 43.722 11.796 1.00 0.12 A -ATOM 2264 CA LYS A 167 49.594 44.620 10.682 1.00 0.13 A -ATOM 2265 C LYS A 167 48.302 44.763 9.890 1.00 0.14 A -ATOM 2266 O LYS A 167 47.442 43.904 9.923 1.00 0.14 A -ATOM 2267 CB LYS A 167 50.776 44.251 9.778 1.00 0.14 A -ATOM 2268 CG LYS A 167 51.482 45.521 9.247 1.00 0.15 A -ATOM 2269 CD LYS A 167 52.981 45.240 8.945 1.00 0.15 A -ATOM 2270 CE LYS A 167 53.361 45.731 7.539 1.00 0.16 A -ATOM 2271 NZ LYS A 167 54.487 44.919 7.009 1.00 0.16 A -ATOM 2272 H LYS A 167 49.056 42.811 11.616 1.00 0.12 A -ATOM 2273 HA LYS A 167 49.774 45.608 11.080 1.00 0.13 A -ATOM 2274 1HB LYS A 167 51.473 43.658 10.352 1.00 0.13 A -ATOM 2275 2HB LYS A 167 50.421 43.665 8.942 1.00 0.14 A -ATOM 2276 1HG LYS A 167 50.972 45.848 8.358 1.00 0.15 A -ATOM 2277 2HG LYS A 167 51.422 46.309 9.984 1.00 0.14 A -ATOM 2278 1HD LYS A 167 53.589 45.765 9.674 1.00 0.15 A -ATOM 2279 2HD LYS A 167 53.189 44.184 9.017 1.00 0.14 A -ATOM 2280 1HE LYS A 167 52.521 45.628 6.871 1.00 0.16 A -ATOM 2281 2HE LYS A 167 53.659 46.767 7.588 1.00 0.16 A -ATOM 2282 1HZ LYS A 167 54.203 43.920 6.965 1.00 0.15 A -ATOM 2283 2HZ LYS A 167 55.313 45.022 7.631 1.00 0.16 A -ATOM 2284 3HZ LYS A 167 54.726 45.251 6.054 1.00 0.17 A -ATOM 2285 N LYS A 168 48.170 45.888 9.208 1.00 0.15 A -ATOM 2286 CA LYS A 168 46.969 46.212 8.440 1.00 0.16 A -ATOM 2287 C LYS A 168 45.738 45.676 9.191 1.00 0.15 A -ATOM 2288 CB LYS A 168 47.014 45.719 6.995 1.00 0.16 A -ATOM 2289 CG LYS A 168 45.594 45.584 6.346 1.00 0.17 A -ATOM 2290 CD LYS A 168 45.496 44.324 5.461 1.00 0.17 A -ATOM 2291 CE LYS A 168 44.107 44.222 4.824 1.00 0.18 A -ATOM 2292 NZ LYS A 168 43.803 42.803 4.459 1.00 0.18 A -ATOM 2293 H LYS A 168 48.906 46.534 9.217 1.00 0.15 A -ATOM 2294 HA LYS A 168 46.848 47.285 8.429 1.00 0.16 A -ATOM 2295 1HB LYS A 168 47.599 46.418 6.411 1.00 0.17 A -ATOM 2296 2HB LYS A 168 47.504 44.798 6.994 1.00 0.16 A -ATOM 2297 1HG LYS A 168 44.838 45.524 7.099 1.00 0.17 A -ATOM 2298 2HG LYS A 168 45.407 46.453 5.734 1.00 0.18 A -ATOM 2299 1HD LYS A 168 46.247 44.369 4.688 1.00 0.18 A -ATOM 2300 2HD LYS A 168 45.648 43.453 6.070 1.00 0.17 A -ATOM 2301 1HE LYS A 168 43.366 44.568 5.526 1.00 0.18 A -ATOM 2302 2HE LYS A 168 44.077 44.831 3.936 1.00 0.19 A -ATOM 2303 1HZ LYS A 168 42.829 42.575 4.745 1.00 0.18 A -ATOM 2304 2HZ LYS A 168 44.465 42.162 4.944 1.00 0.17 A -ATOM 2305 3HZ LYS A 168 43.894 42.682 3.430 1.00 0.19 A -TER 2306 LYS A 168 -ATOM 2307 N MET B 1 13.639 37.821 -0.846 1.00 0.21 B -ATOM 2308 CA MET B 1 14.123 37.656 0.530 1.00 0.20 B -ATOM 2309 C MET B 1 13.201 36.682 1.252 1.00 0.19 B -ATOM 2310 O MET B 1 12.049 36.500 0.900 1.00 0.19 B -ATOM 2311 CB MET B 1 14.116 39.022 1.227 1.00 0.20 B -ATOM 2312 CG MET B 1 13.755 38.872 2.711 1.00 0.18 B -ATOM 2313 SD MET B 1 13.906 40.480 3.509 1.00 0.19 B -ATOM 2314 CE MET B 1 15.668 40.712 3.151 1.00 0.19 B -ATOM 2315 HA MET B 1 15.128 37.258 0.518 1.00 0.19 B -ATOM 2316 1HB MET B 1 15.069 39.449 1.136 1.00 0.20 B -ATOM 2317 2HB MET B 1 13.398 39.668 0.750 1.00 0.21 B -ATOM 2318 1HG MET B 1 12.736 38.517 2.806 1.00 0.19 B -ATOM 2319 2HG MET B 1 14.429 38.167 3.178 1.00 0.17 B -ATOM 2320 1HE MET B 1 15.775 41.242 2.210 1.00 0.20 B -ATOM 2321 2HE MET B 1 16.153 39.748 3.076 1.00 0.18 B -ATOM 2322 3HE MET B 1 16.124 41.277 3.939 1.00 0.19 B -ATOM 2323 N PHE B 2 13.709 36.079 2.279 1.00 0.17 B -ATOM 2324 CA PHE B 2 12.907 35.138 3.066 1.00 0.17 B -ATOM 2325 C PHE B 2 13.306 35.323 4.540 1.00 0.15 B -ATOM 2326 O PHE B 2 14.460 35.552 4.851 1.00 0.15 B -ATOM 2327 CB PHE B 2 13.200 33.779 2.434 1.00 0.17 B -ATOM 2328 CG PHE B 2 12.433 32.720 3.155 1.00 0.16 B -ATOM 2329 CD1 PHE B 2 11.049 32.687 3.040 1.00 0.17 B -ATOM 2330 CD2 PHE B 2 13.098 31.779 3.926 1.00 0.16 B -ATOM 2331 CE1 PHE B 2 10.319 31.700 3.699 1.00 0.17 B -ATOM 2332 CE2 PHE B 2 12.381 30.780 4.586 1.00 0.16 B -ATOM 2333 CZ PHE B 2 10.989 30.741 4.471 1.00 0.16 B -ATOM 2334 H PHE B 2 14.640 36.251 2.541 1.00 0.17 B -ATOM 2335 HA PHE B 2 11.853 35.364 2.993 1.00 0.17 B -ATOM 2336 1HB PHE B 2 12.885 33.801 1.397 1.00 0.18 B -ATOM 2337 2HB PHE B 2 14.260 33.575 2.479 1.00 0.16 B -ATOM 2338 HD1 PHE B 2 10.543 33.426 2.439 1.00 0.18 B -ATOM 2339 HD2 PHE B 2 14.166 31.833 4.016 1.00 0.15 B -ATOM 2340 HE1 PHE B 2 9.242 31.675 3.614 1.00 0.18 B -ATOM 2341 HE2 PHE B 2 12.899 30.033 5.171 1.00 0.15 B -ATOM 2342 HZ PHE B 2 10.429 29.979 4.987 1.00 0.17 B -ATOM 2343 N GLN B 3 12.352 35.266 5.454 1.00 0.15 B -ATOM 2344 CA GLN B 3 12.674 35.459 6.891 1.00 0.14 B -ATOM 2345 C GLN B 3 11.679 34.676 7.745 1.00 0.14 B -ATOM 2346 O GLN B 3 10.579 34.357 7.327 1.00 0.15 B -ATOM 2347 CB GLN B 3 12.681 36.930 7.295 1.00 0.14 B -ATOM 2348 CG GLN B 3 11.407 37.762 7.085 1.00 0.16 B -ATOM 2349 CD GLN B 3 11.836 39.239 7.246 1.00 0.16 B -ATOM 2350 OE1 GLN B 3 11.476 39.903 8.199 1.00 0.16 B -ATOM 2351 NE2 GLN B 3 12.552 39.790 6.309 1.00 0.17 B -ATOM 2352 H GLN B 3 11.426 35.086 5.193 1.00 0.16 B -ATOM 2353 HA GLN B 3 13.676 35.072 7.066 1.00 0.13 B -ATOM 2354 1HB GLN B 3 12.922 36.978 8.339 1.00 0.13 B -ATOM 2355 2HB GLN B 3 13.464 37.394 6.747 1.00 0.14 B -ATOM 2356 1HG GLN B 3 11.006 37.596 6.101 1.00 0.16 B -ATOM 2357 2HG GLN B 3 10.683 37.521 7.841 1.00 0.15 B -ATOM 2358 1HE2 GLN B 3 12.736 39.297 5.488 1.00 0.17 B -ATOM 2359 2HE2 GLN B 3 13.019 40.629 6.484 1.00 0.17 B -ATOM 2360 N GLN B 4 12.076 34.372 8.937 1.00 0.13 B -ATOM 2361 CA GLN B 4 11.223 33.607 9.889 1.00 0.13 B -ATOM 2362 C GLN B 4 11.665 34.006 11.311 1.00 0.12 B -ATOM 2363 O GLN B 4 12.827 34.277 11.539 1.00 0.11 B -ATOM 2364 CB GLN B 4 11.427 32.077 9.744 1.00 0.13 B -ATOM 2365 CG GLN B 4 10.982 31.455 8.393 1.00 0.14 B -ATOM 2366 CD GLN B 4 9.480 31.254 8.482 1.00 0.15 B -ATOM 2367 OE1 GLN B 4 9.028 30.209 8.927 1.00 0.16 B -ATOM 2368 NE2 GLN B 4 8.689 32.120 7.931 1.00 0.16 B -ATOM 2369 H GLN B 4 12.962 34.659 9.228 1.00 0.12 B -ATOM 2370 HA GLN B 4 10.190 33.859 9.746 1.00 0.14 B -ATOM 2371 1HB GLN B 4 12.467 31.876 9.869 1.00 0.12 B -ATOM 2372 2HB GLN B 4 10.883 31.593 10.547 1.00 0.13 B -ATOM 2373 1HG GLN B 4 11.235 32.108 7.577 1.00 0.14 B -ATOM 2374 2HG GLN B 4 11.472 30.496 8.267 1.00 0.14 B -ATOM 2375 1HE2 GLN B 4 9.047 32.789 7.337 1.00 0.16 B -ATOM 2376 2HE2 GLN B 4 7.826 32.268 8.315 1.00 0.16 B -ATOM 2377 N GLU B 5 10.758 34.025 12.256 1.00 0.13 B -ATOM 2378 CA GLU B 5 11.095 34.358 13.653 1.00 0.12 B -ATOM 2379 C GLU B 5 11.365 33.050 14.409 1.00 0.12 B -ATOM 2380 O GLU B 5 10.768 32.028 14.115 1.00 0.13 B -ATOM 2381 CB GLU B 5 9.874 34.978 14.380 1.00 0.14 B -ATOM 2382 CG GLU B 5 9.987 36.511 14.541 1.00 0.14 B -ATOM 2383 CD GLU B 5 8.615 37.199 14.486 1.00 0.15 B -ATOM 2384 OE1 GLU B 5 7.900 37.012 13.513 1.00 0.16 B -ATOM 2385 OE2 GLU B 5 8.314 37.926 15.424 1.00 0.16 B -ATOM 2386 H GLU B 5 9.839 33.803 12.038 1.00 0.14 B -ATOM 2387 HA GLU B 5 11.926 35.038 13.673 1.00 0.12 B -ATOM 2388 1HB GLU B 5 8.987 34.746 13.815 1.00 0.14 B -ATOM 2389 2HB GLU B 5 9.776 34.536 15.369 1.00 0.14 B -ATOM 2390 1HG GLU B 5 10.415 36.723 15.494 1.00 0.14 B -ATOM 2391 2HG GLU B 5 10.616 36.916 13.775 1.00 0.14 B -ATOM 2392 N VAL B 6 12.181 33.091 15.425 1.00 0.12 B -ATOM 2393 CA VAL B 6 12.393 31.890 16.260 1.00 0.12 B -ATOM 2394 C VAL B 6 12.712 32.372 17.683 1.00 0.13 B -ATOM 2395 O VAL B 6 13.353 33.391 17.872 1.00 0.12 B -ATOM 2396 CB VAL B 6 13.500 30.972 15.693 1.00 0.12 B -ATOM 2397 CG1 VAL B 6 14.831 31.704 15.578 1.00 0.10 B -ATOM 2398 CG2 VAL B 6 13.694 29.733 16.589 1.00 0.13 B -ATOM 2399 H VAL B 6 12.626 33.929 15.660 1.00 0.11 B -ATOM 2400 HA VAL B 6 11.468 31.331 16.295 1.00 0.13 B -ATOM 2401 HB VAL B 6 13.202 30.641 14.709 1.00 0.12 B -ATOM 2402 1HG1 VAL B 6 14.693 32.622 15.030 1.00 0.10 B -ATOM 2403 2HG1 VAL B 6 15.534 31.072 15.051 1.00 0.10 B -ATOM 2404 3HG1 VAL B 6 15.212 31.919 16.564 1.00 0.11 B -ATOM 2405 1HG2 VAL B 6 14.070 30.036 17.555 1.00 0.13 B -ATOM 2406 2HG2 VAL B 6 14.404 29.063 16.123 1.00 0.13 B -ATOM 2407 3HG2 VAL B 6 12.751 29.222 16.712 1.00 0.14 B -ATOM 2408 N THR B 7 12.254 31.650 18.679 1.00 0.14 B -ATOM 2409 CA THR B 7 12.522 32.005 20.094 1.00 0.14 B -ATOM 2410 C THR B 7 13.772 31.253 20.603 1.00 0.14 B -ATOM 2411 O THR B 7 13.934 30.061 20.388 1.00 0.15 B -ATOM 2412 CB THR B 7 11.352 31.602 20.995 1.00 0.16 B -ATOM 2413 OG1 THR B 7 10.195 32.281 20.512 1.00 0.16 B -ATOM 2414 CG2 THR B 7 11.634 32.021 22.451 1.00 0.17 B -ATOM 2415 H THR B 7 11.736 30.852 18.488 1.00 0.14 B -ATOM 2416 HA THR B 7 12.661 33.066 20.166 1.00 0.14 B -ATOM 2417 HB THR B 7 11.195 30.533 20.944 1.00 0.16 B -ATOM 2418 HG1 THR B 7 9.859 32.844 21.213 1.00 0.17 B -ATOM 2419 1HG2 THR B 7 11.964 33.049 22.474 1.00 0.16 B -ATOM 2420 2HG2 THR B 7 12.406 31.389 22.872 1.00 0.17 B -ATOM 2421 3HG2 THR B 7 10.732 31.921 23.039 1.00 0.18 B -ATOM 2422 N ILE B 8 14.612 31.953 21.315 1.00 0.14 B -ATOM 2423 CA ILE B 8 15.832 31.383 21.916 1.00 0.14 B -ATOM 2424 C ILE B 8 15.367 30.802 23.254 1.00 0.16 B -ATOM 2425 O ILE B 8 14.911 31.511 24.138 1.00 0.16 B -ATOM 2426 CB ILE B 8 16.933 32.467 22.134 1.00 0.14 B -ATOM 2427 CG1 ILE B 8 17.465 32.868 20.746 1.00 0.12 B -ATOM 2428 CG2 ILE B 8 18.059 31.908 23.010 1.00 0.14 B -ATOM 2429 CD1 ILE B 8 18.523 33.974 20.835 1.00 0.12 B -ATOM 2430 H ILE B 8 14.409 32.880 21.482 1.00 0.14 B -ATOM 2431 HA ILE B 8 16.219 30.613 21.257 1.00 0.14 B -ATOM 2432 HB ILE B 8 16.503 33.329 22.621 1.00 0.14 B -ATOM 2433 1HG1 ILE B 8 17.902 32.002 20.273 1.00 0.12 B -ATOM 2434 2HG1 ILE B 8 16.639 33.220 20.146 1.00 0.12 B -ATOM 2435 1HG2 ILE B 8 18.860 32.631 23.064 1.00 0.14 B -ATOM 2436 2HG2 ILE B 8 18.430 30.986 22.594 1.00 0.14 B -ATOM 2437 3HG2 ILE B 8 17.678 31.721 23.996 1.00 0.15 B -ATOM 2438 1HD1 ILE B 8 18.998 34.086 19.869 1.00 0.11 B -ATOM 2439 2HD1 ILE B 8 19.268 33.711 21.570 1.00 0.12 B -ATOM 2440 3HD1 ILE B 8 18.053 34.905 21.111 1.00 0.12 B -ATOM 2441 N THR B 9 15.440 29.516 23.363 1.00 0.17 B -ATOM 2442 CA THR B 9 14.993 28.768 24.601 1.00 0.18 B -ATOM 2443 C THR B 9 16.152 28.218 25.476 1.00 0.19 B -ATOM 2444 O THR B 9 15.887 27.673 26.531 1.00 0.21 B -ATOM 2445 CB THR B 9 14.055 27.572 24.219 1.00 0.19 B -ATOM 2446 OG1 THR B 9 14.754 26.720 23.298 1.00 0.19 B -ATOM 2447 CG2 THR B 9 12.748 28.127 23.633 1.00 0.19 B -ATOM 2448 H THR B 9 15.779 29.020 22.604 1.00 0.16 B -ATOM 2449 HA THR B 9 14.457 29.446 25.229 1.00 0.19 B -ATOM 2450 HB THR B 9 13.818 27.008 25.113 1.00 0.21 B -ATOM 2451 HG1 THR B 9 14.133 26.349 22.674 1.00 0.19 B -ATOM 2452 1HG2 THR B 9 12.345 28.867 24.315 1.00 0.19 B -ATOM 2453 2HG2 THR B 9 12.030 27.329 23.515 1.00 0.20 B -ATOM 2454 3HG2 THR B 9 12.941 28.589 22.678 1.00 0.18 B -ATOM 2455 N ALA B 10 17.396 28.348 25.084 1.00 0.18 B -ATOM 2456 CA ALA B 10 18.534 27.840 25.896 1.00 0.19 B -ATOM 2457 C ALA B 10 18.738 28.706 27.151 1.00 0.20 B -ATOM 2458 O ALA B 10 18.656 29.907 27.052 1.00 0.19 B -ATOM 2459 CB ALA B 10 19.777 27.935 25.015 1.00 0.18 B -ATOM 2460 H ALA B 10 17.586 28.787 24.237 1.00 0.17 B -ATOM 2461 HA ALA B 10 18.359 26.819 26.164 1.00 0.20 B -ATOM 2462 1HB ALA B 10 19.522 27.647 24.011 1.00 0.18 B -ATOM 2463 2HB ALA B 10 20.543 27.277 25.395 1.00 0.19 B -ATOM 2464 3HB ALA B 10 20.144 28.952 25.010 1.00 0.18 B -ATOM 2465 N PRO B 11 19.025 28.117 28.314 1.00 0.21 B -ATOM 2466 CA PRO B 11 19.258 28.881 29.580 1.00 0.22 B -ATOM 2467 C PRO B 11 20.163 30.070 29.501 1.00 0.21 B -ATOM 2468 O PRO B 11 19.811 31.108 30.043 1.00 0.22 B -ATOM 2469 CB PRO B 11 19.774 27.791 30.541 1.00 0.24 B -ATOM 2470 CG PRO B 11 19.132 26.521 30.048 1.00 0.24 B -ATOM 2471 CD PRO B 11 19.132 26.630 28.515 1.00 0.23 B -ATOM 2472 HA PRO B 11 18.338 29.263 29.943 1.00 0.23 B -ATOM 2473 1HB PRO B 11 20.853 27.711 30.481 1.00 0.24 B -ATOM 2474 2HB PRO B 11 19.467 27.996 31.555 1.00 0.25 B -ATOM 2475 1HG PRO B 11 19.689 25.658 30.378 1.00 0.25 B -ATOM 2476 2HG PRO B 11 18.112 26.469 30.406 1.00 0.25 B -ATOM 2477 1HD PRO B 11 20.060 26.249 28.109 1.00 0.23 B -ATOM 2478 2HD PRO B 11 18.282 26.121 28.108 1.00 0.23 B -ATOM 2479 N ASN B 12 21.283 30.019 28.867 1.00 0.21 B -ATOM 2480 CA ASN B 12 22.086 31.288 28.855 1.00 0.20 B -ATOM 2481 C ASN B 12 21.915 31.914 27.477 1.00 0.19 B -ATOM 2482 O ASN B 12 22.793 32.599 26.989 1.00 0.18 B -ATOM 2483 CB ASN B 12 23.556 30.981 29.187 1.00 0.21 B -ATOM 2484 CG ASN B 12 23.659 30.470 30.625 1.00 0.30 B -ATOM 2485 OD1 ASN B 12 22.751 30.650 31.413 1.00 1.08 B -ATOM 2486 ND2 ASN B 12 24.735 29.836 31.004 1.00 0.68 B -ATOM 2487 H ASN B 12 21.587 29.197 28.402 1.00 0.21 B -ATOM 2488 HA ASN B 12 21.696 31.988 29.598 1.00 0.21 B -ATOM 2489 1HB ASN B 12 23.928 30.227 28.508 1.00 0.26 B -ATOM 2490 2HB ASN B 12 24.144 31.881 29.083 1.00 0.25 B -ATOM 2491 1HD2 ASN B 12 25.467 29.691 30.369 1.00 1.34 B -ATOM 2492 2HD2 ASN B 12 24.811 29.504 31.923 1.00 0.66 B -ATOM 2493 N GLY B 13 20.778 31.687 26.819 1.00 0.18 B -ATOM 2494 CA GLY B 13 20.626 32.301 25.471 1.00 0.16 B -ATOM 2495 C GLY B 13 21.721 31.822 24.526 1.00 0.16 B -ATOM 2496 O GLY B 13 22.197 30.695 24.605 1.00 0.16 B -ATOM 2497 H GLY B 13 20.057 31.124 27.203 1.00 0.19 B -ATOM 2498 1HA GLY B 13 19.675 32.025 25.055 1.00 0.16 B -ATOM 2499 2HA GLY B 13 20.686 33.369 25.553 1.00 0.16 B -ATOM 2500 N LEU B 14 22.117 32.662 23.597 1.00 0.14 B -ATOM 2501 CA LEU B 14 23.141 32.209 22.632 1.00 0.14 B -ATOM 2502 C LEU B 14 24.516 32.470 23.213 1.00 0.15 B -ATOM 2503 O LEU B 14 25.190 33.391 22.800 1.00 0.14 B -ATOM 2504 CB LEU B 14 22.910 32.956 21.312 1.00 0.12 B -ATOM 2505 CG LEU B 14 23.721 32.365 20.155 1.00 0.12 B -ATOM 2506 CD1 LEU B 14 23.130 31.034 19.682 1.00 0.12 B -ATOM 2507 CD2 LEU B 14 23.675 33.366 18.999 1.00 0.11 B -ATOM 2508 H LEU B 14 21.722 33.566 23.530 1.00 0.14 B -ATOM 2509 HA LEU B 14 23.039 31.153 22.470 1.00 0.14 B -ATOM 2510 1HB LEU B 14 21.861 32.906 21.062 1.00 0.12 B -ATOM 2511 2HB LEU B 14 23.189 33.991 21.447 1.00 0.12 B -ATOM 2512 HG LEU B 14 24.732 32.210 20.465 1.00 0.13 B -ATOM 2513 1HD1 LEU B 14 22.069 31.143 19.532 1.00 0.12 B -ATOM 2514 2HD1 LEU B 14 23.315 30.268 20.417 1.00 0.13 B -ATOM 2515 3HD1 LEU B 14 23.596 30.749 18.750 1.00 0.12 B -ATOM 2516 1HD2 LEU B 14 22.652 33.685 18.845 1.00 0.10 B -ATOM 2517 2HD2 LEU B 14 24.045 32.903 18.098 1.00 0.11 B -ATOM 2518 3HD2 LEU B 14 24.283 34.224 19.243 1.00 0.11 B -ATOM 2519 N HIS B 15 24.940 31.677 24.190 1.00 0.16 B -ATOM 2520 CA HIS B 15 26.285 31.936 24.792 1.00 0.17 B -ATOM 2521 C HIS B 15 27.427 31.625 23.834 1.00 0.17 B -ATOM 2522 O HIS B 15 27.237 31.345 22.669 1.00 0.16 B -ATOM 2523 CB HIS B 15 26.427 31.192 26.135 1.00 0.18 B -ATOM 2524 CG HIS B 15 26.055 29.743 25.976 1.00 0.37 B -ATOM 2525 ND1 HIS B 15 27.006 28.735 25.967 1.00 0.57 B -ATOM 2526 CD2 HIS B 15 24.842 29.115 25.848 1.00 0.59 B -ATOM 2527 CE1 HIS B 15 26.356 27.565 25.840 1.00 0.79 B -ATOM 2528 NE2 HIS B 15 25.034 27.739 25.762 1.00 0.81 B -ATOM 2529 H HIS B 15 24.375 30.941 24.532 1.00 0.16 B -ATOM 2530 HA HIS B 15 26.378 32.991 24.969 1.00 0.17 B -ATOM 2531 1HB HIS B 15 27.449 31.261 26.475 1.00 0.30 B -ATOM 2532 2HB HIS B 15 25.777 31.650 26.866 1.00 0.29 B -ATOM 2533 HD2 HIS B 15 23.884 29.611 25.823 1.00 0.67 B -ATOM 2534 HE1 HIS B 15 26.843 26.602 25.805 1.00 0.98 B -ATOM 2535 N THR B 16 28.623 31.796 24.323 1.00 0.18 B -ATOM 2536 CA THR B 16 29.847 31.650 23.470 1.00 0.18 B -ATOM 2537 C THR B 16 29.988 30.408 22.588 1.00 0.18 B -ATOM 2538 O THR B 16 30.137 30.563 21.388 1.00 0.17 B -ATOM 2539 CB THR B 16 31.127 31.844 24.346 1.00 0.19 B -ATOM 2540 OG1 THR B 16 30.907 32.899 25.272 1.00 0.21 B -ATOM 2541 CG2 THR B 16 32.318 32.197 23.452 1.00 0.19 B -ATOM 2542 H THR B 16 28.718 32.099 25.256 1.00 0.18 B -ATOM 2543 HA THR B 16 29.815 32.423 22.743 1.00 0.17 B -ATOM 2544 HB THR B 16 31.339 30.931 24.882 1.00 0.21 B -ATOM 2545 HG1 THR B 16 30.625 32.510 26.103 1.00 0.92 B -ATOM 2546 1HG2 THR B 16 32.279 31.615 22.543 1.00 1.05 B -ATOM 2547 2HG2 THR B 16 33.233 31.978 23.975 1.00 1.01 B -ATOM 2548 3HG2 THR B 16 32.286 33.248 23.208 1.00 1.01 B -ATOM 2549 N ARG B 17 30.014 29.219 23.068 1.00 0.19 B -ATOM 2550 CA ARG B 17 30.233 28.107 22.095 1.00 0.19 B -ATOM 2551 C ARG B 17 29.093 27.973 21.065 1.00 0.18 B -ATOM 2552 O ARG B 17 29.372 27.809 19.894 1.00 0.18 B -ATOM 2553 CB ARG B 17 30.550 26.827 22.900 1.00 0.20 B -ATOM 2554 CG ARG B 17 30.285 25.575 22.050 1.00 0.33 B -ATOM 2555 CD ARG B 17 30.674 24.322 22.839 1.00 0.26 B -ATOM 2556 NE ARG B 17 32.034 24.494 23.422 1.00 0.71 B -ATOM 2557 CZ ARG B 17 32.439 23.695 24.372 1.00 0.68 B -ATOM 2558 NH1 ARG B 17 31.654 22.749 24.808 1.00 1.24 B -ATOM 2559 NH2 ARG B 17 33.630 23.843 24.884 1.00 1.12 B -ATOM 2560 H ARG B 17 29.931 29.045 24.033 1.00 0.19 B -ATOM 2561 HA ARG B 17 31.087 28.352 21.481 1.00 0.19 B -ATOM 2562 1HB ARG B 17 31.591 26.843 23.191 1.00 0.33 B -ATOM 2563 2HB ARG B 17 29.939 26.794 23.787 1.00 0.29 B -ATOM 2564 1HG ARG B 17 29.235 25.521 21.801 1.00 0.61 B -ATOM 2565 2HG ARG B 17 30.869 25.623 21.144 1.00 0.58 B -ATOM 2566 1HD ARG B 17 29.960 24.163 23.634 1.00 0.62 B -ATOM 2567 2HD ARG B 17 30.672 23.467 22.179 1.00 0.38 B -ATOM 2568 HE ARG B 17 32.622 25.204 23.094 1.00 1.44 B -ATOM 2569 1HH1 ARG B 17 30.741 22.636 24.416 1.00 1.48 B -ATOM 2570 2HH1 ARG B 17 31.964 22.137 25.536 1.00 1.73 B -ATOM 2571 1HH2 ARG B 17 34.231 24.567 24.549 1.00 1.66 B -ATOM 2572 2HH2 ARG B 17 33.941 23.231 25.612 1.00 1.25 B -ATOM 2573 N PRO B 18 27.850 28.042 21.427 1.00 0.17 B -ATOM 2574 CA PRO B 18 26.784 27.922 20.414 1.00 0.16 B -ATOM 2575 C PRO B 18 26.758 29.130 19.461 1.00 0.15 B -ATOM 2576 O PRO B 18 26.369 29.011 18.316 1.00 0.14 B -ATOM 2577 CB PRO B 18 25.517 27.772 21.274 1.00 0.16 B -ATOM 2578 CG PRO B 18 25.871 28.154 22.721 1.00 0.18 B -ATOM 2579 CD PRO B 18 27.406 28.206 22.842 1.00 0.18 B -ATOM 2580 HA PRO B 18 26.938 27.035 19.827 1.00 0.17 B -ATOM 2581 1HB PRO B 18 24.738 28.425 20.897 1.00 0.15 B -ATOM 2582 2HB PRO B 18 25.171 26.746 21.244 1.00 0.18 B -ATOM 2583 1HG PRO B 18 25.449 29.125 22.957 1.00 0.19 B -ATOM 2584 2HG PRO B 18 25.476 27.415 23.404 1.00 0.22 B -ATOM 2585 1HD PRO B 18 27.721 29.149 23.247 1.00 0.17 B -ATOM 2586 2HD PRO B 18 27.768 27.390 23.443 1.00 0.20 B -ATOM 2587 N ALA B 19 27.171 30.284 19.911 1.00 0.14 B -ATOM 2588 CA ALA B 19 27.165 31.484 18.997 1.00 0.13 B -ATOM 2589 C ALA B 19 28.248 31.292 17.915 1.00 0.14 B -ATOM 2590 O ALA B 19 28.065 31.651 16.766 1.00 0.13 B -ATOM 2591 CB ALA B 19 27.330 32.766 19.838 1.00 0.13 B -ATOM 2592 H ALA B 19 27.471 30.370 20.843 1.00 0.15 B -ATOM 2593 HA ALA B 19 26.230 31.529 18.468 1.00 0.12 B -ATOM 2594 1HB ALA B 19 26.901 33.604 19.309 1.00 0.13 B -ATOM 2595 2HB ALA B 19 28.376 32.949 20.018 1.00 0.14 B -ATOM 2596 3HB ALA B 19 26.829 32.645 20.783 1.00 0.14 B -ATOM 2597 N ALA B 20 29.351 30.688 18.258 1.00 0.15 B -ATOM 2598 CA ALA B 20 30.425 30.414 17.262 1.00 0.15 B -ATOM 2599 C ALA B 20 29.951 29.302 16.314 1.00 0.15 B -ATOM 2600 O ALA B 20 30.199 29.337 15.119 1.00 0.15 B -ATOM 2601 CB ALA B 20 31.695 29.900 17.957 1.00 0.17 B -ATOM 2602 H ALA B 20 29.474 30.397 19.174 1.00 0.15 B -ATOM 2603 HA ALA B 20 30.650 31.325 16.720 1.00 0.15 B -ATOM 2604 1HB ALA B 20 32.466 29.778 17.215 1.00 0.17 B -ATOM 2605 2HB ALA B 20 31.492 28.945 18.420 1.00 0.18 B -ATOM 2606 3HB ALA B 20 32.015 30.607 18.707 1.00 0.18 B -ATOM 2607 N GLN B 21 29.265 28.295 16.836 1.00 0.16 B -ATOM 2608 CA GLN B 21 28.781 27.215 15.913 1.00 0.16 B -ATOM 2609 C GLN B 21 27.687 27.812 14.974 1.00 0.15 B -ATOM 2610 O GLN B 21 27.585 27.443 13.820 1.00 0.15 B -ATOM 2611 CB GLN B 21 28.198 26.016 16.676 1.00 0.17 B -ATOM 2612 CG GLN B 21 29.303 25.378 17.521 1.00 0.18 B -ATOM 2613 CD GLN B 21 28.721 24.242 18.364 1.00 1.15 B -ATOM 2614 OE1 GLN B 21 27.522 24.047 18.398 1.00 1.74 B -ATOM 2615 NE2 GLN B 21 29.527 23.482 19.054 1.00 1.63 B -ATOM 2616 H GLN B 21 29.059 28.269 17.801 1.00 0.16 B -ATOM 2617 HA GLN B 21 29.623 26.873 15.324 1.00 0.17 B -ATOM 2618 1HB GLN B 21 27.397 26.352 17.319 1.00 0.17 B -ATOM 2619 2HB GLN B 21 27.818 25.290 15.973 1.00 0.17 B -ATOM 2620 1HG GLN B 21 30.071 24.985 16.870 1.00 0.85 B -ATOM 2621 2HG GLN B 21 29.731 26.123 18.174 1.00 0.87 B -ATOM 2622 1HE2 GLN B 21 30.493 23.643 19.027 1.00 1.40 B -ATOM 2623 2HE2 GLN B 21 29.167 22.754 19.601 1.00 2.35 B -ATOM 2624 N PHE B 22 26.857 28.725 15.477 1.00 0.13 B -ATOM 2625 CA PHE B 22 25.774 29.334 14.662 1.00 0.12 B -ATOM 2626 C PHE B 22 26.409 30.135 13.525 1.00 0.12 B -ATOM 2627 O PHE B 22 26.008 30.066 12.374 1.00 0.12 B -ATOM 2628 CB PHE B 22 24.915 30.243 15.585 1.00 0.11 B -ATOM 2629 CG PHE B 22 23.824 30.953 14.793 1.00 0.10 B -ATOM 2630 CD1 PHE B 22 22.607 30.306 14.573 1.00 0.10 B -ATOM 2631 CD2 PHE B 22 24.022 32.249 14.290 1.00 0.09 B -ATOM 2632 CE1 PHE B 22 21.581 30.936 13.859 1.00 0.09 B -ATOM 2633 CE2 PHE B 22 23.000 32.883 13.574 1.00 0.09 B -ATOM 2634 CZ PHE B 22 21.780 32.230 13.358 1.00 0.09 B -ATOM 2635 H PHE B 22 26.949 28.994 16.408 1.00 0.13 B -ATOM 2636 HA PHE B 22 25.162 28.555 14.248 1.00 0.12 B -ATOM 2637 1HB PHE B 22 24.448 29.628 16.343 1.00 0.12 B -ATOM 2638 2HB PHE B 22 25.549 30.973 16.063 1.00 0.11 B -ATOM 2639 HD1 PHE B 22 22.458 29.319 14.965 1.00 0.11 B -ATOM 2640 HD2 PHE B 22 24.958 32.760 14.454 1.00 0.10 B -ATOM 2641 HE1 PHE B 22 20.643 30.419 13.688 1.00 0.09 B -ATOM 2642 HE2 PHE B 22 23.154 33.877 13.189 1.00 0.09 B -ATOM 2643 HZ PHE B 22 20.991 32.729 12.815 1.00 0.08 B -ATOM 2644 N VAL B 23 27.414 30.881 13.868 1.00 0.12 B -ATOM 2645 CA VAL B 23 28.163 31.727 12.878 1.00 0.13 B -ATOM 2646 C VAL B 23 28.871 30.846 11.846 1.00 0.14 B -ATOM 2647 O VAL B 23 28.889 31.155 10.671 1.00 0.14 B -ATOM 2648 CB VAL B 23 29.165 32.675 13.609 1.00 0.13 B -ATOM 2649 CG1 VAL B 23 30.066 33.360 12.581 1.00 0.14 B -ATOM 2650 CG2 VAL B 23 28.383 33.737 14.387 1.00 0.12 B -ATOM 2651 H VAL B 23 27.689 30.889 14.801 1.00 0.12 B -ATOM 2652 HA VAL B 23 27.460 32.317 12.333 1.00 0.12 B -ATOM 2653 HB VAL B 23 29.773 32.098 14.292 1.00 0.14 B -ATOM 2654 1HG1 VAL B 23 30.793 32.651 12.212 1.00 1.01 B -ATOM 2655 2HG1 VAL B 23 30.578 34.190 13.046 1.00 1.05 B -ATOM 2656 3HG1 VAL B 23 29.466 33.721 11.759 1.00 1.01 B -ATOM 2657 1HG2 VAL B 23 29.064 34.307 15.001 1.00 1.03 B -ATOM 2658 2HG2 VAL B 23 27.649 33.255 15.015 1.00 1.03 B -ATOM 2659 3HG2 VAL B 23 27.885 34.397 13.693 1.00 1.01 B -ATOM 2660 N LYS B 24 29.442 29.760 12.254 1.00 0.14 B -ATOM 2661 CA LYS B 24 30.128 28.876 11.284 1.00 0.16 B -ATOM 2662 C LYS B 24 29.110 28.303 10.301 1.00 0.16 B -ATOM 2663 O LYS B 24 29.356 28.205 9.115 1.00 0.16 B -ATOM 2664 CB LYS B 24 30.816 27.705 12.019 1.00 0.17 B -ATOM 2665 CG LYS B 24 31.759 26.971 11.064 1.00 0.22 B -ATOM 2666 CD LYS B 24 32.338 25.741 11.767 1.00 1.00 B -ATOM 2667 CE LYS B 24 33.397 25.092 10.873 1.00 1.18 B -ATOM 2668 NZ LYS B 24 34.165 24.088 11.662 1.00 1.22 B -ATOM 2669 H LYS B 24 29.421 29.524 13.199 1.00 0.14 B -ATOM 2670 HA LYS B 24 30.860 29.453 10.749 1.00 0.16 B -ATOM 2671 1HB LYS B 24 31.381 28.090 12.856 1.00 0.17 B -ATOM 2672 2HB LYS B 24 30.065 27.017 12.379 1.00 0.20 B -ATOM 2673 1HG LYS B 24 31.215 26.663 10.184 1.00 0.78 B -ATOM 2674 2HG LYS B 24 32.566 27.630 10.780 1.00 0.75 B -ATOM 2675 1HD LYS B 24 32.789 26.040 12.702 1.00 1.57 B -ATOM 2676 2HD LYS B 24 31.548 25.030 11.959 1.00 1.59 B -ATOM 2677 1HE LYS B 24 32.914 24.602 10.040 1.00 1.54 B -ATOM 2678 2HE LYS B 24 34.070 25.851 10.503 1.00 1.52 B -ATOM 2679 1HZ LYS B 24 34.907 23.672 11.065 1.00 1.64 B -ATOM 2680 2HZ LYS B 24 33.521 23.339 11.990 1.00 1.60 B -ATOM 2681 3HZ LYS B 24 34.603 24.553 12.482 1.00 1.57 B -ATOM 2682 N GLU B 25 27.967 27.925 10.793 1.00 0.15 B -ATOM 2683 CA GLU B 25 26.935 27.366 9.923 1.00 0.15 B -ATOM 2684 C GLU B 25 26.401 28.483 8.984 1.00 0.14 B -ATOM 2685 O GLU B 25 26.151 28.248 7.814 1.00 0.15 B -ATOM 2686 CB GLU B 25 25.784 26.772 10.757 1.00 0.15 B -ATOM 2687 CG GLU B 25 24.806 26.202 9.673 1.00 0.15 B -ATOM 2688 CD GLU B 25 23.664 25.269 10.101 1.00 0.15 B -ATOM 2689 OE1 GLU B 25 23.922 24.167 10.558 1.00 0.17 B -ATOM 2690 OE2 GLU B 25 22.530 25.643 9.835 1.00 0.15 B -ATOM 2691 H GLU B 25 27.793 28.028 11.745 1.00 0.14 B -ATOM 2692 HA GLU B 25 27.374 26.572 9.324 1.00 0.16 B -ATOM 2693 1HB GLU B 25 26.159 25.993 11.412 1.00 0.15 B -ATOM 2694 2HB GLU B 25 25.300 27.549 11.330 1.00 0.14 B -ATOM 2695 1HG GLU B 25 24.339 27.038 9.223 1.00 0.14 B -ATOM 2696 2HG GLU B 25 25.385 25.685 8.923 1.00 0.16 B -ATOM 2697 N ALA B 26 26.220 29.697 9.489 1.00 0.13 B -ATOM 2698 CA ALA B 26 25.732 30.817 8.634 1.00 0.13 B -ATOM 2699 C ALA B 26 26.725 31.042 7.472 1.00 0.14 B -ATOM 2700 O ALA B 26 26.325 31.226 6.336 1.00 0.14 B -ATOM 2701 CB ALA B 26 25.578 32.038 9.553 1.00 0.12 B -ATOM 2702 H ALA B 26 26.406 29.865 10.438 1.00 0.13 B -ATOM 2703 HA ALA B 26 24.783 30.566 8.196 1.00 0.12 B -ATOM 2704 1HB ALA B 26 25.139 32.856 9.003 1.00 0.12 B -ATOM 2705 2HB ALA B 26 26.546 32.332 9.931 1.00 0.12 B -ATOM 2706 3HB ALA B 26 24.935 31.777 10.384 1.00 0.11 B -ATOM 2707 N LYS B 27 28.003 31.002 7.740 1.00 0.15 B -ATOM 2708 CA LYS B 27 29.025 31.172 6.664 1.00 0.16 B -ATOM 2709 C LYS B 27 28.964 30.053 5.591 1.00 0.17 B -ATOM 2710 O LYS B 27 29.543 30.193 4.532 1.00 0.18 B -ATOM 2711 CB LYS B 27 30.439 31.179 7.273 1.00 0.17 B -ATOM 2712 CG LYS B 27 30.661 32.476 8.045 1.00 0.17 B -ATOM 2713 CD LYS B 27 32.090 32.508 8.592 1.00 0.29 B -ATOM 2714 CE LYS B 27 32.294 33.780 9.416 1.00 1.15 B -ATOM 2715 NZ LYS B 27 33.748 33.972 9.681 1.00 1.43 B -ATOM 2716 H LYS B 27 28.297 30.859 8.659 1.00 0.14 B -ATOM 2717 HA LYS B 27 28.850 32.108 6.172 1.00 0.16 B -ATOM 2718 1HB LYS B 27 30.545 30.339 7.944 1.00 0.17 B -ATOM 2719 2HB LYS B 27 31.172 31.103 6.484 1.00 0.18 B -ATOM 2720 1HG LYS B 27 30.514 33.312 7.380 1.00 0.20 B -ATOM 2721 2HG LYS B 27 29.961 32.536 8.864 1.00 0.19 B -ATOM 2722 1HD LYS B 27 32.255 31.642 9.218 1.00 1.05 B -ATOM 2723 2HD LYS B 27 32.790 32.497 7.771 1.00 1.10 B -ATOM 2724 1HE LYS B 27 31.914 34.629 8.867 1.00 1.87 B -ATOM 2725 2HE LYS B 27 31.766 33.692 10.353 1.00 1.89 B -ATOM 2726 1HZ LYS B 27 34.216 34.313 8.817 1.00 1.77 B -ATOM 2727 2HZ LYS B 27 34.170 33.066 9.970 1.00 1.93 B -ATOM 2728 3HZ LYS B 27 33.874 34.672 10.439 1.00 1.86 B -ATOM 2729 N GLY B 28 28.298 28.954 5.833 1.00 0.17 B -ATOM 2730 CA GLY B 28 28.247 27.878 4.820 1.00 0.18 B -ATOM 2731 C GLY B 28 27.236 28.260 3.747 1.00 0.18 B -ATOM 2732 O GLY B 28 27.195 27.620 2.705 1.00 0.19 B -ATOM 2733 H GLY B 28 27.828 28.837 6.676 1.00 0.16 B -ATOM 2734 1HA GLY B 28 29.227 27.753 4.373 1.00 0.19 B -ATOM 2735 2HA GLY B 28 27.950 26.952 5.291 1.00 0.18 B -ATOM 2736 N PHE B 29 26.417 29.311 3.971 1.00 0.17 B -ATOM 2737 CA PHE B 29 25.427 29.698 2.904 1.00 0.17 B -ATOM 2738 C PHE B 29 25.909 30.940 2.170 1.00 0.18 B -ATOM 2739 O PHE B 29 26.508 31.824 2.751 1.00 0.17 B -ATOM 2740 CB PHE B 29 24.040 30.004 3.472 1.00 0.16 B -ATOM 2741 CG PHE B 29 23.528 28.823 4.245 1.00 0.16 B -ATOM 2742 CD1 PHE B 29 22.870 27.795 3.579 1.00 0.17 B -ATOM 2743 CD2 PHE B 29 23.700 28.763 5.631 1.00 0.15 B -ATOM 2744 CE1 PHE B 29 22.380 26.711 4.299 1.00 0.17 B -ATOM 2745 CE2 PHE B 29 23.202 27.670 6.344 1.00 0.15 B -ATOM 2746 CZ PHE B 29 22.540 26.648 5.673 1.00 0.16 B -ATOM 2747 H PHE B 29 26.473 29.821 4.816 1.00 0.16 B -ATOM 2748 HA PHE B 29 25.346 28.888 2.198 1.00 0.18 B -ATOM 2749 1HB PHE B 29 24.098 30.857 4.118 1.00 0.15 B -ATOM 2750 2HB PHE B 29 23.361 30.216 2.657 1.00 0.16 B -ATOM 2751 HD1 PHE B 29 22.735 27.841 2.509 1.00 0.17 B -ATOM 2752 HD2 PHE B 29 24.223 29.555 6.148 1.00 0.14 B -ATOM 2753 HE1 PHE B 29 21.885 25.926 3.801 1.00 0.18 B -ATOM 2754 HE2 PHE B 29 23.315 27.623 7.406 1.00 0.14 B -ATOM 2755 HZ PHE B 29 22.152 25.803 6.218 1.00 0.16 B -ATOM 2756 N THR B 30 25.639 31.014 0.891 1.00 0.19 B -ATOM 2757 CA THR B 30 26.088 32.208 0.095 1.00 0.20 B -ATOM 2758 C THR B 30 25.208 33.435 0.335 1.00 0.19 B -ATOM 2759 O THR B 30 25.709 34.541 0.234 1.00 0.20 B -ATOM 2760 CB THR B 30 26.214 31.842 -1.408 1.00 0.21 B -ATOM 2761 OG1 THR B 30 24.948 31.381 -1.876 1.00 0.21 B -ATOM 2762 CG2 THR B 30 27.288 30.751 -1.524 1.00 0.22 B -ATOM 2763 H THR B 30 25.139 30.290 0.453 1.00 0.19 B -ATOM 2764 HA THR B 30 27.054 32.506 0.454 1.00 0.20 B -ATOM 2765 HB THR B 30 26.523 32.709 -1.974 1.00 0.22 B -ATOM 2766 HG1 THR B 30 25.081 30.896 -2.691 1.00 0.22 B -ATOM 2767 1HG2 THR B 30 27.449 30.497 -2.559 1.00 0.23 B -ATOM 2768 2HG2 THR B 30 26.970 29.874 -0.979 1.00 0.21 B -ATOM 2769 3HG2 THR B 30 28.213 31.118 -1.095 1.00 0.22 B -ATOM 2770 N SER B 31 23.938 33.295 0.663 1.00 0.18 B -ATOM 2771 CA SER B 31 23.129 34.514 0.905 1.00 0.18 B -ATOM 2772 C SER B 31 23.653 35.426 2.024 1.00 0.17 B -ATOM 2773 O SER B 31 24.285 35.015 2.986 1.00 0.16 B -ATOM 2774 CB SER B 31 21.708 34.178 1.365 1.00 0.17 B -ATOM 2775 OG SER B 31 21.088 33.306 0.448 1.00 0.18 B -ATOM 2776 H SER B 31 23.526 32.406 0.737 1.00 0.18 B -ATOM 2777 HA SER B 31 23.077 35.069 -0.001 1.00 0.19 B -ATOM 2778 1HB SER B 31 21.743 33.708 2.335 1.00 0.16 B -ATOM 2779 2HB SER B 31 21.140 35.099 1.441 1.00 0.17 B -ATOM 2780 HG SER B 31 21.474 32.440 0.566 1.00 0.18 B -ATOM 2781 N GLU B 32 23.243 36.670 1.927 1.00 0.18 B -ATOM 2782 CA GLU B 32 23.502 37.653 2.993 1.00 0.17 B -ATOM 2783 C GLU B 32 22.415 37.310 4.024 1.00 0.16 B -ATOM 2784 O GLU B 32 21.256 37.149 3.681 1.00 0.16 B -ATOM 2785 CB GLU B 32 23.539 39.120 2.481 1.00 0.19 B -ATOM 2786 CG GLU B 32 22.431 40.155 2.865 1.00 0.19 B -ATOM 2787 CD GLU B 32 21.765 40.086 4.244 1.00 0.17 B -ATOM 2788 OE1 GLU B 32 22.335 40.606 5.194 1.00 0.17 B -ATOM 2789 OE2 GLU B 32 20.628 39.640 4.295 1.00 0.17 B -ATOM 2790 H GLU B 32 22.693 36.915 1.169 1.00 0.18 B -ATOM 2791 HA GLU B 32 24.468 37.421 3.403 1.00 0.17 B -ATOM 2792 1HB GLU B 32 24.481 39.543 2.791 1.00 0.19 B -ATOM 2793 2HB GLU B 32 23.558 39.063 1.400 1.00 0.20 B -ATOM 2794 1HG GLU B 32 22.895 41.126 2.809 1.00 0.20 B -ATOM 2795 2HG GLU B 32 21.665 40.108 2.116 1.00 0.19 B -ATOM 2796 N ILE B 33 22.793 37.117 5.264 1.00 0.15 B -ATOM 2797 CA ILE B 33 21.850 36.689 6.323 1.00 0.13 B -ATOM 2798 C ILE B 33 21.944 37.682 7.472 1.00 0.13 B -ATOM 2799 O ILE B 33 23.028 38.053 7.895 1.00 0.13 B -ATOM 2800 CB ILE B 33 22.268 35.280 6.837 1.00 0.12 B -ATOM 2801 CG1 ILE B 33 22.324 34.284 5.646 1.00 0.13 B -ATOM 2802 CG2 ILE B 33 21.304 34.821 7.949 1.00 0.11 B -ATOM 2803 CD1 ILE B 33 23.170 33.032 5.968 1.00 0.13 B -ATOM 2804 H ILE B 33 23.725 37.244 5.501 1.00 0.15 B -ATOM 2805 HA ILE B 33 20.845 36.660 5.933 1.00 0.13 B -ATOM 2806 HB ILE B 33 23.251 35.363 7.276 1.00 0.12 B -ATOM 2807 1HG1 ILE B 33 21.328 33.974 5.386 1.00 0.13 B -ATOM 2808 2HG1 ILE B 33 22.769 34.783 4.796 1.00 0.14 B -ATOM 2809 1HG2 ILE B 33 21.433 35.464 8.813 1.00 0.11 B -ATOM 2810 2HG2 ILE B 33 21.527 33.803 8.232 1.00 0.11 B -ATOM 2811 3HG2 ILE B 33 20.283 34.888 7.608 1.00 0.11 B -ATOM 2812 1HD1 ILE B 33 22.519 32.187 6.126 1.00 0.13 B -ATOM 2813 2HD1 ILE B 33 23.771 33.190 6.848 1.00 0.12 B -ATOM 2814 3HD1 ILE B 33 23.819 32.827 5.130 1.00 0.14 B -ATOM 2815 N THR B 34 20.811 38.104 7.967 1.00 0.13 B -ATOM 2816 CA THR B 34 20.755 39.073 9.082 1.00 0.13 B -ATOM 2817 C THR B 34 19.921 38.481 10.224 1.00 0.12 B -ATOM 2818 O THR B 34 18.876 37.883 10.024 1.00 0.11 B -ATOM 2819 CB THR B 34 20.068 40.412 8.589 1.00 0.14 B -ATOM 2820 OG1 THR B 34 20.865 40.935 7.536 1.00 0.16 B -ATOM 2821 CG2 THR B 34 19.893 41.530 9.645 1.00 0.15 B -ATOM 2822 H THR B 34 19.983 37.773 7.581 1.00 0.13 B -ATOM 2823 HA THR B 34 21.762 39.282 9.416 1.00 0.13 B -ATOM 2824 HB THR B 34 19.089 40.173 8.193 1.00 0.14 B -ATOM 2825 HG1 THR B 34 20.808 40.331 6.793 1.00 0.16 B -ATOM 2826 1HG2 THR B 34 19.867 42.488 9.130 1.00 0.16 B -ATOM 2827 2HG2 THR B 34 20.708 41.525 10.344 1.00 0.15 B -ATOM 2828 3HG2 THR B 34 18.956 41.396 10.170 1.00 0.15 B -ATOM 2829 N VAL B 35 20.395 38.735 11.402 1.00 0.11 B -ATOM 2830 CA VAL B 35 19.728 38.389 12.685 1.00 0.11 B -ATOM 2831 C VAL B 35 19.219 39.739 13.261 1.00 0.12 B -ATOM 2832 O VAL B 35 19.969 40.691 13.375 1.00 0.13 B -ATOM 2833 CB VAL B 35 20.701 37.672 13.672 1.00 0.10 B -ATOM 2834 CG1 VAL B 35 19.961 37.454 15.002 1.00 0.10 B -ATOM 2835 CG2 VAL B 35 21.183 36.334 13.078 1.00 0.09 B -ATOM 2836 H VAL B 35 21.222 39.228 11.443 1.00 0.12 B -ATOM 2837 HA VAL B 35 18.876 37.772 12.502 1.00 0.10 B -ATOM 2838 HB VAL B 35 21.559 38.308 13.853 1.00 0.10 B -ATOM 2839 1HG1 VAL B 35 19.792 38.414 15.472 1.00 0.10 B -ATOM 2840 2HG1 VAL B 35 20.554 36.835 15.657 1.00 0.09 B -ATOM 2841 3HG1 VAL B 35 19.010 36.978 14.814 1.00 0.09 B -ATOM 2842 1HG2 VAL B 35 20.535 36.032 12.266 1.00 0.09 B -ATOM 2843 2HG2 VAL B 35 21.188 35.567 13.838 1.00 0.09 B -ATOM 2844 3HG2 VAL B 35 22.185 36.463 12.706 1.00 0.09 B -ATOM 2845 N THR B 36 17.938 39.821 13.605 1.00 0.12 B -ATOM 2846 CA THR B 36 17.328 41.063 14.162 1.00 0.13 B -ATOM 2847 C THR B 36 16.678 40.781 15.468 1.00 0.13 B -ATOM 2848 O THR B 36 15.761 39.976 15.574 1.00 0.13 B -ATOM 2849 CB THR B 36 16.271 41.716 13.209 1.00 0.14 B -ATOM 2850 OG1 THR B 36 16.912 42.027 11.980 1.00 0.15 B -ATOM 2851 CG2 THR B 36 15.664 42.990 13.824 1.00 0.16 B -ATOM 2852 H THR B 36 17.380 39.038 13.502 1.00 0.11 B -ATOM 2853 HA THR B 36 18.098 41.763 14.354 1.00 0.14 B -ATOM 2854 HB THR B 36 15.477 41.022 13.027 1.00 0.14 B -ATOM 2855 HG1 THR B 36 17.525 42.752 12.134 1.00 0.16 B -ATOM 2856 1HG2 THR B 36 15.172 43.562 13.049 1.00 0.17 B -ATOM 2857 2HG2 THR B 36 16.438 43.586 14.276 1.00 0.16 B -ATOM 2858 3HG2 THR B 36 14.935 42.713 14.576 1.00 0.16 B -ATOM 2859 N SER B 37 17.143 41.478 16.474 1.00 0.14 B -ATOM 2860 CA SER B 37 16.506 41.302 17.816 1.00 0.14 B -ATOM 2861 C SER B 37 16.071 42.696 18.330 1.00 0.16 B -ATOM 2862 O SER B 37 16.863 43.621 18.399 1.00 0.17 B -ATOM 2863 CB SER B 37 17.476 40.582 18.756 1.00 0.14 B -ATOM 2864 OG SER B 37 16.887 40.527 20.048 1.00 0.14 B -ATOM 2865 H SER B 37 17.891 42.119 16.330 1.00 0.15 B -ATOM 2866 HA SER B 37 15.609 40.705 17.716 1.00 0.14 B -ATOM 2867 1HB SER B 37 17.653 39.581 18.400 1.00 0.13 B -ATOM 2868 2HB SER B 37 18.407 41.115 18.798 1.00 0.14 B -ATOM 2869 HG SER B 37 17.484 40.055 20.628 1.00 0.14 B -ATOM 2870 N ASN B 38 14.785 42.848 18.651 1.00 0.17 B -ATOM 2871 CA ASN B 38 14.236 44.174 19.133 1.00 0.18 B -ATOM 2872 C ASN B 38 14.630 45.353 18.221 1.00 0.19 B -ATOM 2873 O ASN B 38 14.888 46.437 18.699 1.00 0.21 B -ATOM 2874 CB ASN B 38 14.700 44.416 20.584 1.00 0.19 B -ATOM 2875 CG ASN B 38 13.935 45.567 21.247 1.00 0.21 B -ATOM 2876 OD1 ASN B 38 14.452 46.220 22.147 1.00 0.22 B -ATOM 2877 ND2 ASN B 38 12.781 45.925 20.769 1.00 0.22 B -ATOM 2878 H ASN B 38 14.172 42.083 18.565 1.00 0.16 B -ATOM 2879 HA ASN B 38 13.156 44.134 19.111 1.00 0.19 B -ATOM 2880 1HB ASN B 38 14.505 43.520 21.157 1.00 0.19 B -ATOM 2881 2HB ASN B 38 15.757 44.621 20.597 1.00 0.19 B -ATOM 2882 1HD2 ASN B 38 12.459 45.540 19.937 1.00 0.21 B -ATOM 2883 2HD2 ASN B 38 12.166 46.425 21.330 1.00 0.23 B -ATOM 2884 N GLY B 39 14.623 45.184 16.913 1.00 0.19 B -ATOM 2885 CA GLY B 39 14.924 46.333 16.021 1.00 0.20 B -ATOM 2886 C GLY B 39 16.408 46.601 15.868 1.00 0.20 B -ATOM 2887 O GLY B 39 16.787 47.632 15.336 1.00 0.21 B -ATOM 2888 H GLY B 39 14.389 44.318 16.519 1.00 0.18 B -ATOM 2889 1HA GLY B 39 14.516 46.123 15.046 1.00 0.20 B -ATOM 2890 2HA GLY B 39 14.453 47.214 16.424 1.00 0.21 B -ATOM 2891 N LYS B 40 17.252 45.704 16.297 1.00 0.19 B -ATOM 2892 CA LYS B 40 18.711 45.913 16.128 1.00 0.19 B -ATOM 2893 C LYS B 40 19.157 44.692 15.314 1.00 0.17 B -ATOM 2894 O LYS B 40 18.690 43.596 15.520 1.00 0.16 B -ATOM 2895 CB LYS B 40 19.369 46.018 17.497 1.00 0.19 B -ATOM 2896 CG LYS B 40 18.838 47.256 18.222 1.00 0.94 B -ATOM 2897 CD LYS B 40 19.588 47.436 19.543 1.00 1.31 B -ATOM 2898 CE LYS B 40 18.981 48.606 20.318 1.00 1.93 B -ATOM 2899 NZ LYS B 40 19.592 48.672 21.675 1.00 2.59 B -ATOM 2900 H LYS B 40 16.929 44.875 16.716 1.00 0.18 B -ATOM 2901 HA LYS B 40 18.901 46.823 15.560 1.00 0.20 B -ATOM 2902 1HB LYS B 40 19.141 45.134 18.076 1.00 0.67 B -ATOM 2903 2HB LYS B 40 20.438 46.104 17.378 1.00 0.69 B -ATOM 2904 1HG LYS B 40 18.987 48.128 17.601 1.00 1.52 B -ATOM 2905 2HG LYS B 40 17.785 47.133 18.422 1.00 1.58 B -ATOM 2906 1HD LYS B 40 19.504 46.532 20.129 1.00 1.83 B -ATOM 2907 2HD LYS B 40 20.629 47.641 19.341 1.00 1.84 B -ATOM 2908 1HE LYS B 40 19.176 49.527 19.790 1.00 2.41 B -ATOM 2909 2HE LYS B 40 17.915 48.463 20.410 1.00 2.37 B -ATOM 2910 1HZ LYS B 40 18.987 48.168 22.354 1.00 2.97 B -ATOM 2911 2HZ LYS B 40 19.686 49.668 21.965 1.00 3.02 B -ATOM 2912 3HZ LYS B 40 20.531 48.226 21.655 1.00 2.98 B -ATOM 2913 N SER B 41 19.978 44.913 14.348 1.00 0.18 B -ATOM 2914 CA SER B 41 20.427 43.884 13.407 1.00 0.17 B -ATOM 2915 C SER B 41 21.921 43.667 13.362 1.00 0.17 B -ATOM 2916 O SER B 41 22.751 44.519 13.647 1.00 0.18 B -ATOM 2917 CB SER B 41 20.094 44.362 11.988 1.00 0.17 B -ATOM 2918 OG SER B 41 18.688 44.467 11.857 1.00 0.18 B -ATOM 2919 H SER B 41 20.284 45.810 14.217 1.00 0.19 B -ATOM 2920 HA SER B 41 19.916 42.958 13.597 1.00 0.15 B -ATOM 2921 1HB SER B 41 20.540 45.330 11.819 1.00 0.19 B -ATOM 2922 2HB SER B 41 20.484 43.660 11.259 1.00 0.17 B -ATOM 2923 HG SER B 41 18.502 44.964 11.060 1.00 0.18 B -ATOM 2924 N ALA B 42 22.222 42.489 12.936 1.00 0.15 B -ATOM 2925 CA ALA B 42 23.597 42.052 12.740 1.00 0.15 B -ATOM 2926 C ALA B 42 23.679 40.991 11.637 1.00 0.14 B -ATOM 2927 O ALA B 42 22.814 40.139 11.500 1.00 0.13 B -ATOM 2928 CB ALA B 42 24.053 41.339 14.020 1.00 0.14 B -ATOM 2929 H ALA B 42 21.498 41.864 12.755 1.00 0.14 B -ATOM 2930 HA ALA B 42 24.238 42.899 12.529 1.00 0.16 B -ATOM 2931 1HB ALA B 42 24.141 42.052 14.823 1.00 0.15 B -ATOM 2932 2HB ALA B 42 25.008 40.861 13.852 1.00 0.14 B -ATOM 2933 3HB ALA B 42 23.321 40.588 14.282 1.00 0.13 B -ATOM 2934 N SER B 43 24.771 40.991 10.939 1.00 0.15 B -ATOM 2935 CA SER B 43 25.050 39.940 9.955 1.00 0.14 B -ATOM 2936 C SER B 43 25.211 38.629 10.753 1.00 0.13 B -ATOM 2937 O SER B 43 25.920 38.593 11.751 1.00 0.13 B -ATOM 2938 CB SER B 43 26.403 40.224 9.315 1.00 0.16 B -ATOM 2939 OG SER B 43 26.877 39.045 8.672 1.00 0.15 B -ATOM 2940 H SER B 43 25.449 41.666 11.115 1.00 0.16 B -ATOM 2941 HA SER B 43 24.277 39.898 9.202 1.00 0.14 B -ATOM 2942 1HB SER B 43 26.304 41.013 8.589 1.00 0.17 B -ATOM 2943 2HB SER B 43 27.100 40.531 10.084 1.00 0.16 B -ATOM 2944 HG SER B 43 26.391 38.935 7.853 1.00 0.15 B -ATOM 2945 N ALA B 44 24.595 37.562 10.350 1.00 0.12 B -ATOM 2946 CA ALA B 44 24.773 36.299 11.103 1.00 0.11 B -ATOM 2947 C ALA B 44 26.170 35.700 10.847 1.00 0.12 B -ATOM 2948 O ALA B 44 26.537 34.703 11.448 1.00 0.11 B -ATOM 2949 CB ALA B 44 23.723 35.328 10.588 1.00 0.10 B -ATOM 2950 H ALA B 44 24.020 37.586 9.554 1.00 0.12 B -ATOM 2951 HA ALA B 44 24.637 36.471 12.162 1.00 0.11 B -ATOM 2952 1HB ALA B 44 22.740 35.731 10.749 1.00 0.10 B -ATOM 2953 2HB ALA B 44 23.821 34.386 11.095 1.00 0.10 B -ATOM 2954 3HB ALA B 44 23.872 35.179 9.530 1.00 0.11 B -ATOM 2955 N LYS B 45 26.947 36.276 9.944 1.00 0.13 B -ATOM 2956 CA LYS B 45 28.289 35.699 9.638 1.00 0.14 B -ATOM 2957 C LYS B 45 29.348 36.460 10.412 1.00 0.15 B -ATOM 2958 O LYS B 45 30.533 36.318 10.149 1.00 0.16 B -ATOM 2959 CB LYS B 45 28.626 35.752 8.123 1.00 0.15 B -ATOM 2960 CG LYS B 45 27.594 34.951 7.278 1.00 0.15 B -ATOM 2961 CD LYS B 45 27.916 35.034 5.764 1.00 0.16 B -ATOM 2962 CE LYS B 45 26.702 34.545 4.945 1.00 0.16 B -ATOM 2963 NZ LYS B 45 27.107 34.401 3.509 1.00 0.17 B -ATOM 2964 H LYS B 45 26.638 37.073 9.475 1.00 0.13 B -ATOM 2965 HA LYS B 45 28.308 34.677 9.959 1.00 0.13 B -ATOM 2966 1HB LYS B 45 28.632 36.781 7.797 1.00 0.16 B -ATOM 2967 2HB LYS B 45 29.607 35.332 7.975 1.00 0.16 B -ATOM 2968 1HG LYS B 45 27.618 33.914 7.579 1.00 0.14 B -ATOM 2969 2HG LYS B 45 26.607 35.349 7.448 1.00 0.14 B -ATOM 2970 1HD LYS B 45 28.142 36.056 5.494 1.00 0.17 B -ATOM 2971 2HD LYS B 45 28.768 34.408 5.537 1.00 0.16 B -ATOM 2972 1HE LYS B 45 26.365 33.589 5.325 1.00 0.15 B -ATOM 2973 2HE LYS B 45 25.896 35.263 5.023 1.00 0.15 B -ATOM 2974 1HZ LYS B 45 26.442 34.923 2.901 1.00 0.17 B -ATOM 2975 2HZ LYS B 45 27.102 33.395 3.243 1.00 0.17 B -ATOM 2976 3HZ LYS B 45 28.063 34.787 3.381 1.00 0.18 B -ATOM 2977 N SER B 46 28.943 37.269 11.371 1.00 0.14 B -ATOM 2978 CA SER B 46 29.939 38.041 12.147 1.00 0.15 B -ATOM 2979 C SER B 46 29.634 37.961 13.638 1.00 0.15 B -ATOM 2980 O SER B 46 28.722 38.575 14.166 1.00 0.14 B -ATOM 2981 CB SER B 46 29.932 39.490 11.614 1.00 0.16 B -ATOM 2982 OG SER B 46 30.070 40.404 12.694 1.00 0.17 B -ATOM 2983 H SER B 46 27.986 37.362 11.573 1.00 0.14 B -ATOM 2984 HA SER B 46 30.920 37.609 12.011 1.00 0.16 B -ATOM 2985 1HB SER B 46 30.751 39.630 10.925 1.00 0.17 B -ATOM 2986 2HB SER B 46 29.001 39.672 11.095 1.00 0.16 B -ATOM 2987 HG SER B 46 30.862 40.174 13.180 1.00 0.17 B -ATOM 2988 N LEU B 47 30.443 37.183 14.303 1.00 0.15 B -ATOM 2989 CA LEU B 47 30.320 36.994 15.776 1.00 0.15 B -ATOM 2990 C LEU B 47 30.421 38.366 16.477 1.00 0.16 B -ATOM 2991 O LEU B 47 29.739 38.611 17.446 1.00 0.15 B -ATOM 2992 CB LEU B 47 31.462 36.039 16.219 1.00 0.15 B -ATOM 2993 CG LEU B 47 31.346 35.730 17.720 1.00 0.16 B -ATOM 2994 CD1 LEU B 47 30.166 34.780 17.986 1.00 0.19 B -ATOM 2995 CD2 LEU B 47 32.647 35.074 18.193 1.00 0.19 B -ATOM 2996 H LEU B 47 31.159 36.716 13.817 1.00 0.15 B -ATOM 2997 HA LEU B 47 29.361 36.555 16.019 1.00 0.14 B -ATOM 2998 1HB LEU B 47 31.402 35.122 15.653 1.00 0.15 B -ATOM 2999 2HB LEU B 47 32.414 36.512 16.027 1.00 0.17 B -ATOM 3000 HG LEU B 47 31.192 36.649 18.265 1.00 0.19 B -ATOM 3001 1HD1 LEU B 47 30.129 34.019 17.221 1.00 1.01 B -ATOM 3002 2HD1 LEU B 47 29.244 35.339 17.981 1.00 1.06 B -ATOM 3003 3HD1 LEU B 47 30.290 34.310 18.951 1.00 1.00 B -ATOM 3004 1HD2 LEU B 47 32.559 34.809 19.236 1.00 1.00 B -ATOM 3005 2HD2 LEU B 47 33.466 35.766 18.065 1.00 1.08 B -ATOM 3006 3HD2 LEU B 47 32.833 34.185 17.609 1.00 1.02 B -ATOM 3007 N PHE B 48 31.258 39.264 16.009 1.00 0.17 B -ATOM 3008 CA PHE B 48 31.365 40.600 16.695 1.00 0.18 B -ATOM 3009 C PHE B 48 30.035 41.391 16.690 1.00 0.17 B -ATOM 3010 O PHE B 48 29.617 41.868 17.727 1.00 0.18 B -ATOM 3011 CB PHE B 48 32.477 41.474 16.091 1.00 0.19 B -ATOM 3012 CG PHE B 48 32.601 42.748 16.892 1.00 0.22 B -ATOM 3013 CD1 PHE B 48 31.889 43.896 16.499 1.00 0.28 B -ATOM 3014 CD2 PHE B 48 33.424 42.786 18.034 1.00 0.28 B -ATOM 3015 CE1 PHE B 48 31.999 45.084 17.247 1.00 0.33 B -ATOM 3016 CE2 PHE B 48 33.536 43.975 18.781 1.00 0.34 B -ATOM 3017 CZ PHE B 48 32.823 45.123 18.388 1.00 0.34 B -ATOM 3018 H PHE B 48 31.816 39.061 15.232 1.00 0.17 B -ATOM 3019 HA PHE B 48 31.605 40.418 17.724 1.00 0.18 B -ATOM 3020 1HB PHE B 48 33.412 40.935 16.122 1.00 0.21 B -ATOM 3021 2HB PHE B 48 32.232 41.714 15.067 1.00 0.20 B -ATOM 3022 HD1 PHE B 48 31.260 43.865 15.624 1.00 0.34 B -ATOM 3023 HD2 PHE B 48 33.971 41.905 18.335 1.00 0.33 B -ATOM 3024 HE1 PHE B 48 31.453 45.965 16.945 1.00 0.41 B -ATOM 3025 HE2 PHE B 48 34.170 44.006 19.655 1.00 0.43 B -ATOM 3026 HZ PHE B 48 32.906 46.033 18.963 1.00 0.40 B -ATOM 3027 N LYS B 49 29.362 41.569 15.577 1.00 0.17 B -ATOM 3028 CA LYS B 49 28.107 42.347 15.610 1.00 0.17 B -ATOM 3029 C LYS B 49 27.033 41.586 16.342 1.00 0.16 B -ATOM 3030 O LYS B 49 26.141 42.152 16.942 1.00 0.16 B -ATOM 3031 CB LYS B 49 27.634 42.521 14.170 1.00 0.17 B -ATOM 3032 CG LYS B 49 28.723 43.192 13.319 1.00 0.19 B -ATOM 3033 CD LYS B 49 28.863 44.672 13.696 1.00 0.24 B -ATOM 3034 CE LYS B 49 29.721 45.383 12.648 1.00 0.36 B -ATOM 3035 NZ LYS B 49 30.166 46.702 13.181 1.00 1.13 B -ATOM 3036 H LYS B 49 29.673 41.203 14.721 1.00 0.17 B -ATOM 3037 HA LYS B 49 28.273 43.310 16.073 1.00 0.18 B -ATOM 3038 1HB LYS B 49 27.403 41.552 13.753 1.00 0.17 B -ATOM 3039 2HB LYS B 49 26.745 43.134 14.159 1.00 0.18 B -ATOM 3040 1HG LYS B 49 29.665 42.691 13.481 1.00 0.23 B -ATOM 3041 2HG LYS B 49 28.455 43.116 12.275 1.00 0.20 B -ATOM 3042 1HD LYS B 49 27.886 45.130 13.733 1.00 0.34 B -ATOM 3043 2HD LYS B 49 29.338 44.760 14.659 1.00 0.43 B -ATOM 3044 1HE LYS B 49 30.586 44.779 12.418 1.00 1.02 B -ATOM 3045 2HE LYS B 49 29.140 45.535 11.750 1.00 1.11 B -ATOM 3046 1HZ LYS B 49 30.080 47.424 12.438 1.00 1.71 B -ATOM 3047 2HZ LYS B 49 31.158 46.635 13.487 1.00 1.68 B -ATOM 3048 3HZ LYS B 49 29.570 46.968 13.990 1.00 1.70 B -ATOM 3049 N LEU B 50 27.084 40.306 16.251 1.00 0.15 B -ATOM 3050 CA LEU B 50 26.017 39.486 16.901 1.00 0.13 B -ATOM 3051 C LEU B 50 26.100 39.663 18.424 1.00 0.14 B -ATOM 3052 O LEU B 50 25.097 39.606 19.120 1.00 0.14 B -ATOM 3053 CB LEU B 50 26.315 38.035 16.494 1.00 0.12 B -ATOM 3054 CG LEU B 50 25.427 37.293 15.487 1.00 0.11 B -ATOM 3055 CD1 LEU B 50 25.854 35.800 15.606 1.00 0.11 B -ATOM 3056 CD2 LEU B 50 23.942 37.427 15.814 1.00 0.11 B -ATOM 3057 H LEU B 50 27.812 39.871 15.732 1.00 0.15 B -ATOM 3058 HA LEU B 50 25.044 39.802 16.590 1.00 0.13 B -ATOM 3059 1HB LEU B 50 27.300 38.028 16.064 1.00 0.13 B -ATOM 3060 2HB LEU B 50 26.352 37.446 17.399 1.00 0.12 B -ATOM 3061 HG LEU B 50 25.626 37.641 14.482 1.00 0.12 B -ATOM 3062 1HD1 LEU B 50 25.430 35.377 16.510 1.00 0.11 B -ATOM 3063 2HD1 LEU B 50 26.938 35.735 15.669 1.00 0.12 B -ATOM 3064 3HD1 LEU B 50 25.517 35.241 14.753 1.00 0.10 B -ATOM 3065 1HD2 LEU B 50 23.599 38.414 15.553 1.00 0.11 B -ATOM 3066 2HD2 LEU B 50 23.795 37.256 16.859 1.00 0.11 B -ATOM 3067 3HD2 LEU B 50 23.382 36.695 15.250 1.00 0.10 B -ATOM 3068 N GLN B 51 27.283 39.866 18.934 1.00 0.15 B -ATOM 3069 CA GLN B 51 27.460 40.018 20.397 1.00 0.16 B -ATOM 3070 C GLN B 51 26.825 41.312 20.859 1.00 0.17 B -ATOM 3071 O GLN B 51 26.716 41.550 22.039 1.00 0.17 B -ATOM 3072 CB GLN B 51 28.951 40.092 20.735 1.00 0.17 B -ATOM 3073 CG GLN B 51 29.567 38.696 20.612 1.00 0.17 B -ATOM 3074 CD GLN B 51 31.091 38.798 20.693 1.00 0.42 B -ATOM 3075 OE1 GLN B 51 31.656 39.841 20.431 1.00 0.78 B -ATOM 3076 NE2 GLN B 51 31.786 37.752 21.047 1.00 0.37 B -ATOM 3077 H GLN B 51 28.063 39.914 18.345 1.00 0.15 B -ATOM 3078 HA GLN B 51 27.022 39.168 20.908 1.00 0.15 B -ATOM 3079 1HB GLN B 51 29.444 40.767 20.052 1.00 0.18 B -ATOM 3080 2HB GLN B 51 29.079 40.444 21.745 1.00 0.18 B -ATOM 3081 1HG GLN B 51 29.207 38.076 21.421 1.00 0.30 B -ATOM 3082 2HG GLN B 51 29.284 38.256 19.673 1.00 0.32 B -ATOM 3083 1HE2 GLN B 51 31.330 36.910 21.259 1.00 0.27 B -ATOM 3084 2HE2 GLN B 51 32.762 37.807 21.102 1.00 0.59 B -ATOM 3085 N THR B 52 26.431 42.181 19.956 1.00 0.17 B -ATOM 3086 CA THR B 52 25.851 43.475 20.422 1.00 0.18 B -ATOM 3087 C THR B 52 24.324 43.373 20.553 1.00 0.18 B -ATOM 3088 O THR B 52 23.665 44.294 20.994 1.00 0.19 B -ATOM 3089 CB THR B 52 26.277 44.658 19.505 1.00 0.19 B -ATOM 3090 OG1 THR B 52 26.271 44.234 18.149 1.00 0.21 B -ATOM 3091 CG2 THR B 52 27.681 45.137 19.901 1.00 0.22 B -ATOM 3092 H THR B 52 26.528 41.983 18.999 1.00 0.16 B -ATOM 3093 HA THR B 52 26.222 43.664 21.414 1.00 0.19 B -ATOM 3094 HB THR B 52 25.578 45.472 19.626 1.00 0.21 B -ATOM 3095 HG1 THR B 52 25.467 43.731 18.000 1.00 0.95 B -ATOM 3096 1HG2 THR B 52 27.957 45.986 19.294 1.00 0.98 B -ATOM 3097 2HG2 THR B 52 28.390 44.338 19.749 1.00 1.00 B -ATOM 3098 3HG2 THR B 52 27.683 45.426 20.948 1.00 0.99 B -ATOM 3099 N LEU B 53 23.763 42.258 20.181 1.00 0.16 B -ATOM 3100 CA LEU B 53 22.307 42.054 20.274 1.00 0.16 B -ATOM 3101 C LEU B 53 21.956 41.348 21.593 1.00 0.16 B -ATOM 3102 O LEU B 53 22.761 40.643 22.169 1.00 0.16 B -ATOM 3103 CB LEU B 53 21.904 41.110 19.103 1.00 0.14 B -ATOM 3104 CG LEU B 53 21.829 41.905 17.787 1.00 0.14 B -ATOM 3105 CD1 LEU B 53 21.892 40.932 16.605 1.00 0.16 B -ATOM 3106 CD2 LEU B 53 20.506 42.709 17.705 1.00 0.13 B -ATOM 3107 H LEU B 53 24.311 41.542 19.811 1.00 0.15 B -ATOM 3108 HA LEU B 53 21.792 42.986 20.232 1.00 0.17 B -ATOM 3109 1HB LEU B 53 22.641 40.325 19.010 1.00 0.14 B -ATOM 3110 2HB LEU B 53 20.938 40.671 19.309 1.00 0.14 B -ATOM 3111 HG LEU B 53 22.670 42.583 17.734 1.00 0.14 B -ATOM 3112 1HD1 LEU B 53 21.699 41.469 15.689 1.00 0.16 B -ATOM 3113 2HD1 LEU B 53 21.146 40.162 16.734 1.00 0.16 B -ATOM 3114 3HD1 LEU B 53 22.866 40.482 16.563 1.00 0.17 B -ATOM 3115 1HD2 LEU B 53 20.148 42.944 18.695 1.00 0.13 B -ATOM 3116 2HD2 LEU B 53 19.752 42.132 17.189 1.00 0.12 B -ATOM 3117 3HD2 LEU B 53 20.680 43.628 17.163 1.00 0.13 B -ATOM 3118 N GLY B 54 20.735 41.502 22.042 1.00 0.16 B -ATOM 3119 CA GLY B 54 20.301 40.802 23.293 1.00 0.16 B -ATOM 3120 C GLY B 54 19.838 39.433 22.830 1.00 0.15 B -ATOM 3121 O GLY B 54 18.810 39.324 22.193 1.00 0.15 B -ATOM 3122 H GLY B 54 20.098 42.049 21.529 1.00 0.16 B -ATOM 3123 1HA GLY B 54 21.129 40.711 23.986 1.00 0.17 B -ATOM 3124 2HA GLY B 54 19.483 41.330 23.766 1.00 0.17 B -ATOM 3125 N LEU B 55 20.599 38.388 23.081 1.00 0.15 B -ATOM 3126 CA LEU B 55 20.181 37.064 22.604 1.00 0.14 B -ATOM 3127 C LEU B 55 20.097 36.177 23.838 1.00 0.14 B -ATOM 3128 O LEU B 55 20.627 35.078 23.864 1.00 0.14 B -ATOM 3129 CB LEU B 55 21.193 36.547 21.573 1.00 0.13 B -ATOM 3130 CG LEU B 55 21.364 37.399 20.300 1.00 0.12 B -ATOM 3131 CD1 LEU B 55 22.437 36.731 19.407 1.00 0.11 B -ATOM 3132 CD2 LEU B 55 20.054 37.481 19.508 1.00 0.11 B -ATOM 3133 H LEU B 55 21.451 38.491 23.562 1.00 0.15 B -ATOM 3134 HA LEU B 55 19.198 37.103 22.168 1.00 0.13 B -ATOM 3135 1HB LEU B 55 22.149 36.490 22.056 1.00 0.13 B -ATOM 3136 2HB LEU B 55 20.893 35.554 21.280 1.00 0.12 B -ATOM 3137 HG LEU B 55 21.695 38.391 20.563 1.00 0.13 B -ATOM 3138 1HD1 LEU B 55 21.975 36.019 18.732 1.00 0.10 B -ATOM 3139 2HD1 LEU B 55 23.166 36.212 20.018 1.00 0.12 B -ATOM 3140 3HD1 LEU B 55 22.936 37.490 18.839 1.00 0.11 B -ATOM 3141 1HD2 LEU B 55 19.342 38.082 20.048 1.00 0.12 B -ATOM 3142 2HD2 LEU B 55 19.658 36.487 19.363 1.00 0.11 B -ATOM 3143 3HD2 LEU B 55 20.249 37.932 18.542 1.00 0.11 B -ATOM 3144 N THR B 56 19.430 36.677 24.879 1.00 0.16 B -ATOM 3145 CA THR B 56 19.284 35.890 26.115 1.00 0.17 B -ATOM 3146 C THR B 56 18.105 34.917 25.963 1.00 0.17 B -ATOM 3147 O THR B 56 17.350 34.989 25.014 1.00 0.16 B -ATOM 3148 CB THR B 56 19.016 36.835 27.301 1.00 0.18 B -ATOM 3149 OG1 THR B 56 17.682 37.317 27.226 1.00 0.20 B -ATOM 3150 CG2 THR B 56 19.988 38.014 27.252 1.00 0.21 B -ATOM 3151 H THR B 56 19.038 37.580 24.832 1.00 0.16 B -ATOM 3152 HA THR B 56 20.189 35.340 26.286 1.00 0.17 B -ATOM 3153 HB THR B 56 19.154 36.299 28.227 1.00 0.22 B -ATOM 3154 HG1 THR B 56 17.179 36.910 27.935 1.00 0.96 B -ATOM 3155 1HG2 THR B 56 19.864 38.547 26.321 1.00 0.99 B -ATOM 3156 2HG2 THR B 56 21.002 37.650 27.326 1.00 1.04 B -ATOM 3157 3HG2 THR B 56 19.783 38.680 28.076 1.00 1.05 B -ATOM 3158 N GLN B 57 17.939 34.013 26.893 1.00 0.18 B -ATOM 3159 CA GLN B 57 16.813 33.048 26.806 1.00 0.18 B -ATOM 3160 C GLN B 57 15.484 33.780 26.738 1.00 0.18 B -ATOM 3161 O GLN B 57 15.256 34.733 27.464 1.00 0.19 B -ATOM 3162 CB GLN B 57 16.823 32.168 28.075 1.00 0.20 B -ATOM 3163 CG GLN B 57 15.698 31.138 27.979 1.00 0.20 B -ATOM 3164 CD GLN B 57 15.840 30.191 29.157 1.00 0.22 B -ATOM 3165 OE1 GLN B 57 15.520 29.016 29.068 1.00 0.22 B -ATOM 3166 NE2 GLN B 57 16.331 30.681 30.266 1.00 0.23 B -ATOM 3167 H GLN B 57 18.557 33.977 27.654 1.00 0.18 B -ATOM 3168 HA GLN B 57 16.921 32.434 25.931 1.00 0.17 B -ATOM 3169 1HB GLN B 57 17.772 31.665 28.165 1.00 0.20 B -ATOM 3170 2HB GLN B 57 16.667 32.788 28.947 1.00 0.20 B -ATOM 3171 1HG GLN B 57 14.739 31.641 28.028 1.00 0.20 B -ATOM 3172 2HG GLN B 57 15.774 30.589 27.052 1.00 0.19 B -ATOM 3173 1HE2 GLN B 57 16.586 31.629 30.302 1.00 0.22 B -ATOM 3174 2HE2 GLN B 57 16.448 30.114 31.054 1.00 0.24 B -ATOM 3175 N GLY B 58 14.574 33.321 25.895 1.00 0.18 B -ATOM 3176 CA GLY B 58 13.252 33.967 25.835 1.00 0.18 B -ATOM 3177 C GLY B 58 13.184 35.068 24.781 1.00 0.17 B -ATOM 3178 O GLY B 58 12.147 35.684 24.565 1.00 0.18 B -ATOM 3179 H GLY B 58 14.761 32.536 25.333 1.00 0.17 B -ATOM 3180 1HA GLY B 58 12.520 33.215 25.604 1.00 0.19 B -ATOM 3181 2HA GLY B 58 13.043 34.393 26.800 1.00 0.19 B -ATOM 3182 N THR B 59 14.272 35.333 24.139 1.00 0.16 B -ATOM 3183 CA THR B 59 14.298 36.393 23.106 1.00 0.15 B -ATOM 3184 C THR B 59 13.828 35.854 21.745 1.00 0.14 B -ATOM 3185 O THR B 59 14.310 34.838 21.292 1.00 0.14 B -ATOM 3186 CB THR B 59 15.761 36.889 22.938 1.00 0.15 B -ATOM 3187 OG1 THR B 59 16.191 37.523 24.139 1.00 0.16 B -ATOM 3188 CG2 THR B 59 15.819 37.896 21.778 1.00 0.14 B -ATOM 3189 H THR B 59 15.088 34.836 24.344 1.00 0.16 B -ATOM 3190 HA THR B 59 13.666 37.214 23.418 1.00 0.16 B -ATOM 3191 HB THR B 59 16.407 36.050 22.723 1.00 0.14 B -ATOM 3192 HG1 THR B 59 15.547 37.332 24.824 1.00 0.17 B -ATOM 3193 1HG2 THR B 59 14.942 38.529 21.805 1.00 0.15 B -ATOM 3194 2HG2 THR B 59 15.848 37.365 20.838 1.00 0.13 B -ATOM 3195 3HG2 THR B 59 16.699 38.505 21.872 1.00 0.14 B -ATOM 3196 N VAL B 60 12.938 36.561 21.059 1.00 0.15 B -ATOM 3197 CA VAL B 60 12.492 36.133 19.716 1.00 0.14 B -ATOM 3198 C VAL B 60 13.360 36.857 18.711 1.00 0.13 B -ATOM 3199 O VAL B 60 13.391 38.083 18.703 1.00 0.13 B -ATOM 3200 CB VAL B 60 11.020 36.566 19.486 1.00 0.15 B -ATOM 3201 CG1 VAL B 60 10.555 36.204 18.066 1.00 0.14 B -ATOM 3202 CG2 VAL B 60 10.107 35.952 20.545 1.00 0.16 B -ATOM 3203 H VAL B 60 12.589 37.396 21.421 1.00 0.15 B -ATOM 3204 HA VAL B 60 12.594 35.079 19.606 1.00 0.13 B -ATOM 3205 HB VAL B 60 10.965 37.640 19.589 1.00 0.15 B -ATOM 3206 1HG1 VAL B 60 9.598 36.669 17.866 1.00 0.15 B -ATOM 3207 2HG1 VAL B 60 10.466 35.134 17.961 1.00 0.14 B -ATOM 3208 3HG1 VAL B 60 11.280 36.572 17.363 1.00 0.14 B -ATOM 3209 1HG2 VAL B 60 9.097 36.309 20.395 1.00 0.17 B -ATOM 3210 2HG2 VAL B 60 10.450 36.260 21.524 1.00 0.16 B -ATOM 3211 3HG2 VAL B 60 10.128 34.879 20.476 1.00 0.16 B -ATOM 3212 N VAL B 61 14.059 36.157 17.835 1.00 0.12 B -ATOM 3213 CA VAL B 61 14.864 36.932 16.833 1.00 0.11 B -ATOM 3214 C VAL B 61 14.293 36.732 15.446 1.00 0.11 B -ATOM 3215 O VAL B 61 13.603 35.745 15.209 1.00 0.11 B -ATOM 3216 CB VAL B 61 16.312 36.441 16.765 1.00 0.10 B -ATOM 3217 CG1 VAL B 61 17.074 36.774 18.062 1.00 0.11 B -ATOM 3218 CG2 VAL B 61 16.281 34.931 16.524 1.00 0.10 B -ATOM 3219 H VAL B 61 14.043 35.166 17.832 1.00 0.11 B -ATOM 3220 HA VAL B 61 14.853 37.977 17.090 1.00 0.12 B -ATOM 3221 HB VAL B 61 16.808 36.920 15.929 1.00 0.10 B -ATOM 3222 1HG1 VAL B 61 16.567 37.565 18.594 1.00 0.12 B -ATOM 3223 2HG1 VAL B 61 18.074 37.101 17.813 1.00 0.10 B -ATOM 3224 3HG1 VAL B 61 17.131 35.900 18.694 1.00 0.11 B -ATOM 3225 1HG2 VAL B 61 15.815 34.724 15.572 1.00 0.09 B -ATOM 3226 2HG2 VAL B 61 15.714 34.457 17.310 1.00 0.10 B -ATOM 3227 3HG2 VAL B 61 17.286 34.549 16.520 1.00 0.09 B -ATOM 3228 N THR B 62 14.625 37.620 14.502 1.00 0.11 B -ATOM 3229 CA THR B 62 14.149 37.382 13.113 1.00 0.11 B -ATOM 3230 C THR B 62 15.386 37.021 12.291 1.00 0.11 B -ATOM 3231 O THR B 62 16.382 37.717 12.330 1.00 0.11 B -ATOM 3232 CB THR B 62 13.423 38.601 12.484 1.00 0.13 B -ATOM 3233 OG1 THR B 62 12.316 38.915 13.324 1.00 0.14 B -ATOM 3234 CG2 THR B 62 12.914 38.197 11.088 1.00 0.13 B -ATOM 3235 H THR B 62 15.210 38.388 14.715 1.00 0.11 B -ATOM 3236 HA THR B 62 13.462 36.550 13.125 1.00 0.11 B -ATOM 3237 HB THR B 62 14.081 39.443 12.409 1.00 0.13 B -ATOM 3238 HG1 THR B 62 11.542 38.456 12.985 1.00 0.14 B -ATOM 3239 1HG2 THR B 62 12.218 38.936 10.722 1.00 0.14 B -ATOM 3240 2HG2 THR B 62 12.415 37.239 11.154 1.00 0.13 B -ATOM 3241 3HG2 THR B 62 13.748 38.116 10.405 1.00 0.13 B -ATOM 3242 N ILE B 63 15.323 35.952 11.540 1.00 0.10 B -ATOM 3243 CA ILE B 63 16.459 35.529 10.672 1.00 0.10 B -ATOM 3244 C ILE B 63 15.924 35.795 9.251 1.00 0.11 B -ATOM 3245 O ILE B 63 14.906 35.258 8.877 1.00 0.11 B -ATOM 3246 CB ILE B 63 16.865 34.022 10.831 1.00 0.09 B -ATOM 3247 CG1 ILE B 63 17.198 33.728 12.319 1.00 0.09 B -ATOM 3248 CG2 ILE B 63 18.059 33.733 9.891 1.00 0.09 B -ATOM 3249 CD1 ILE B 63 17.608 32.259 12.559 1.00 0.09 B -ATOM 3250 H ILE B 63 14.499 35.439 11.517 1.00 0.10 B -ATOM 3251 HA ILE B 63 17.318 36.148 10.885 1.00 0.10 B -ATOM 3252 HB ILE B 63 16.038 33.399 10.520 1.00 0.10 B -ATOM 3253 1HG1 ILE B 63 18.000 34.371 12.640 1.00 0.08 B -ATOM 3254 2HG1 ILE B 63 16.318 33.939 12.910 1.00 0.09 B -ATOM 3255 1HG2 ILE B 63 17.686 33.573 8.887 1.00 0.10 B -ATOM 3256 2HG2 ILE B 63 18.586 32.852 10.216 1.00 0.09 B -ATOM 3257 3HG2 ILE B 63 18.735 34.577 9.882 1.00 0.09 B -ATOM 3258 1HD1 ILE B 63 16.886 31.597 12.116 1.00 0.09 B -ATOM 3259 2HD1 ILE B 63 17.650 32.071 13.626 1.00 0.09 B -ATOM 3260 3HD1 ILE B 63 18.579 32.075 12.129 1.00 0.09 B -ATOM 3261 N SER B 64 16.588 36.634 8.493 1.00 0.12 B -ATOM 3262 CA SER B 64 16.183 36.994 7.099 1.00 0.13 B -ATOM 3263 C SER B 64 17.357 36.727 6.197 1.00 0.13 B -ATOM 3264 O SER B 64 18.506 36.929 6.580 1.00 0.13 B -ATOM 3265 CB SER B 64 15.827 38.499 6.933 1.00 0.14 B -ATOM 3266 OG SER B 64 15.323 39.025 8.147 1.00 0.14 B -ATOM 3267 H SER B 64 17.389 37.034 8.856 1.00 0.11 B -ATOM 3268 HA SER B 64 15.360 36.392 6.798 1.00 0.13 B -ATOM 3269 1HB SER B 64 16.707 39.061 6.657 1.00 0.15 B -ATOM 3270 2HB SER B 64 15.096 38.613 6.147 1.00 0.15 B -ATOM 3271 HG SER B 64 16.074 39.219 8.713 1.00 0.14 B -ATOM 3272 N ALA B 65 17.104 36.323 4.990 1.00 0.14 B -ATOM 3273 CA ALA B 65 18.265 36.095 4.081 1.00 0.15 B -ATOM 3274 C ALA B 65 17.898 36.569 2.710 1.00 0.16 B -ATOM 3275 O ALA B 65 16.735 36.574 2.324 1.00 0.17 B -ATOM 3276 CB ALA B 65 18.665 34.633 3.955 1.00 0.14 B -ATOM 3277 H ALA B 65 16.170 36.199 4.685 1.00 0.14 B -ATOM 3278 HA ALA B 65 19.114 36.647 4.452 1.00 0.15 B -ATOM 3279 1HB ALA B 65 17.798 34.040 3.710 1.00 0.14 B -ATOM 3280 2HB ALA B 65 19.085 34.293 4.888 1.00 0.13 B -ATOM 3281 3HB ALA B 65 19.405 34.530 3.171 1.00 0.15 B -ATOM 3282 N GLU B 66 18.891 36.937 1.961 1.00 0.17 B -ATOM 3283 CA GLU B 66 18.615 37.396 0.571 1.00 0.19 B -ATOM 3284 C GLU B 66 19.730 36.869 -0.297 1.00 0.20 B -ATOM 3285 O GLU B 66 20.875 37.281 -0.180 1.00 0.20 B -ATOM 3286 CB GLU B 66 18.606 38.934 0.607 1.00 0.20 B -ATOM 3287 CG GLU B 66 17.597 39.684 -0.288 1.00 0.21 B -ATOM 3288 CD GLU B 66 17.462 39.109 -1.688 1.00 0.22 B -ATOM 3289 OE1 GLU B 66 18.262 39.442 -2.552 1.00 0.23 B -ATOM 3290 OE2 GLU B 66 16.512 38.377 -1.881 1.00 0.22 B -ATOM 3291 H GLU B 66 19.814 36.899 2.318 1.00 0.17 B -ATOM 3292 HA GLU B 66 17.673 37.002 0.225 1.00 0.19 B -ATOM 3293 1HB GLU B 66 18.396 39.225 1.623 1.00 0.19 B -ATOM 3294 2HB GLU B 66 19.598 39.284 0.364 1.00 0.20 B -ATOM 3295 1HG GLU B 66 16.648 39.662 0.170 1.00 0.21 B -ATOM 3296 2HG GLU B 66 17.915 40.717 -0.360 1.00 0.22 B -ATOM 3297 N GLY B 67 19.425 35.957 -1.164 1.00 0.20 B -ATOM 3298 CA GLY B 67 20.507 35.436 -2.019 1.00 0.21 B -ATOM 3299 C GLY B 67 20.029 34.156 -2.681 1.00 0.21 B -ATOM 3300 O GLY B 67 18.888 33.755 -2.568 1.00 0.21 B -ATOM 3301 H GLY B 67 18.498 35.624 -1.255 1.00 0.20 B -ATOM 3302 1HA GLY B 67 20.773 36.174 -2.768 1.00 0.22 B -ATOM 3303 2HA GLY B 67 21.377 35.218 -1.418 1.00 0.20 B -ATOM 3304 N GLU B 68 20.935 33.536 -3.350 1.00 0.22 B -ATOM 3305 CA GLU B 68 20.711 32.275 -4.068 1.00 0.23 B -ATOM 3306 C GLU B 68 20.142 31.173 -3.184 1.00 0.22 B -ATOM 3307 O GLU B 68 19.299 30.436 -3.659 1.00 0.22 B -ATOM 3308 CB GLU B 68 22.102 31.787 -4.531 1.00 0.23 B -ATOM 3309 CG GLU B 68 22.077 31.007 -5.847 1.00 0.25 B -ATOM 3310 CD GLU B 68 23.504 31.001 -6.399 1.00 0.26 B -ATOM 3311 OE1 GLU B 68 24.399 30.748 -5.606 1.00 0.25 B -ATOM 3312 OE2 GLU B 68 23.678 31.278 -7.577 1.00 0.27 B -ATOM 3313 H GLU B 68 21.825 33.926 -3.388 1.00 0.22 B -ATOM 3314 HA GLU B 68 20.069 32.447 -4.918 1.00 0.23 B -ATOM 3315 1HB GLU B 68 22.740 32.649 -4.650 1.00 0.24 B -ATOM 3316 2HB GLU B 68 22.532 31.152 -3.763 1.00 0.23 B -ATOM 3317 1HG GLU B 68 21.762 29.989 -5.660 1.00 0.25 B -ATOM 3318 2HG GLU B 68 21.414 31.477 -6.551 1.00 0.25 B -ATOM 3319 N ASP B 69 20.601 30.990 -1.932 1.00 0.20 B -ATOM 3320 CA ASP B 69 20.024 29.843 -1.157 1.00 0.20 B -ATOM 3321 C ASP B 69 19.284 30.403 0.025 1.00 0.18 B -ATOM 3322 O ASP B 69 19.334 29.849 1.109 1.00 0.17 B -ATOM 3323 CB ASP B 69 21.163 28.906 -0.694 1.00 0.20 B -ATOM 3324 CG ASP B 69 22.301 29.706 -0.020 1.00 0.19 B -ATOM 3325 OD1 ASP B 69 22.058 30.827 0.412 1.00 0.18 B -ATOM 3326 OD2 ASP B 69 23.403 29.176 0.051 1.00 0.19 B -ATOM 3327 H ASP B 69 21.304 31.578 -1.542 1.00 0.20 B -ATOM 3328 HA ASP B 69 19.337 29.285 -1.783 1.00 0.20 B -ATOM 3329 1HB ASP B 69 20.769 28.189 0.011 1.00 0.19 B -ATOM 3330 2HB ASP B 69 21.560 28.379 -1.551 1.00 0.21 B -ATOM 3331 N GLU B 70 18.630 31.531 -0.149 1.00 0.18 B -ATOM 3332 CA GLU B 70 17.973 32.150 1.040 1.00 0.17 B -ATOM 3333 C GLU B 70 16.915 31.349 1.803 1.00 0.17 B -ATOM 3334 O GLU B 70 16.749 31.565 2.995 1.00 0.15 B -ATOM 3335 CB GLU B 70 17.418 33.500 0.593 1.00 0.18 B -ATOM 3336 CG GLU B 70 16.199 33.364 -0.350 1.00 0.19 B -ATOM 3337 CD GLU B 70 15.802 34.749 -0.903 1.00 0.20 B -ATOM 3338 OE1 GLU B 70 16.693 35.470 -1.324 1.00 0.20 B -ATOM 3339 OE2 GLU B 70 14.618 35.063 -0.902 1.00 0.20 B -ATOM 3340 H GLU B 70 18.612 31.995 -1.035 1.00 0.19 B -ATOM 3341 HA GLU B 70 18.728 32.315 1.784 1.00 0.16 B -ATOM 3342 1HB GLU B 70 17.121 34.057 1.467 1.00 0.17 B -ATOM 3343 2HB GLU B 70 18.198 34.041 0.079 1.00 0.18 B -ATOM 3344 1HG GLU B 70 16.451 32.717 -1.176 1.00 0.19 B -ATOM 3345 2HG GLU B 70 15.366 32.950 0.192 1.00 0.18 B -ATOM 3346 N GLN B 71 16.179 30.492 1.206 1.00 0.17 B -ATOM 3347 CA GLN B 71 15.119 29.765 2.004 1.00 0.17 B -ATOM 3348 C GLN B 71 15.771 28.642 2.834 1.00 0.17 B -ATOM 3349 O GLN B 71 15.469 28.439 3.995 1.00 0.16 B -ATOM 3350 CB GLN B 71 13.944 29.180 1.160 1.00 0.18 B -ATOM 3351 CG GLN B 71 13.728 29.752 -0.280 1.00 0.20 B -ATOM 3352 CD GLN B 71 12.376 30.498 -0.366 1.00 0.20 B -ATOM 3353 OE1 GLN B 71 12.265 31.586 0.163 1.00 0.19 B -ATOM 3354 NE2 GLN B 71 11.427 30.084 -1.185 1.00 0.21 B -ATOM 3355 H GLN B 71 16.276 30.343 0.256 1.00 0.18 B -ATOM 3356 HA GLN B 71 14.712 30.443 2.707 1.00 0.16 B -ATOM 3357 1HB GLN B 71 14.106 28.117 1.063 1.00 0.19 B -ATOM 3358 2HB GLN B 71 13.034 29.320 1.732 1.00 0.18 B -ATOM 3359 1HG GLN B 71 14.530 30.398 -0.551 1.00 0.19 B -ATOM 3360 2HG GLN B 71 13.681 28.915 -0.964 1.00 0.20 B -ATOM 3361 1HE2 GLN B 71 11.609 29.410 -1.852 1.00 0.22 B -ATOM 3362 2HE2 GLN B 71 10.505 30.258 -0.960 1.00 0.21 B -ATOM 3363 N LYS B 72 16.656 27.934 2.225 1.00 0.17 B -ATOM 3364 CA LYS B 72 17.375 26.846 2.870 1.00 0.17 B -ATOM 3365 C LYS B 72 18.199 27.462 3.991 1.00 0.16 B -ATOM 3366 O LYS B 72 18.319 26.898 5.057 1.00 0.16 B -ATOM 3367 CB LYS B 72 18.355 26.160 1.898 1.00 0.19 B -ATOM 3368 CG LYS B 72 18.606 24.736 2.440 1.00 0.19 B -ATOM 3369 CD LYS B 72 19.641 23.986 1.580 1.00 0.21 B -ATOM 3370 CE LYS B 72 21.014 24.023 2.246 1.00 0.20 B -ATOM 3371 NZ LYS B 72 21.027 23.108 3.427 1.00 0.20 B -ATOM 3372 H LYS B 72 16.858 28.143 1.311 1.00 0.18 B -ATOM 3373 HA LYS B 72 16.661 26.114 3.230 1.00 0.18 B -ATOM 3374 1HB LYS B 72 17.919 26.109 0.909 1.00 0.19 B -ATOM 3375 2HB LYS B 72 19.292 26.701 1.854 1.00 0.18 B -ATOM 3376 1HG LYS B 72 18.951 24.805 3.465 1.00 0.18 B -ATOM 3377 2HG LYS B 72 17.671 24.191 2.427 1.00 0.20 B -ATOM 3378 1HD LYS B 72 19.335 22.958 1.465 1.00 0.22 B -ATOM 3379 2HD LYS B 72 19.708 24.449 0.608 1.00 0.21 B -ATOM 3380 1HE LYS B 72 21.772 23.716 1.543 1.00 0.21 B -ATOM 3381 2HE LYS B 72 21.208 25.016 2.554 1.00 0.19 B -ATOM 3382 1HZ LYS B 72 20.652 23.605 4.262 1.00 0.19 B -ATOM 3383 2HZ LYS B 72 22.003 22.798 3.618 1.00 0.21 B -ATOM 3384 3HZ LYS B 72 20.433 22.279 3.226 1.00 0.21 B -ATOM 3385 N ALA B 73 18.810 28.627 3.743 1.00 0.15 B -ATOM 3386 CA ALA B 73 19.652 29.223 4.810 1.00 0.14 B -ATOM 3387 C ALA B 73 18.807 29.550 6.049 1.00 0.13 B -ATOM 3388 O ALA B 73 19.191 29.239 7.159 1.00 0.13 B -ATOM 3389 CB ALA B 73 20.334 30.492 4.259 1.00 0.14 B -ATOM 3390 H ALA B 73 18.728 29.082 2.867 1.00 0.16 B -ATOM 3391 HA ALA B 73 20.407 28.510 5.103 1.00 0.14 B -ATOM 3392 1HB ALA B 73 19.603 31.281 4.157 1.00 0.14 B -ATOM 3393 2HB ALA B 73 20.769 30.278 3.294 1.00 0.15 B -ATOM 3394 3HB ALA B 73 21.108 30.805 4.939 1.00 0.14 B -ATOM 3395 N VAL B 74 17.676 30.170 5.873 1.00 0.13 B -ATOM 3396 CA VAL B 74 16.807 30.541 7.045 1.00 0.12 B -ATOM 3397 C VAL B 74 16.243 29.267 7.650 1.00 0.13 B -ATOM 3398 O VAL B 74 16.155 29.130 8.866 1.00 0.12 B -ATOM 3399 CB VAL B 74 15.705 31.532 6.593 1.00 0.12 B -ATOM 3400 CG1 VAL B 74 14.668 31.781 7.705 1.00 0.12 B -ATOM 3401 CG2 VAL B 74 16.361 32.865 6.167 1.00 0.12 B -ATOM 3402 H VAL B 74 17.393 30.403 4.970 1.00 0.14 B -ATOM 3403 HA VAL B 74 17.409 31.014 7.794 1.00 0.11 B -ATOM 3404 HB VAL B 74 15.203 31.105 5.751 1.00 0.13 B -ATOM 3405 1HG1 VAL B 74 13.953 32.520 7.367 1.00 0.12 B -ATOM 3406 2HG1 VAL B 74 15.162 32.142 8.594 1.00 0.11 B -ATOM 3407 3HG1 VAL B 74 14.150 30.859 7.928 1.00 0.12 B -ATOM 3408 1HG2 VAL B 74 15.810 33.291 5.341 1.00 0.13 B -ATOM 3409 2HG2 VAL B 74 17.383 32.689 5.858 1.00 0.12 B -ATOM 3410 3HG2 VAL B 74 16.356 33.560 6.993 1.00 0.12 B -ATOM 3411 N GLU B 75 15.871 28.332 6.806 1.00 0.14 B -ATOM 3412 CA GLU B 75 15.294 27.046 7.326 1.00 0.15 B -ATOM 3413 C GLU B 75 16.283 26.387 8.243 1.00 0.15 B -ATOM 3414 O GLU B 75 15.953 25.933 9.326 1.00 0.15 B -ATOM 3415 CB GLU B 75 14.881 26.071 6.189 1.00 0.16 B -ATOM 3416 CG GLU B 75 13.539 26.619 5.658 1.00 0.17 B -ATOM 3417 CD GLU B 75 13.027 25.980 4.367 1.00 0.18 B -ATOM 3418 OE1 GLU B 75 13.613 25.028 3.877 1.00 0.19 B -ATOM 3419 OE2 GLU B 75 12.027 26.495 3.882 1.00 0.18 B -ATOM 3420 H GLU B 75 15.953 28.493 5.842 1.00 0.14 B -ATOM 3421 HA GLU B 75 14.416 27.289 7.895 1.00 0.15 B -ATOM 3422 1HB GLU B 75 15.622 26.067 5.405 1.00 0.17 B -ATOM 3423 2HB GLU B 75 14.744 25.074 6.587 1.00 0.17 B -ATOM 3424 1HG GLU B 75 12.794 26.470 6.418 1.00 0.17 B -ATOM 3425 2HG GLU B 75 13.650 27.681 5.490 1.00 0.16 B -ATOM 3426 N HIS B 76 17.492 26.324 7.819 1.00 0.15 B -ATOM 3427 CA HIS B 76 18.525 25.686 8.637 1.00 0.15 B -ATOM 3428 C HIS B 76 18.900 26.490 9.861 1.00 0.13 B -ATOM 3429 O HIS B 76 19.221 25.910 10.884 1.00 0.14 B -ATOM 3430 CB HIS B 76 19.771 25.441 7.750 1.00 0.15 B -ATOM 3431 CG HIS B 76 19.368 24.390 6.747 1.00 0.17 B -ATOM 3432 ND1 HIS B 76 20.129 23.266 6.459 1.00 0.18 B -ATOM 3433 CD2 HIS B 76 18.234 24.270 5.991 1.00 0.17 B -ATOM 3434 CE1 HIS B 76 19.435 22.533 5.561 1.00 0.19 B -ATOM 3435 NE2 HIS B 76 18.278 23.105 5.247 1.00 0.19 B -ATOM 3436 H HIS B 76 17.721 26.684 6.936 1.00 0.15 B -ATOM 3437 HA HIS B 76 18.155 24.745 8.992 1.00 0.16 B -ATOM 3438 1HB HIS B 76 20.052 26.356 7.239 1.00 0.15 B -ATOM 3439 2HB HIS B 76 20.596 25.086 8.349 1.00 0.16 B -ATOM 3440 HD2 HIS B 76 17.424 24.966 5.986 1.00 0.17 B -ATOM 3441 HE1 HIS B 76 19.776 21.597 5.145 1.00 0.21 B -ATOM 3442 N LEU B 77 18.922 27.789 9.794 1.00 0.12 B -ATOM 3443 CA LEU B 77 19.387 28.553 10.985 1.00 0.11 B -ATOM 3444 C LEU B 77 18.312 28.674 12.023 1.00 0.11 B -ATOM 3445 O LEU B 77 18.603 28.822 13.199 1.00 0.11 B -ATOM 3446 CB LEU B 77 19.939 29.927 10.535 1.00 0.10 B -ATOM 3447 CG LEU B 77 21.229 29.750 9.700 1.00 0.11 B -ATOM 3448 CD1 LEU B 77 21.642 31.122 9.180 1.00 0.10 B -ATOM 3449 CD2 LEU B 77 22.399 29.243 10.560 1.00 0.11 B -ATOM 3450 H LEU B 77 18.682 28.265 8.967 1.00 0.12 B -ATOM 3451 HA LEU B 77 20.172 28.001 11.462 1.00 0.12 B -ATOM 3452 1HB LEU B 77 19.197 30.433 9.932 1.00 0.10 B -ATOM 3453 2HB LEU B 77 20.162 30.527 11.402 1.00 0.10 B -ATOM 3454 HG LEU B 77 21.046 29.073 8.872 1.00 0.12 B -ATOM 3455 1HD1 LEU B 77 20.829 31.564 8.630 1.00 0.10 B -ATOM 3456 2HD1 LEU B 77 22.506 31.019 8.541 1.00 0.11 B -ATOM 3457 3HD1 LEU B 77 21.893 31.751 10.023 1.00 0.10 B -ATOM 3458 1HD2 LEU B 77 23.329 29.402 10.028 1.00 0.12 B -ATOM 3459 2HD2 LEU B 77 22.291 28.193 10.768 1.00 0.12 B -ATOM 3460 3HD2 LEU B 77 22.424 29.799 11.486 1.00 0.10 B -ATOM 3461 N VAL B 78 17.091 28.596 11.620 1.00 0.11 B -ATOM 3462 CA VAL B 78 16.008 28.692 12.580 1.00 0.12 B -ATOM 3463 C VAL B 78 16.003 27.377 13.351 1.00 0.13 B -ATOM 3464 O VAL B 78 15.791 27.343 14.554 1.00 0.13 B -ATOM 3465 CB VAL B 78 14.735 28.939 11.757 1.00 0.12 B -ATOM 3466 CG1 VAL B 78 13.539 28.310 12.469 1.00 0.13 B -ATOM 3467 CG2 VAL B 78 14.463 30.445 11.623 1.00 0.11 B -ATOM 3468 H VAL B 78 16.889 28.468 10.669 1.00 0.12 B -ATOM 3469 HA VAL B 78 16.182 29.506 13.268 1.00 0.11 B -ATOM 3470 HB VAL B 78 14.849 28.499 10.774 1.00 0.12 B -ATOM 3471 1HG1 VAL B 78 12.624 28.657 12.012 1.00 0.13 B -ATOM 3472 2HG1 VAL B 78 13.556 28.604 13.509 1.00 0.13 B -ATOM 3473 3HG1 VAL B 78 13.597 27.237 12.395 1.00 0.14 B -ATOM 3474 1HG2 VAL B 78 13.447 30.586 11.307 1.00 0.12 B -ATOM 3475 2HG2 VAL B 78 15.127 30.877 10.895 1.00 0.11 B -ATOM 3476 3HG2 VAL B 78 14.602 30.929 12.580 1.00 0.11 B -ATOM 3477 N LYS B 79 16.249 26.299 12.641 1.00 0.14 B -ATOM 3478 CA LYS B 79 16.268 24.971 13.286 1.00 0.15 B -ATOM 3479 C LYS B 79 17.490 24.920 14.197 1.00 0.15 B -ATOM 3480 O LYS B 79 17.394 24.574 15.362 1.00 0.16 B -ATOM 3481 CB LYS B 79 16.265 23.894 12.222 1.00 0.17 B -ATOM 3482 CG LYS B 79 16.173 22.539 12.911 1.00 0.18 B -ATOM 3483 CD LYS B 79 15.783 21.467 11.871 1.00 0.20 B -ATOM 3484 CE LYS B 79 16.881 20.402 11.748 1.00 0.21 B -ATOM 3485 NZ LYS B 79 17.160 20.233 10.304 1.00 0.21 B -ATOM 3486 H LYS B 79 16.416 26.388 11.677 1.00 0.14 B -ATOM 3487 HA LYS B 79 15.386 24.860 13.897 1.00 0.16 B -ATOM 3488 1HB LYS B 79 15.406 24.040 11.578 1.00 0.17 B -ATOM 3489 2HB LYS B 79 17.171 23.947 11.636 1.00 0.16 B -ATOM 3490 1HG LYS B 79 17.129 22.317 13.359 1.00 0.18 B -ATOM 3491 2HG LYS B 79 15.427 22.571 13.692 1.00 0.18 B -ATOM 3492 1HD LYS B 79 14.851 21.000 12.163 1.00 0.20 B -ATOM 3493 2HD LYS B 79 15.640 21.927 10.898 1.00 0.19 B -ATOM 3494 1HE LYS B 79 17.787 20.713 12.250 1.00 0.20 B -ATOM 3495 2HE LYS B 79 16.540 19.469 12.169 1.00 0.22 B -ATOM 3496 1HZ LYS B 79 16.263 20.263 9.778 1.00 0.21 B -ATOM 3497 2HZ LYS B 79 17.632 19.326 10.143 1.00 0.22 B -ATOM 3498 3HZ LYS B 79 17.771 21.012 9.980 1.00 0.20 B -ATOM 3499 N LEU B 80 18.638 25.300 13.704 1.00 0.15 B -ATOM 3500 CA LEU B 80 19.809 25.322 14.581 1.00 0.15 B -ATOM 3501 C LEU B 80 19.541 26.193 15.829 1.00 0.14 B -ATOM 3502 O LEU B 80 19.814 25.796 16.949 1.00 0.15 B -ATOM 3503 CB LEU B 80 20.977 25.916 13.778 1.00 0.14 B -ATOM 3504 CG LEU B 80 22.248 25.864 14.593 1.00 0.14 B -ATOM 3505 CD1 LEU B 80 22.514 24.445 15.113 1.00 0.16 B -ATOM 3506 CD2 LEU B 80 23.416 26.304 13.731 1.00 0.14 B -ATOM 3507 H LEU B 80 18.721 25.579 12.765 1.00 0.14 B -ATOM 3508 HA LEU B 80 20.038 24.325 14.889 1.00 0.16 B -ATOM 3509 1HB LEU B 80 21.117 25.351 12.870 1.00 0.14 B -ATOM 3510 2HB LEU B 80 20.756 26.945 13.529 1.00 0.13 B -ATOM 3511 HG LEU B 80 22.133 26.530 15.379 1.00 0.14 B -ATOM 3512 1HD1 LEU B 80 21.872 24.240 15.947 1.00 0.16 B -ATOM 3513 2HD1 LEU B 80 23.543 24.353 15.418 1.00 0.16 B -ATOM 3514 3HD1 LEU B 80 22.312 23.736 14.331 1.00 0.17 B -ATOM 3515 1HD2 LEU B 80 23.257 27.319 13.404 1.00 0.13 B -ATOM 3516 2HD2 LEU B 80 23.485 25.652 12.877 1.00 0.15 B -ATOM 3517 3HD2 LEU B 80 24.331 26.246 14.305 1.00 0.14 B -ATOM 3518 N MET B 81 19.009 27.376 15.650 1.00 0.13 B -ATOM 3519 CA MET B 81 18.772 28.275 16.803 1.00 0.12 B -ATOM 3520 C MET B 81 17.807 27.701 17.833 1.00 0.13 B -ATOM 3521 O MET B 81 17.933 27.941 19.021 1.00 0.14 B -ATOM 3522 CB MET B 81 18.237 29.656 16.365 1.00 0.11 B -ATOM 3523 CG MET B 81 18.560 30.632 17.519 1.00 0.11 B -ATOM 3524 SD MET B 81 18.693 32.312 16.876 1.00 0.09 B -ATOM 3525 CE MET B 81 20.484 32.566 17.066 1.00 0.09 B -ATOM 3526 H MET B 81 18.775 27.669 14.752 1.00 0.12 B -ATOM 3527 HA MET B 81 19.714 28.415 17.296 1.00 0.12 B -ATOM 3528 1HB MET B 81 18.726 29.978 15.453 1.00 0.10 B -ATOM 3529 2HB MET B 81 17.167 29.616 16.212 1.00 0.11 B -ATOM 3530 1HG MET B 81 17.774 30.582 18.257 1.00 0.11 B -ATOM 3531 2HG MET B 81 19.498 30.360 17.992 1.00 0.11 B -ATOM 3532 1HE MET B 81 20.730 33.570 16.748 1.00 0.09 B -ATOM 3533 2HE MET B 81 21.026 31.859 16.457 1.00 0.09 B -ATOM 3534 3HE MET B 81 20.764 32.435 18.102 1.00 0.10 B -ATOM 3535 N ALA B 82 16.837 26.983 17.400 1.00 0.14 B -ATOM 3536 CA ALA B 82 15.837 26.413 18.361 1.00 0.15 B -ATOM 3537 C ALA B 82 16.461 25.188 19.064 1.00 0.17 B -ATOM 3538 O ALA B 82 16.140 24.892 20.199 1.00 0.18 B -ATOM 3539 CB ALA B 82 14.538 26.054 17.626 1.00 0.16 B -ATOM 3540 H ALA B 82 16.751 26.816 16.441 1.00 0.14 B -ATOM 3541 HA ALA B 82 15.612 27.152 19.117 1.00 0.15 B -ATOM 3542 1HB ALA B 82 14.159 26.931 17.119 1.00 0.15 B -ATOM 3543 2HB ALA B 82 13.804 25.712 18.341 1.00 0.17 B -ATOM 3544 3HB ALA B 82 14.731 25.276 16.906 1.00 0.16 B -ATOM 3545 N GLU B 83 17.366 24.497 18.390 1.00 0.17 B -ATOM 3546 CA GLU B 83 18.059 23.308 18.950 1.00 0.19 B -ATOM 3547 C GLU B 83 19.156 23.708 19.954 1.00 0.19 B -ATOM 3548 O GLU B 83 19.446 23.005 20.896 1.00 0.20 B -ATOM 3549 CB GLU B 83 18.873 22.627 17.841 1.00 0.19 B -ATOM 3550 CG GLU B 83 18.067 21.572 17.098 1.00 0.20 B -ATOM 3551 CD GLU B 83 18.747 21.236 15.761 1.00 0.20 B -ATOM 3552 OE1 GLU B 83 19.692 21.925 15.393 1.00 0.19 B -ATOM 3553 OE2 GLU B 83 18.303 20.297 15.124 1.00 0.21 B -ATOM 3554 H GLU B 83 17.604 24.775 17.490 1.00 0.16 B -ATOM 3555 HA GLU B 83 17.327 22.619 19.351 1.00 0.20 B -ATOM 3556 1HB GLU B 83 19.198 23.381 17.142 1.00 0.18 B -ATOM 3557 2HB GLU B 83 19.751 22.148 18.267 1.00 0.20 B -ATOM 3558 1HG GLU B 83 18.023 20.678 17.704 1.00 0.21 B -ATOM 3559 2HG GLU B 83 17.074 21.937 16.916 1.00 0.20 B -ATOM 3560 N LEU B 84 19.834 24.791 19.676 1.00 0.17 B -ATOM 3561 CA LEU B 84 20.966 25.223 20.523 1.00 0.17 B -ATOM 3562 C LEU B 84 20.582 25.387 22.015 1.00 0.18 B -ATOM 3563 O LEU B 84 19.632 26.008 22.441 1.00 0.18 B -ATOM 3564 CB LEU B 84 21.588 26.445 19.840 1.00 0.16 B -ATOM 3565 CG LEU B 84 22.725 26.110 18.848 1.00 0.16 B -ATOM 3566 CD1 LEU B 84 22.733 24.651 18.365 1.00 0.17 B -ATOM 3567 CD2 LEU B 84 22.539 27.020 17.654 1.00 0.14 B -ATOM 3568 H LEU B 84 19.614 25.315 18.875 1.00 0.16 B -ATOM 3569 HA LEU B 84 21.688 24.444 20.575 1.00 0.18 B -ATOM 3570 1HB LEU B 84 20.797 26.964 19.316 1.00 0.15 B -ATOM 3571 2HB LEU B 84 21.978 27.104 20.600 1.00 0.15 B -ATOM 3572 HG LEU B 84 23.674 26.324 19.303 1.00 0.16 B -ATOM 3573 1HD1 LEU B 84 21.737 24.355 18.077 1.00 0.17 B -ATOM 3574 2HD1 LEU B 84 23.094 24.003 19.143 1.00 0.18 B -ATOM 3575 3HD1 LEU B 84 23.398 24.570 17.535 1.00 0.17 B -ATOM 3576 1HD2 LEU B 84 21.612 26.771 17.189 1.00 0.14 B -ATOM 3577 2HD2 LEU B 84 23.349 26.884 16.964 1.00 0.14 B -ATOM 3578 3HD2 LEU B 84 22.497 28.045 17.972 1.00 0.13 B -ATOM 3579 N GLU B 85 21.427 24.691 22.731 1.00 0.19 B -ATOM 3580 CA GLU B 85 21.525 24.453 24.184 1.00 0.21 B -ATOM 3581 C GLU B 85 22.437 25.489 24.855 1.00 0.20 B -ATOM 3582 CB GLU B 85 22.141 23.025 24.360 1.00 0.22 B -ATOM 3583 CG GLU B 85 22.868 22.434 23.118 1.00 0.22 B -ATOM 3584 CD GLU B 85 24.090 23.197 22.572 1.00 0.21 B -ATOM 3585 OE1 GLU B 85 24.772 23.914 23.293 1.00 0.21 B -ATOM 3586 OE2 GLU B 85 24.340 22.985 21.394 1.00 0.21 B -ATOM 3587 H GLU B 85 22.091 24.246 22.217 1.00 0.20 B -ATOM 3588 HA GLU B 85 20.562 24.488 24.655 1.00 0.21 B -ATOM 3589 1HB GLU B 85 22.827 23.024 25.187 1.00 0.23 B -ATOM 3590 2HB GLU B 85 21.329 22.348 24.599 1.00 0.23 B -ATOM 3591 1HG GLU B 85 23.217 21.453 23.393 1.00 0.24 B -ATOM 3592 2HG GLU B 85 22.156 22.328 22.322 1.00 0.22 B -TER 3593 GLU B 385 -END diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/README.txt b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/README.txt deleted file mode 100644 index a938b25be..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/README.txt +++ /dev/null @@ -1,6 +0,0 @@ -################################################################################ -# Information about configuration files present in the same directory # -################################################################################ -"run-prodigy-prot-prot/data/configurations/raw_input.toml": An untouched copy of the raw input file, as provided by the user. -"run-prodigy-prot-prot/data/configurations/cleaned_input.toml": Pre-parsed input file where (eventually) some indexing and modifications were applied to ensure further processing. -"run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.toml": Final input file with detailed default parameters. diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/cleaned_input.toml b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/cleaned_input.toml deleted file mode 100644 index aebd2e0bd..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/cleaned_input.toml +++ /dev/null @@ -1,10 +0,0 @@ - -run_dir = "run-prodigy-prot-prot" -molecules = [ - "data/prot-prot.pdb", - "data/homotrimer.pdb", - ] -postprocess=false -clean=false -['topoaa.1'] -['prodigy.1'] diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.json b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.json deleted file mode 100644 index a099aa7b1..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.json +++ /dev/null @@ -1,65 +0,0 @@ -{ - "cns_exec": "", - "ncores": 4, - "max_cpus": true, - "mode": "local", - "batch_type": "slurm", - "queue": "", - "queue_limit": 100, - "concat": 1, - "self_contained": false, - "clean": false, - "offline": false, - "debug": false, - "preprocess": false, - "postprocess": false, - "run_dir": "run-prodigy-prot-prot", - "molecules": [ - "data/prot-prot.pdb", - "data/homotrimer.pdb" - ], - "topoaa.1": { - "molecules": [ - "data/prot-prot.pdb", - "data/homotrimer.pdb" - ], - "mol1": { - "cyclicpept": false, - "nhisd": 0, - "hisd_1": NaN, - "nhise": 0, - "hise_1": NaN - }, - "mol2": { - "cyclicpept": false, - "nhisd": 0, - "hisd_1": NaN, - "nhise": 0, - "hise_1": NaN - }, - "autohis": true, - "delenph": true, - "log_level": "quiet", - "iniseed": 917, - "ligand_param_fname": "", - "ligand_top_fname": "", - "limit": true, - "set_bfactor": true, - "tolerance": 0, - "cyclicpept_dist": 2.0, - "disulphide_dist": 2.2 - }, - "prodigy.1": { - "scoring_mode": "protein", - "chains": [ - "A", - "B" - ], - "ligand_resname": "UNK", - "ligand_chain": "B", - "distance_cutoff": NaN, - "accessibility_cutoff": 0.05, - "temperature": 25.0, - "to_pkd": true - } -} \ No newline at end of file diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.toml b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.toml deleted file mode 100644 index ea3a3d197..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/enhanced_haddock_params.toml +++ /dev/null @@ -1,54 +0,0 @@ -cns_exec = "" -ncores = 4 -max_cpus = true -mode = "local" -batch_type = "slurm" -queue = "" -queue_limit = 100 -concat = 1 -self_contained = false -clean = false -offline = false -debug = false -preprocess = false -postprocess = false -run_dir = "run-prodigy-prot-prot" -molecules = [ "data/prot-prot.pdb", "data/homotrimer.pdb",] - -["topoaa.1"] -molecules = [ "data/prot-prot.pdb", "data/homotrimer.pdb",] -autohis = true -delenph = true -log_level = "quiet" -iniseed = 917 -ligand_param_fname = "" -ligand_top_fname = "" -limit = true -set_bfactor = true -tolerance = 0 -cyclicpept_dist = 2.0 -disulphide_dist = 2.2 - -["prodigy.1"] -scoring_mode = "protein" -chains = [ "A", "B",] -ligand_resname = "UNK" -ligand_chain = "B" -distance_cutoff = nan -accessibility_cutoff = 0.05 -temperature = 25.0 -to_pkd = true - -["topoaa.1".mol1] -cyclicpept = false -nhisd = 0 -hisd_1 = nan -nhise = 0 -hise_1 = nan - -["topoaa.1".mol2] -cyclicpept = false -nhisd = 0 -hisd_1 = nan -nhise = 0 -hise_1 = nan diff --git a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/raw_input.toml b/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/raw_input.toml deleted file mode 100644 index be7221384..000000000 --- a/examples/scoring/prodigy/run-prodigy-prot-prot/data/configurations/raw_input.toml +++ /dev/null @@ -1,10 +0,0 @@ - -run_dir = "run-prodigy-prot-prot" -molecules = [ - "data/prot-prot.pdb", - "data/homotrimer.pdb", - ] -postprocess=false -clean=false -[topoaa] -[prodigy] From b2eb9a848f25fe724f2788c77cd3f3a5ac5cb549 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Fri, 4 Oct 2024 14:25:35 +0200 Subject: [PATCH 09/16] double modules --- .../scoring/{prodigy => }/data/homotrimer.pdb | 0 .../{prodigy => }/data/ligand-prodrg.param | 0 .../{prodigy => }/data/ligand-prodrg.top | 0 .../scoring/{prodigy => }/data/prot-lig.pdb | 0 .../scoring/{prodigy => }/data/prot-prot.pdb | 0 .../prodigy-protein-ligand-test.cfg | 8 +- .../prodigy-protein-protein-test.cfg | 7 +- .../openmm/data/ambig-active-rigidbody.tbl | 149 + .../openmm/data/ligand-prodrg.param | 137 + .../thirdparty/openmm/data/ligand-prodrg.top | 161 + .../openmm/data/neuraminidase-2BAT.pdb | 3023 +++++++++++++++++ .../openmm/data/oseltamivir_zwitterion.pdb | 101 + .../thirdparty/openmm/openmm-ligand-test.cfg | 45 + src/haddock/libs/libprodigy.py | 176 + .../modules/scoring/prodigy/prodigy.py | 317 -- .../{prodigy => prodigyligand}/__init__.py | 0 .../{prodigy => prodigyligand}/defaults.yaml | 0 .../modules/scoring/prodigyligand/prodigy.py | 76 + .../scoring/prodigyprotein/__init__.py | 83 + .../scoring/prodigyprotein/defaults.yaml | 51 + .../modules/scoring/prodigyprotein/prodigy.py | 53 + 21 files changed, 4063 insertions(+), 324 deletions(-) rename examples/scoring/{prodigy => }/data/homotrimer.pdb (100%) rename examples/scoring/{prodigy => }/data/ligand-prodrg.param (100%) rename examples/scoring/{prodigy => }/data/ligand-prodrg.top (100%) rename examples/scoring/{prodigy => }/data/prot-lig.pdb (100%) rename examples/scoring/{prodigy => }/data/prot-prot.pdb (100%) rename examples/scoring/{prodigy => }/prodigy-protein-ligand-test.cfg (67%) rename examples/scoring/{prodigy => }/prodigy-protein-protein-test.cfg (74%) create mode 100644 examples/thirdparty/openmm/data/ambig-active-rigidbody.tbl create mode 100644 examples/thirdparty/openmm/data/ligand-prodrg.param create mode 100644 examples/thirdparty/openmm/data/ligand-prodrg.top create mode 100644 examples/thirdparty/openmm/data/neuraminidase-2BAT.pdb create mode 100644 examples/thirdparty/openmm/data/oseltamivir_zwitterion.pdb create mode 100644 examples/thirdparty/openmm/openmm-ligand-test.cfg create mode 100644 src/haddock/libs/libprodigy.py delete mode 100644 src/haddock/modules/scoring/prodigy/prodigy.py rename src/haddock/modules/scoring/{prodigy => prodigyligand}/__init__.py (100%) rename src/haddock/modules/scoring/{prodigy => prodigyligand}/defaults.yaml (100%) create mode 100644 src/haddock/modules/scoring/prodigyligand/prodigy.py create mode 100644 src/haddock/modules/scoring/prodigyprotein/__init__.py create mode 100644 src/haddock/modules/scoring/prodigyprotein/defaults.yaml create mode 100644 src/haddock/modules/scoring/prodigyprotein/prodigy.py diff --git a/examples/scoring/prodigy/data/homotrimer.pdb b/examples/scoring/data/homotrimer.pdb similarity index 100% rename from examples/scoring/prodigy/data/homotrimer.pdb rename to examples/scoring/data/homotrimer.pdb diff --git a/examples/scoring/prodigy/data/ligand-prodrg.param b/examples/scoring/data/ligand-prodrg.param similarity index 100% rename from examples/scoring/prodigy/data/ligand-prodrg.param rename to examples/scoring/data/ligand-prodrg.param diff --git a/examples/scoring/prodigy/data/ligand-prodrg.top b/examples/scoring/data/ligand-prodrg.top similarity index 100% rename from examples/scoring/prodigy/data/ligand-prodrg.top rename to examples/scoring/data/ligand-prodrg.top diff --git a/examples/scoring/prodigy/data/prot-lig.pdb b/examples/scoring/data/prot-lig.pdb similarity index 100% rename from examples/scoring/prodigy/data/prot-lig.pdb rename to examples/scoring/data/prot-lig.pdb diff --git a/examples/scoring/prodigy/data/prot-prot.pdb b/examples/scoring/data/prot-prot.pdb similarity index 100% rename from examples/scoring/prodigy/data/prot-prot.pdb rename to examples/scoring/data/prot-prot.pdb diff --git a/examples/scoring/prodigy/prodigy-protein-ligand-test.cfg b/examples/scoring/prodigy-protein-ligand-test.cfg similarity index 67% rename from examples/scoring/prodigy/prodigy-protein-ligand-test.cfg rename to examples/scoring/prodigy-protein-ligand-test.cfg index 8c0d6253b..d5dda2a7c 100644 --- a/examples/scoring/prodigy/prodigy-protein-ligand-test.cfg +++ b/examples/scoring/prodigy-protein-ligand-test.cfg @@ -1,4 +1,4 @@ -run_dir = "run-prodigy-prot-lig" +run_dir = "run-prodigy-lig" molecules = "data/prot-lig.pdb" [topoaa] @@ -6,7 +6,7 @@ ligand_param_fname = "data/ligand-prodrg.param" ligand_top_fname = "data/ligand-prodrg.top" delenph = false -[prodigy] -scoring_mode = "ligand" +[prodigyligand] +receptor_chain = "A" +ligand_chain = "B" ligand_resname = "G39" - diff --git a/examples/scoring/prodigy/prodigy-protein-protein-test.cfg b/examples/scoring/prodigy-protein-protein-test.cfg similarity index 74% rename from examples/scoring/prodigy/prodigy-protein-protein-test.cfg rename to examples/scoring/prodigy-protein-protein-test.cfg index be7221384..9619e6737 100644 --- a/examples/scoring/prodigy/prodigy-protein-protein-test.cfg +++ b/examples/scoring/prodigy-protein-protein-test.cfg @@ -4,7 +4,8 @@ molecules = [ "data/prot-prot.pdb", "data/homotrimer.pdb", ] -postprocess=false -clean=false + [topoaa] -[prodigy] + +[prodigyprotein] + diff --git a/examples/thirdparty/openmm/data/ambig-active-rigidbody.tbl b/examples/thirdparty/openmm/data/ambig-active-rigidbody.tbl new file mode 100644 index 000000000..82b883e67 --- /dev/null +++ b/examples/thirdparty/openmm/data/ambig-active-rigidbody.tbl @@ -0,0 +1,149 @@ +! HADDOCK AIR restraints +! HADDOCK AIR restraints for 1st selection +! +assign ( resid 151 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 152 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 348 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 276 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 156 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 292 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 277 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 222 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 371 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 246 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 406 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 179 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 178 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 227 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 294 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 224 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 119 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + +assign ( resid 118 and segid A) + ( + ( resid 500 and segid B) + ) 2.0 2.0 0.0 + + +! HADDOCK AIR restraints for 2nd selection +! +assign ( resid 500 and segid B) + ( + ( resid 151 and segid A) + or + ( resid 152 and segid A) + or + ( resid 348 and segid A) + or + ( resid 276 and segid A) + or + ( resid 156 and segid A) + or + ( resid 292 and segid A) + or + ( resid 277 and segid A) + or + ( resid 222 and segid A) + or + ( resid 371 and segid A) + or + ( resid 246 and segid A) + or + ( resid 406 and segid A) + or + ( resid 179 and segid A) + or + ( resid 178 and segid A) + or + ( resid 227 and segid A) + or + ( resid 294 and segid A) + or + ( resid 224 and segid A) + or + ( resid 119 and segid A) + or + ( resid 118 and segid A) + ) 2.0 2.0 0.0 + + +! HADDOCK AIR restraints for 3rd selection +! + +! HADDOCK AIR restraints for 4th selection +! + +! HADDOCK AIR restraints for 5th selection +! + +! HADDOCK AIR restraints for 6th selection +! + + diff --git a/examples/thirdparty/openmm/data/ligand-prodrg.param b/examples/thirdparty/openmm/data/ligand-prodrg.param new file mode 100644 index 000000000..74de15e0d --- /dev/null +++ b/examples/thirdparty/openmm/data/ligand-prodrg.param @@ -0,0 +1,137 @@ +! Put in this file your ligand parameters if needed +! +! +! This file was generated by PRODRG version 070118.0614 +! PRODRG written/copyrighted by Daan van Aalten +! and Alexander Schuettelkopf +! +! Questions/comments to dava@davapc1.bioch.dundee.ac.uk +! +! When using this software in a publication, cite: +! A. W. Schuettelkopf and D. M. F. van Aalten (2004). +! PRODRG - a tool for high-throughput crystallography +! of protein-ligand complexes. +! Acta Crystallogr. D60, 1355--1363. +! +! +! *** NOTE *** IF YOU USE MORE THAN ONE PRODRG-GENERATED TOPOLOGY IN CNS, +! PLEASE CAREFULLY READ THE FAQ AS THIS MAY CAUSE PROBLEMS +! +! +set echo=off message=on end + +evaluate ($pd_x = 1.0) + +eval ($pd_v=$pd_x* 16000.0) BOND CA82 CA81 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND CA81 CA8 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND CA8 CA9 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND CA8 OA7 $pd_v 1.435 +eval ($pd_v=$pd_x* 16000.0) BOND CA9 CA91 $pd_v 1.530 +eval ($pd_v=$pd_x* 12000.0) BOND OA7 CA6 $pd_v 1.435 +eval ($pd_v=$pd_x* 20000.0) BOND CA6 CA7 $pd_v 1.390 +eval ($pd_v=$pd_x* 16000.0) BOND CA6 CA5 $pd_v 1.530 +eval ($pd_v=$pd_x* 20000.0) BOND CA7 CA2 $pd_v 1.390 +eval ($pd_v=$pd_x* 16000.0) BOND CA2 CA1 $pd_v 1.530 +eval ($pd_v=$pd_x* 16000.0) BOND CA2 CA3 $pd_v 1.530 +eval ($pd_v=$pd_x* 20000.0) BOND CA1 OA1B $pd_v 1.250 +eval ($pd_v=$pd_x* 20000.0) BOND CA1 OA1A $pd_v 1.250 +eval ($pd_v=$pd_x* 16000.0) BOND CA3 CA4 $pd_v 1.530 +eval ($pd_v=$pd_x* 18000.0) BOND CA4 NA4 $pd_v 1.470 +eval ($pd_v=$pd_x* 16000.0) BOND CA4 CA5 $pd_v 1.530 +eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAB $pd_v 1.000 +eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAC $pd_v 1.000 +eval ($pd_v=$pd_x* 17900.0) BOND NA4 HAAA $pd_v 1.000 +eval ($pd_v=$pd_x* 18000.0) BOND CA5 NA5 $pd_v 1.470 +eval ($pd_v=$pd_x* 17900.0) BOND NA5 HAAD $pd_v 1.000 +eval ($pd_v=$pd_x* 20000.0) BOND NA5 CA10 $pd_v 1.330 +eval ($pd_v=$pd_x* 16000.0) BOND CA10 CA11 $pd_v 1.530 +eval ($pd_v=$pd_x* 24000.0) BOND CA10 OA10 $pd_v 1.230 + +eval ($pd_v=$pd_x* 880.0) ANGLE CA82 CA81 CA8 $pd_v 111.000 +eval ($pd_v=$pd_x* 480.0) ANGLE CA81 CA8 CA9 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE CA81 CA8 OA7 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE CA9 CA8 OA7 $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA8 CA9 CA91 $pd_v 111.000 +eval ($pd_v=$pd_x* 640.0) ANGLE CA8 OA7 CA6 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE OA7 CA6 CA7 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE OA7 CA6 CA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 544.0) ANGLE CA7 CA6 CA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 800.0) ANGLE CA6 CA7 CA2 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA7 CA2 CA1 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA7 CA2 CA3 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA1 CA2 CA3 $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA2 CA1 OA1B $pd_v 120.000 +eval ($pd_v=$pd_x* 800.0) ANGLE CA2 CA1 OA1A $pd_v 120.000 +eval ($pd_v=$pd_x* 960.0) ANGLE OA1B CA1 OA1A $pd_v 126.000 +eval ($pd_v=$pd_x* 880.0) ANGLE CA2 CA3 CA4 $pd_v 111.000 +eval ($pd_v=$pd_x* 880.0) ANGLE CA3 CA4 NA4 $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA3 CA4 CA5 $pd_v 111.000 +eval ($pd_v=$pd_x* 880.0) ANGLE NA4 CA4 CA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAB $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAC $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA4 NA4 HAAA $pd_v 109.500 +eval ($pd_v=$pd_x* 640.0) ANGLE HAAB NA4 HAAC $pd_v 109.500 +eval ($pd_v=$pd_x* 640.0) ANGLE HAAB NA4 HAAA $pd_v 109.500 +eval ($pd_v=$pd_x* 640.0) ANGLE HAAC NA4 HAAA $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA6 CA5 CA4 $pd_v 111.000 +eval ($pd_v=$pd_x* 880.0) ANGLE CA6 CA5 NA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 880.0) ANGLE CA4 CA5 NA5 $pd_v 109.500 +eval ($pd_v=$pd_x* 720.0) ANGLE CA5 NA5 HAAD $pd_v 115.000 +eval ($pd_v=$pd_x* 960.0) ANGLE CA5 NA5 CA10 $pd_v 122.000 +eval ($pd_v=$pd_x* 560.0) ANGLE HAAD NA5 CA10 $pd_v 123.000 +eval ($pd_v=$pd_x* 960.0) ANGLE NA5 CA10 CA11 $pd_v 115.000 +eval ($pd_v=$pd_x* 960.0) ANGLE NA5 CA10 OA10 $pd_v 124.000 +eval ($pd_v=$pd_x* 960.0) ANGLE CA11 CA10 OA10 $pd_v 121.000 + +eval ($pd_v=$pd_x* 800.0) IMPR CA2 CA7 CA3 CA1 $pd_v 0 0.000 +eval ($pd_v=$pd_x* 800.0) IMPR CA1 CA2 OA1A OA1B $pd_v 0 0.000 +eval ($pd_v=$pd_x* 800.0) IMPR NA5 CA5 HAAD CA10 $pd_v 0 0.000 +eval ($pd_v=$pd_x* 800.0) IMPR CA10 NA5 CA11 OA10 $pd_v 0 0.000 +eval ($pd_v=$pd_x* 400.0) IMPR CA8 CA81 CA9 OA7 $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR CA6 OA7 CA7 CA5 $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR CA4 CA3 NA4 CA5 $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR NA4 CA4 HAAC HAAB $pd_v 0 35.264 +eval ($pd_v=$pd_x* 400.0) IMPR CA5 CA6 NA5 CA4 $pd_v 0 35.264 + +eval ($pd_v=$pd_x* 19.6) DIHE OA7 CA8 CA81 CA82 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 19.6) DIHE CA81 CA8 CA9 CA91 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 8.1) DIHE CA81 CA8 OA7 CA6 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 8.1) DIHE CA5 CA6 OA7 CA8 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 1000.0) DIHE OA7 CA6 CA7 CA2 $pd_v 2 180.000 +eval ($pd_v=$pd_x* 19.6) DIHE OA7 CA6 CA5 NA5 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 1000.0) DIHE CA3 CA2 CA7 CA6 $pd_v 2 180.000 +eval ($pd_v=$pd_x* 19.6) DIHE CA7 CA2 CA1 OA1A $pd_v 2 180.000 +eval ($pd_v=$pd_x* 0.1) DIHE CA7 CA2 CA3 CA4 $pd_v 6 0.000 +eval ($pd_v=$pd_x* 19.6) DIHE CA2 CA3 CA4 CA5 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 8.1) DIHE CA3 CA4 NA4 HAAA $pd_v 3 0.000 +eval ($pd_v=$pd_x* 19.6) DIHE NA5 CA5 CA4 CA3 $pd_v 3 0.000 +eval ($pd_v=$pd_x* 0.1) DIHE CA6 CA5 NA5 CA10 $pd_v 6 180.000 +eval ($pd_v=$pd_x* 640.0) DIHE OA10 CA10 NA5 CA5 $pd_v 2 180.000 + + +NONBONDED CA82 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA81 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA8 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA9 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA91 0.10000 3.29633 0.10000 3.02906 +NONBONDED OA7 0.10000 2.58361 0.10000 2.31634 +NONBONDED CA6 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA7 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA2 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA1 0.10000 3.29633 0.10000 3.02906 +NONBONDED OA1B 0.10000 2.58361 0.10000 2.31634 +NONBONDED OA1A 0.10000 2.58361 0.10000 2.31634 +NONBONDED CA3 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA4 0.10000 3.29633 0.10000 3.02906 +NONBONDED NA4 0.10000 2.67270 0.10000 2.40543 +NONBONDED HAAB 0.10000 1.42544 0.10000 1.15817 +NONBONDED HAAC 0.10000 1.42544 0.10000 1.15817 +NONBONDED HAAA 0.10000 1.42544 0.10000 1.15817 +NONBONDED CA5 0.10000 3.29633 0.10000 3.02906 +NONBONDED NA5 0.10000 2.67270 0.10000 2.40543 +NONBONDED HAAD 0.10000 1.42544 0.10000 1.15817 +NONBONDED CA10 0.10000 3.29633 0.10000 3.02906 +NONBONDED CA11 0.10000 3.29633 0.10000 3.02906 +NONBONDED OA10 0.10000 2.58361 0.10000 2.31634 + +set echo=on message=on end diff --git a/examples/thirdparty/openmm/data/ligand-prodrg.top b/examples/thirdparty/openmm/data/ligand-prodrg.top new file mode 100644 index 000000000..9f58ce52d --- /dev/null +++ b/examples/thirdparty/openmm/data/ligand-prodrg.top @@ -0,0 +1,161 @@ +! Put in this file your ligand topology if needed +! +! +! This file was generated by PRODRG version 070118.0614 +! PRODRG written/copyrighted by Daan van Aalten +! and Alexander Schuettelkopf +! +! Questions/comments to dava@davapc1.bioch.dundee.ac.uk +! +! When using this software in a publication, cite: +! A. W. Schuettelkopf and D. M. F. van Aalten (2004). +! PRODRG - a tool for high-throughput crystallography +! of protein-ligand complexes. +! Acta Crystallogr. D60, 1355--1363. +! +! +! *** NOTE *** IF YOU USE MORE THAN ONE PRODRG-GENERATED TOPOLOGY IN CNS, +! PLEASE CAREFULLY READ THE FAQ AS THIS MAY CAUSE PROBLEMS +! +! +set echo=false end +AUTOGENERATE ANGLES=FALSE END +MASS CA82 15.0350 ! equivalent to CH3 +MASS CA81 14.0270 ! equivalent to CH2 +MASS CA8 13.0190 ! equivalent to CS1 +MASS CA9 14.0270 ! equivalent to CH2 +MASS CA91 15.0350 ! equivalent to CH3 +MASS OA7 15.9994 ! equivalent to OS +MASS CA6 13.0190 ! equivalent to CS1 +MASS CA7 13.0190 ! equivalent to CR61 +MASS CA2 12.0110 ! equivalent to CB +MASS CA1 12.0110 ! equivalent to C +MASS OA1B 15.9994 ! equivalent to OM +MASS OA1A 15.9994 ! equivalent to OM +MASS CA3 14.0270 ! equivalent to CH2 +MASS CA4 13.0190 ! equivalent to CH1 +MASS NA4 14.0067 ! equivalent to NL +MASS HAAB 1.0080 ! equivalent to H +MASS HAAC 1.0080 ! equivalent to H +MASS HAAA 1.0080 ! equivalent to H +MASS CA5 13.0190 ! equivalent to CH1 +MASS NA5 14.0067 ! equivalent to N +MASS HAAD 1.0080 ! equivalent to H +MASS CA10 12.0110 ! equivalent to C +MASS CA11 15.0350 ! equivalent to CH3 +MASS OA10 15.9994 ! equivalent to O + +Residue G39 +GROUP + ATOM C82 TYPE= CA82 CHARGE= 0.024 END + ATOM C81 TYPE= CA81 CHARGE= 0.062 END + ATOM C8 TYPE= CA8 CHARGE= 0.211 END + ATOM C9 TYPE= CA9 CHARGE= 0.061 END + ATOM C91 TYPE= CA91 CHARGE= 0.024 END + ATOM O7 TYPE= OA7 CHARGE=-0.182 END + ATOM C6 TYPE= CA6 CHARGE= 0.211 END + ATOM C7 TYPE= CA7 CHARGE=-0.008 END + ATOM C2 TYPE= CA2 CHARGE=-0.022 END + ATOM C1 TYPE= CA1 CHARGE= 0.361 END + ATOM O1B TYPE= OA1B CHARGE=-0.756 END + ATOM O1A TYPE= OA1A CHARGE=-0.756 END + ATOM C3 TYPE= CA3 CHARGE= 0.062 END + ATOM C4 TYPE= CA4 CHARGE= 0.124 END + ATOM N4 TYPE= NA4 CHARGE= 0.646 END + ATOM HAB TYPE= HAAB CHARGE= 0.000 END + ATOM HAC TYPE= HAAC CHARGE= 0.001 END + ATOM HAA TYPE= HAAA CHARGE= 0.000 END + ATOM C5 TYPE= CA5 CHARGE= 0.124 END + ATOM N5 TYPE= NA5 CHARGE= 0.132 END + ATOM H07 TYPE= HAAD CHARGE= 0.000 END + ATOM C10 TYPE= CA10 CHARGE= 0.361 END + ATOM C11 TYPE= CA11 CHARGE= 0.024 END + ATOM O10 TYPE= OA10 CHARGE=-0.704 END + + BOND C82 C81 + BOND C81 C8 + BOND C8 C9 + BOND C8 O7 + BOND C9 C91 + BOND O7 C6 + BOND C6 C7 + BOND C6 C5 + BOND C7 C2 + BOND C2 C1 + BOND C2 C3 + BOND C1 O1B + BOND C1 O1A + BOND C3 C4 + BOND C4 N4 + BOND C4 C5 + BOND N4 HAB + BOND N4 HAC + BOND N4 HAA + BOND C5 N5 + BOND N5 H07 + BOND N5 C10 + BOND C10 C11 + BOND C10 O10 + + ANGLE C82 C81 C8 + ANGLE C81 C8 C9 + ANGLE C81 C8 O7 + ANGLE C9 C8 O7 + ANGLE C8 C9 C91 + ANGLE C8 O7 C6 + ANGLE O7 C6 C7 + ANGLE O7 C6 C5 + ANGLE C7 C6 C5 + ANGLE C6 C7 C2 + ANGLE C7 C2 C1 + ANGLE C7 C2 C3 + ANGLE C1 C2 C3 + ANGLE C2 C1 O1B + ANGLE C2 C1 O1A + ANGLE O1B C1 O1A + ANGLE C2 C3 C4 + ANGLE C3 C4 N4 + ANGLE C3 C4 C5 + ANGLE N4 C4 C5 + ANGLE C4 N4 HAB + ANGLE C4 N4 HAC + ANGLE C4 N4 HAA + ANGLE HAB N4 HAC + ANGLE HAB N4 HAA + ANGLE HAC N4 HAA + ANGLE C6 C5 C4 + ANGLE C6 C5 N5 + ANGLE C4 C5 N5 + ANGLE C5 N5 H07 + ANGLE C5 N5 C10 + ANGLE H07 N5 C10 + ANGLE N5 C10 C11 + ANGLE N5 C10 O10 + ANGLE C11 C10 O10 + + IMPROPER C2 C7 C3 C1 + IMPROPER C1 C2 O1A O1B + IMPROPER N5 C5 H07 C10 + IMPROPER C10 N5 C11 O10 + IMPROPER C8 C81 C9 O7 + IMPROPER C6 O7 C7 C5 + IMPROPER C4 C3 N4 C5 + IMPROPER N4 C4 HAC HAB + IMPROPER C5 C6 N5 C4 + + DIHEDRAL O7 C8 C81 C82 + DIHEDRAL C81 C8 C9 C91 + DIHEDRAL C81 C8 O7 C6 + DIHEDRAL C5 C6 O7 C8 + DIHEDRAL O7 C6 C7 C2 + DIHEDRAL O7 C6 C5 N5 + DIHEDRAL C3 C2 C7 C6 + DIHEDRAL C7 C2 C1 O1A + DIHEDRAL C7 C2 C3 C4 + DIHEDRAL C2 C3 C4 C5 + DIHEDRAL C3 C4 N4 HAA + DIHEDRAL N5 C5 C4 C3 + DIHEDRAL C6 C5 N5 C10 + DIHEDRAL O10 C10 N5 C5 +END +set echo=true end diff --git a/examples/thirdparty/openmm/data/neuraminidase-2BAT.pdb b/examples/thirdparty/openmm/data/neuraminidase-2BAT.pdb new file mode 100644 index 000000000..15587dedf --- /dev/null +++ b/examples/thirdparty/openmm/data/neuraminidase-2BAT.pdb @@ -0,0 +1,3023 @@ +ATOM 1 N VAL A 82 78.157 78.171 32.436 1.00 46.67 A N +ATOM 2 CA VAL A 82 78.442 78.998 33.594 1.00 46.67 A C +ATOM 3 C VAL A 82 79.558 79.832 33.006 1.00 46.39 A C +ATOM 4 O VAL A 82 80.351 79.289 32.234 1.00 47.14 A O +ATOM 5 CB VAL A 82 78.919 78.106 34.733 1.00 46.90 A C +ATOM 6 CG1 VAL A 82 79.274 78.906 35.964 1.00 47.69 A C +ATOM 7 CG2 VAL A 82 77.771 77.206 35.137 1.00 47.86 A C +ATOM 8 N GLU A 83 79.621 81.091 33.411 1.00 45.16 A N +ATOM 9 CA GLU A 83 80.563 82.058 32.904 1.00 42.65 A C +ATOM 10 C GLU A 83 81.111 82.824 34.075 1.00 39.46 A C +ATOM 11 O GLU A 83 80.550 82.776 35.170 1.00 40.30 A O +ATOM 12 CB GLU A 83 79.734 82.846 32.002 1.00 44.79 A C +ATOM 13 CG GLU A 83 80.201 83.932 31.107 1.00 48.80 A C +ATOM 14 CD GLU A 83 79.049 84.129 30.124 1.00 51.21 A C +ATOM 15 OE1 GLU A 83 77.974 84.621 30.518 1.00 52.16 A O +ATOM 16 OE2 GLU A 83 79.229 83.733 28.965 1.00 52.99 A O1- +ATOM 17 N TYR A 84 82.201 83.532 33.850 1.00 35.18 A N +ATOM 18 CA TYR A 84 82.815 84.288 34.910 1.00 30.30 A C +ATOM 19 C TYR A 84 82.135 85.627 35.167 1.00 29.16 A C +ATOM 20 O TYR A 84 81.645 86.303 34.249 1.00 27.30 A O +ATOM 21 CB TYR A 84 84.234 84.504 34.537 1.00 28.68 A C +ATOM 22 CG TYR A 84 85.172 83.337 34.698 1.00 26.30 A C +ATOM 23 CD1 TYR A 84 85.301 82.690 35.907 1.00 25.85 A C +ATOM 24 CD2 TYR A 84 85.984 83.012 33.652 1.00 25.41 A C +ATOM 25 CE1 TYR A 84 86.263 81.733 36.079 1.00 24.94 A C +ATOM 26 CE2 TYR A 84 86.946 82.051 33.824 1.00 25.57 A C +ATOM 27 CZ TYR A 84 87.077 81.432 35.032 1.00 25.24 A C +ATOM 28 OH TYR A 84 88.076 80.513 35.185 1.00 26.25 A O +ATOM 29 N ARG A 85 82.095 86.024 36.434 1.00 26.80 A N +ATOM 30 CA ARG A 85 81.491 87.287 36.781 1.00 26.22 A C +ATOM 31 C ARG A 85 82.446 88.354 36.323 1.00 27.88 A C +ATOM 32 O ARG A 85 83.655 88.228 36.553 1.00 29.80 A O +ATOM 33 CB ARG A 85 81.287 87.450 38.283 1.00 23.07 A C +ATOM 34 CG ARG A 85 80.186 86.537 38.739 1.00 21.27 A C +ATOM 35 CD ARG A 85 79.413 86.911 39.986 1.00 18.89 A C +ATOM 36 NE ARG A 85 80.124 86.706 41.219 1.00 17.28 A N +ATOM 37 CZ ARG A 85 79.478 86.779 42.386 1.00 17.52 A C +ATOM 38 NH1 ARG A 85 78.182 87.042 42.439 1.00 16.83 A N1+ +ATOM 39 NH2 ARG A 85 80.139 86.601 43.539 1.00 17.09 A N +ATOM 40 N ASN A 86 81.987 89.350 35.573 1.00 29.67 A N +ATOM 41 CA ASN A 86 82.879 90.434 35.146 1.00 30.79 A C +ATOM 42 C ASN A 86 82.426 91.760 35.751 1.00 29.77 A C +ATOM 43 O ASN A 86 82.970 92.805 35.423 1.00 30.43 A O +ATOM 44 CB ASN A 86 82.915 90.597 33.613 1.00 33.63 A C +ATOM 45 CG ASN A 86 81.631 91.079 32.937 1.00 36.82 A C +ATOM 46 OD1 ASN A 86 80.764 91.709 33.561 1.00 38.60 A O +ATOM 47 ND2 ASN A 86 81.473 90.861 31.625 1.00 39.45 A N +ATOM 48 N TRP A 87 81.371 91.786 36.571 1.00 28.33 A N +ATOM 49 CA TRP A 87 80.834 92.994 37.201 1.00 25.65 A C +ATOM 50 C TRP A 87 80.706 94.280 36.391 1.00 24.71 A C +ATOM 51 O TRP A 87 80.717 95.350 36.995 1.00 23.13 A O +ATOM 52 CB TRP A 87 81.659 93.288 38.442 1.00 24.83 A C +ATOM 53 CG TRP A 87 81.580 92.169 39.473 1.00 24.71 A C +ATOM 54 CD1 TRP A 87 82.612 91.271 39.575 1.00 25.03 A C +ATOM 55 CD2 TRP A 87 80.606 91.963 40.427 1.00 24.11 A C +ATOM 56 NE1 TRP A 87 82.311 90.501 40.597 1.00 25.49 A N +ATOM 57 CE2 TRP A 87 81.124 90.874 41.129 1.00 24.27 A C +ATOM 58 CE3 TRP A 87 79.399 92.531 40.783 1.00 23.14 A C +ATOM 59 CZ2 TRP A 87 80.450 90.353 42.211 1.00 23.83 A C +ATOM 60 CZ3 TRP A 87 78.719 92.010 41.868 1.00 23.16 A C +ATOM 61 CH2 TRP A 87 79.246 90.937 42.573 1.00 24.64 A C +ATOM 62 N SER A 88 80.537 94.267 35.066 1.00 23.42 A N +ATOM 63 CA SER A 88 80.442 95.522 34.380 1.00 24.92 A C +ATOM 64 C SER A 88 79.031 96.089 34.245 1.00 25.67 A C +ATOM 65 O SER A 88 78.360 95.976 33.213 1.00 26.71 A O +ATOM 66 CB SER A 88 81.099 95.374 33.013 1.00 25.08 A C +ATOM 67 OG SER A 88 80.543 94.319 32.243 1.00 27.87 A O +ATOM 68 N LYS A 89 78.526 96.711 35.305 1.00 24.96 A N +ATOM 69 CA LYS A 89 77.204 97.320 35.315 1.00 25.10 A C +ATOM 70 C LYS A 89 77.351 98.522 36.247 1.00 24.54 A C +ATOM 71 O LYS A 89 78.169 98.475 37.187 1.00 25.18 A O +ATOM 72 CB LYS A 89 76.150 96.412 35.910 1.00 26.03 A C +ATOM 73 CG LYS A 89 75.518 95.447 34.959 1.00 26.49 A C +ATOM 74 CD LYS A 89 74.563 94.571 35.731 1.00 26.27 A C +ATOM 75 CE LYS A 89 73.991 93.640 34.682 1.00 26.52 A C +ATOM 76 NZ LYS A 89 73.202 92.605 35.298 1.00 26.88 A N1+ +ATOM 77 N PRO A 90 76.639 99.631 36.017 1.00 22.63 A N +ATOM 78 CA PRO A 90 76.731 100.824 36.833 1.00 21.81 A C +ATOM 79 C PRO A 90 76.464 100.527 38.289 1.00 21.36 A C +ATOM 80 O PRO A 90 75.825 99.537 38.594 1.00 20.87 A O +ATOM 81 CB PRO A 90 75.706 101.720 36.286 1.00 23.21 A C +ATOM 82 CG PRO A 90 75.410 101.252 34.886 1.00 23.22 A C +ATOM 83 CD PRO A 90 75.686 99.777 34.926 1.00 22.95 A C +ATOM 84 N GLN A 91 76.923 101.299 39.253 1.00 21.98 A N +ATOM 85 CA GLN A 91 76.599 101.033 40.648 1.00 22.42 A C +ATOM 86 C GLN A 91 75.144 101.498 40.696 1.00 23.47 A C +ATOM 87 O GLN A 91 74.745 102.398 39.936 1.00 23.66 A O +ATOM 88 CB GLN A 91 77.463 101.889 41.539 1.00 21.47 A C +ATOM 89 CG GLN A 91 77.139 101.774 42.992 1.00 22.86 A C +ATOM 90 CD GLN A 91 78.089 102.589 43.838 1.00 25.27 A C +ATOM 91 OE1 GLN A 91 79.201 102.164 44.133 1.00 26.20 A O +ATOM 92 NE2 GLN A 91 77.752 103.779 44.310 1.00 26.55 A N +ATOM 93 N CYS A 92 74.264 100.898 41.466 1.00 24.37 A N +ATOM 94 CA CYS A 92 72.905 101.390 41.499 1.00 24.72 A C +ATOM 95 C CYS A 92 72.918 102.692 42.265 1.00 27.57 A C +ATOM 96 O CYS A 92 73.753 102.899 43.163 1.00 28.87 A O +ATOM 97 CB CYS A 92 71.976 100.518 42.255 1.00 23.48 A C +ATOM 98 SG CYS A 92 71.956 98.822 41.711 1.00 20.26 A S +ATOM 99 N GLN A 93 72.012 103.604 41.899 1.00 30.64 A N +ATOM 100 CA GLN A 93 71.892 104.879 42.603 1.00 32.50 A C +ATOM 101 C GLN A 93 71.166 104.523 43.874 1.00 31.87 A C +ATOM 102 O GLN A 93 70.222 103.728 43.828 1.00 33.68 A O +ATOM 103 CB GLN A 93 71.081 105.873 41.808 1.00 35.19 A C +ATOM 104 CG GLN A 93 72.036 106.670 40.924 1.00 38.87 A C +ATOM 105 CD GLN A 93 73.055 107.506 41.720 1.00 41.61 A C +ATOM 106 OE1 GLN A 93 73.049 107.637 42.959 1.00 42.78 A O +ATOM 107 NE2 GLN A 93 74.000 108.103 41.011 1.00 42.53 A N +ATOM 108 N ILE A 94 71.600 105.000 45.022 1.00 30.33 A N +ATOM 109 CA ILE A 94 70.893 104.600 46.200 1.00 28.40 A C +ATOM 110 C ILE A 94 70.562 105.872 46.932 1.00 27.59 A C +ATOM 111 O ILE A 94 71.243 106.893 46.814 1.00 28.59 A O +ATOM 112 CB ILE A 94 71.738 103.628 47.141 1.00 28.54 A C +ATOM 113 CG1 ILE A 94 72.885 104.338 47.801 1.00 28.08 A C +ATOM 114 CG2 ILE A 94 72.378 102.502 46.350 1.00 29.01 A C +ATOM 115 CD1 ILE A 94 73.091 103.690 49.188 1.00 26.88 A C +ATOM 116 N THR A 95 69.491 105.703 47.686 1.00 25.10 A N +ATOM 117 CA THR A 95 68.834 106.664 48.546 1.00 22.16 A C +ATOM 118 C THR A 95 69.204 106.456 49.995 1.00 19.78 A C +ATOM 119 O THR A 95 68.942 107.291 50.865 1.00 19.36 A O +ATOM 120 CB THR A 95 67.362 106.416 48.299 1.00 23.35 A C +ATOM 121 OG1 THR A 95 67.202 106.776 46.929 1.00 22.72 A O +ATOM 122 CG2 THR A 95 66.422 107.118 49.232 1.00 23.86 A C +ATOM 123 N GLY A 96 69.723 105.283 50.309 1.00 17.73 A N +ATOM 124 CA GLY A 96 70.065 104.913 51.689 1.00 16.85 A C +ATOM 125 C GLY A 96 69.964 103.377 51.744 1.00 18.43 A C +ATOM 126 O GLY A 96 69.924 102.705 50.682 1.00 16.96 A O +ATOM 127 N PHE A 97 69.858 102.816 52.936 1.00 16.54 A N +ATOM 128 CA PHE A 97 69.792 101.383 53.098 1.00 17.90 A C +ATOM 129 C PHE A 97 68.485 100.900 53.701 1.00 17.60 A C +ATOM 130 O PHE A 97 67.891 101.635 54.486 1.00 18.13 A O +ATOM 131 CB PHE A 97 70.998 100.965 53.957 1.00 17.73 A C +ATOM 132 CG PHE A 97 72.279 101.356 53.219 1.00 18.59 A C +ATOM 133 CD1 PHE A 97 72.816 100.492 52.288 1.00 18.68 A C +ATOM 134 CD2 PHE A 97 72.863 102.602 53.432 1.00 17.89 A C +ATOM 135 CE1 PHE A 97 73.922 100.878 51.571 1.00 18.38 A C +ATOM 136 CE2 PHE A 97 73.970 102.972 52.707 1.00 17.59 A C +ATOM 137 CZ PHE A 97 74.498 102.117 51.784 1.00 17.69 A C +ATOM 138 N ALA A 98 68.027 99.692 53.314 1.00 16.96 A N +ATOM 139 CA ALA A 98 66.802 99.047 53.769 1.00 17.22 A C +ATOM 140 C ALA A 98 67.159 97.768 54.548 1.00 16.89 A C +ATOM 141 O ALA A 98 68.199 97.195 54.218 1.00 17.24 A O +ATOM 142 CB ALA A 98 65.967 98.676 52.566 1.00 16.20 A C +ATOM 143 N PRO A 99 66.446 97.281 55.586 1.00 17.06 A N +ATOM 144 CA PRO A 99 66.804 96.072 56.354 1.00 17.28 A C +ATOM 145 C PRO A 99 66.894 94.830 55.460 1.00 18.53 A C +ATOM 146 O PRO A 99 66.112 94.672 54.499 1.00 20.09 A O +ATOM 147 CB PRO A 99 65.734 95.934 57.410 1.00 16.82 A C +ATOM 148 CG PRO A 99 65.091 97.291 57.448 1.00 16.75 A C +ATOM 149 CD PRO A 99 65.123 97.729 55.985 1.00 16.31 A C +ATOM 150 N PHE A 100 67.854 93.948 55.705 1.00 16.89 A N +ATOM 151 CA PHE A 100 67.951 92.786 54.852 1.00 16.79 A C +ATOM 152 C PHE A 100 68.012 91.494 55.631 1.00 15.97 A C +ATOM 153 O PHE A 100 67.294 90.593 55.208 1.00 14.69 A O +ATOM 154 CB PHE A 100 69.170 92.927 53.982 1.00 16.79 A C +ATOM 155 CG PHE A 100 69.315 91.905 52.871 1.00 17.27 A C +ATOM 156 CD1 PHE A 100 68.233 91.548 52.085 1.00 16.83 A C +ATOM 157 CD2 PHE A 100 70.566 91.345 52.639 1.00 16.78 A C +ATOM 158 CE1 PHE A 100 68.413 90.613 51.075 1.00 16.75 A C +ATOM 159 CE2 PHE A 100 70.731 90.420 51.630 1.00 15.50 A C +ATOM 160 CZ PHE A 100 69.659 90.065 50.849 1.00 16.84 A C +ATOM 161 N SER A 101 68.773 91.317 56.723 1.00 14.45 A N +ATOM 162 CA SER A 101 68.779 90.057 57.425 1.00 13.90 A C +ATOM 163 C SER A 101 69.292 90.239 58.828 1.00 14.52 A C +ATOM 164 O SER A 101 69.945 91.243 59.082 1.00 15.71 A O +ATOM 165 CB SER A 101 69.652 89.120 56.713 1.00 15.66 A C +ATOM 166 OG SER A 101 69.584 87.830 57.289 1.00 16.22 A O +ATOM 167 N LYS A 102 69.038 89.352 59.740 1.00 11.37 A N +ATOM 168 CA LYS A 102 69.496 89.413 61.113 1.00 13.52 A C +ATOM 169 C LYS A 102 69.481 87.926 61.463 1.00 15.68 A C +ATOM 170 O LYS A 102 68.523 87.250 61.079 1.00 16.07 A O +ATOM 171 CB LYS A 102 68.526 90.188 61.968 1.00 11.66 A C +ATOM 172 CG LYS A 102 68.822 90.121 63.453 1.00 12.09 A C +ATOM 173 CD LYS A 102 68.589 91.502 63.985 1.00 13.12 A C +ATOM 174 CE LYS A 102 68.184 91.574 65.415 1.00 11.86 A C +ATOM 175 NZ LYS A 102 69.053 90.893 66.348 1.00 14.45 A N1+ +ATOM 176 N ASP A 103 70.486 87.320 62.116 1.00 18.18 A N +ATOM 177 CA ASP A 103 70.387 85.903 62.361 1.00 21.09 A C +ATOM 178 C ASP A 103 70.108 85.584 63.794 1.00 22.02 A C +ATOM 179 O ASP A 103 69.911 84.412 64.119 1.00 24.18 A O +ATOM 180 CB ASP A 103 71.672 85.155 61.922 1.00 22.93 A C +ATOM 181 CG ASP A 103 72.979 85.408 62.678 1.00 25.70 A C +ATOM 182 OD1 ASP A 103 72.967 86.077 63.720 1.00 26.01 A O +ATOM 183 OD2 ASP A 103 74.028 84.916 62.209 1.00 26.93 A O1- +ATOM 184 N ASN A 104 70.191 86.580 64.672 1.00 21.62 A N +ATOM 185 CA ASN A 104 69.916 86.370 66.086 1.00 20.62 A C +ATOM 186 C ASN A 104 70.671 85.270 66.824 1.00 21.80 A C +ATOM 187 O ASN A 104 70.174 84.802 67.860 1.00 23.59 A O +ATOM 188 CB ASN A 104 68.419 86.113 66.312 1.00 19.86 A C +ATOM 189 CG ASN A 104 67.504 87.300 66.076 1.00 19.49 A C +ATOM 190 OD1 ASN A 104 66.827 87.407 65.054 1.00 16.34 A O +ATOM 191 ND2 ASN A 104 67.460 88.263 66.981 1.00 18.20 A N +ATOM 192 N SER A 105 71.926 84.914 66.444 1.00 22.14 A N +ATOM 193 CA SER A 105 72.708 83.887 67.103 1.00 22.07 A C +ATOM 194 C SER A 105 72.859 83.998 68.605 1.00 21.79 A C +ATOM 195 O SER A 105 72.770 82.967 69.254 1.00 22.40 A O +ATOM 196 CB SER A 105 74.136 83.787 66.499 1.00 25.03 A C +ATOM 197 OG SER A 105 74.215 83.034 65.248 1.00 27.39 A O +ATOM 198 N ILE A 106 72.978 85.141 69.268 1.00 21.61 A N +ATOM 199 CA ILE A 106 73.143 85.146 70.733 1.00 20.94 A C +ATOM 200 C ILE A 106 71.861 84.903 71.510 1.00 21.89 A C +ATOM 201 O ILE A 106 71.930 84.228 72.544 1.00 23.25 A O +ATOM 202 CB ILE A 106 73.788 86.487 71.202 1.00 20.14 A C +ATOM 203 CG1 ILE A 106 75.091 86.733 70.476 1.00 19.72 A C +ATOM 204 CG2 ILE A 106 74.162 86.423 72.679 1.00 20.08 A C +ATOM 205 CD1 ILE A 106 76.171 85.664 70.713 1.00 19.40 A C +ATOM 206 N ARG A 107 70.663 85.353 71.074 1.00 21.64 A N +ATOM 207 CA ARG A 107 69.446 85.119 71.847 1.00 19.99 A C +ATOM 208 C ARG A 107 69.202 83.631 71.809 1.00 18.94 A C +ATOM 209 O ARG A 107 68.987 83.033 72.881 1.00 19.11 A O +ATOM 210 CB ARG A 107 68.212 85.779 71.275 1.00 21.22 A C +ATOM 211 CG ARG A 107 68.330 87.263 70.931 1.00 22.76 A C +ATOM 212 CD ARG A 107 67.024 87.840 70.381 1.00 23.81 A C +ATOM 213 NE ARG A 107 66.200 88.291 71.491 1.00 25.04 A N +ATOM 214 CZ ARG A 107 64.877 88.205 71.511 1.00 25.87 A C +ATOM 215 NH1 ARG A 107 64.186 87.717 70.504 1.00 27.00 A N1+ +ATOM 216 NH2 ARG A 107 64.191 88.630 72.560 1.00 26.56 A N +ATOM 217 N LEU A 108 69.337 83.090 70.582 1.00 16.14 A N +ATOM 218 CA LEU A 108 69.161 81.654 70.329 1.00 15.90 A C +ATOM 219 C LEU A 108 70.124 80.786 71.145 1.00 16.77 A C +ATOM 220 O LEU A 108 69.719 79.767 71.690 1.00 18.31 A O +ATOM 221 CB LEU A 108 69.374 81.335 68.835 1.00 11.22 A C +ATOM 222 CG LEU A 108 68.435 81.921 67.772 1.00 9.02 A C +ATOM 223 CD1 LEU A 108 68.940 81.583 66.423 1.00 7.85 A C +ATOM 224 CD2 LEU A 108 67.085 81.267 67.779 1.00 8.08 A C +ATOM 225 N SER A 109 71.383 81.187 71.363 1.00 17.96 A N +ATOM 226 CA SER A 109 72.367 80.421 72.119 1.00 16.96 A C +ATOM 227 C SER A 109 71.940 80.215 73.546 1.00 18.29 A C +ATOM 228 O SER A 109 72.552 79.382 74.210 1.00 19.73 A O +ATOM 229 CB SER A 109 73.702 81.123 72.145 1.00 16.59 A C +ATOM 230 OG SER A 109 74.166 81.345 70.807 1.00 15.32 A O +ATOM 231 N ALA A 110 70.924 80.901 74.064 1.00 17.32 A N +ATOM 232 CA ALA A 110 70.567 80.637 75.441 1.00 19.13 A C +ATOM 233 C ALA A 110 69.510 79.533 75.473 1.00 19.95 A C +ATOM 234 O ALA A 110 68.892 79.265 76.517 1.00 21.92 A O +ATOM 235 CB ALA A 110 70.032 81.893 76.072 1.00 18.35 A C +ATOM 236 N GLY A 111 69.241 78.906 74.328 1.00 19.35 A N +ATOM 237 CA GLY A 111 68.287 77.845 74.246 1.00 18.88 A C +ATOM 238 C GLY A 111 68.493 77.108 72.948 1.00 19.65 A C +ATOM 239 O GLY A 111 67.528 76.888 72.216 1.00 20.99 A O +ATOM 240 N GLY A 112 69.717 76.668 72.654 1.00 19.62 A N +ATOM 241 CA GLY A 112 70.049 75.942 71.413 1.00 19.95 A C +ATOM 242 C GLY A 112 71.563 75.774 71.343 1.00 19.62 A C +ATOM 243 O GLY A 112 72.206 76.431 72.172 1.00 21.12 A O +ATOM 244 N ASP A 113 72.188 74.958 70.464 1.00 18.56 A N +ATOM 245 CA ASP A 113 73.632 74.804 70.427 1.00 17.48 A C +ATOM 246 C ASP A 113 74.061 75.527 69.169 1.00 17.70 A C +ATOM 247 O ASP A 113 73.825 75.091 68.011 1.00 15.45 A O +ATOM 248 CB ASP A 113 74.028 73.352 70.325 1.00 19.18 A C +ATOM 249 CG ASP A 113 73.349 72.430 71.317 1.00 20.70 A C +ATOM 250 OD1 ASP A 113 73.450 72.623 72.539 1.00 21.06 A O +ATOM 251 OD2 ASP A 113 72.718 71.485 70.847 1.00 21.26 A O1- +ATOM 252 N ILE A 114 74.620 76.700 69.498 1.00 15.86 A N +ATOM 253 CA ILE A 114 75.070 77.665 68.516 1.00 16.53 A C +ATOM 254 C ILE A 114 76.548 77.922 68.652 1.00 16.97 A C +ATOM 255 O ILE A 114 77.035 78.201 69.756 1.00 19.34 A O +ATOM 256 CB ILE A 114 74.276 78.998 68.732 1.00 16.36 A C +ATOM 257 CG1 ILE A 114 72.765 78.814 68.507 1.00 15.14 A C +ATOM 258 CG2 ILE A 114 74.855 80.080 67.795 1.00 16.37 A C +ATOM 259 CD1 ILE A 114 72.234 78.452 67.102 1.00 14.97 A C +ATOM 260 N TRP A 115 77.253 77.866 67.540 1.00 15.67 A N +ATOM 261 CA TRP A 115 78.684 78.113 67.407 1.00 14.71 A C +ATOM 262 C TRP A 115 79.163 79.411 68.026 1.00 13.88 A C +ATOM 263 O TRP A 115 78.419 80.384 68.002 1.00 13.02 A O +ATOM 264 CB TRP A 115 79.018 78.137 65.930 1.00 15.03 A C +ATOM 265 CG TRP A 115 79.330 76.765 65.354 1.00 15.51 A C +ATOM 266 CD1 TRP A 115 78.433 75.988 64.663 1.00 16.19 A C +ATOM 267 CD2 TRP A 115 80.579 76.211 65.374 1.00 15.63 A C +ATOM 268 NE1 TRP A 115 79.111 74.955 64.208 1.00 16.77 A N +ATOM 269 CE2 TRP A 115 80.405 75.062 64.609 1.00 16.40 A C +ATOM 270 CE3 TRP A 115 81.793 76.558 65.901 1.00 13.49 A C +ATOM 271 CZ2 TRP A 115 81.486 74.240 64.376 1.00 14.32 A C +ATOM 272 CZ3 TRP A 115 82.859 75.732 65.654 1.00 12.90 A C +ATOM 273 CH2 TRP A 115 82.707 74.591 64.908 1.00 13.55 A C +ATOM 274 N VAL A 116 80.341 79.541 68.634 1.00 14.50 A N +ATOM 275 CA VAL A 116 80.805 80.822 69.196 1.00 12.30 A C +ATOM 276 C VAL A 116 81.530 81.399 67.999 1.00 13.48 A C +ATOM 277 O VAL A 116 82.257 80.587 67.404 1.00 13.24 A O +ATOM 278 CB VAL A 116 81.772 80.573 70.362 1.00 11.22 A C +ATOM 279 CG1 VAL A 116 82.578 81.800 70.647 1.00 9.25 A C +ATOM 280 CG2 VAL A 116 80.976 80.243 71.626 1.00 10.53 A C +ATOM 281 N THR A 117 81.370 82.665 67.561 1.00 12.95 A N +ATOM 282 CA THR A 117 82.097 83.135 66.400 1.00 13.40 A C +ATOM 283 C THR A 117 82.538 84.587 66.485 1.00 14.31 A C +ATOM 284 O THR A 117 82.324 85.210 67.511 1.00 17.59 A O +ATOM 285 CB THR A 117 81.229 83.008 65.131 1.00 13.15 A C +ATOM 286 OG1 THR A 117 80.095 83.837 65.301 1.00 11.43 A O +ATOM 287 CG2 THR A 117 80.770 81.612 64.866 1.00 12.87 A C +ATOM 288 N ARG A 118 83.289 85.143 65.545 1.00 13.61 A N +ATOM 289 CA ARG A 118 83.584 86.559 65.542 1.00 13.65 A C +ATOM 290 C ARG A 118 84.044 86.806 64.109 1.00 12.77 A C +ATOM 291 O ARG A 118 84.100 85.894 63.286 1.00 13.08 A O +ATOM 292 CB ARG A 118 84.664 87.021 66.519 1.00 13.85 A C +ATOM 293 CG ARG A 118 83.980 87.884 67.596 1.00 15.04 A C +ATOM 294 CD ARG A 118 84.854 89.024 68.108 1.00 16.17 A C +ATOM 295 NE ARG A 118 84.909 90.099 67.128 1.00 16.09 A N +ATOM 296 CZ ARG A 118 85.963 90.869 66.903 1.00 17.37 A C +ATOM 297 NH1 ARG A 118 87.057 90.697 67.597 1.00 18.87 A N1+ +ATOM 298 NH2 ARG A 118 85.946 91.815 65.975 1.00 18.09 A N +ATOM 299 N GLU A 119 84.350 88.026 63.720 1.00 12.01 A N +ATOM 300 CA GLU A 119 84.752 88.386 62.372 1.00 10.32 A C +ATOM 301 C GLU A 119 83.800 87.787 61.347 1.00 12.76 A C +ATOM 302 O GLU A 119 84.269 87.041 60.478 1.00 13.57 A O +ATOM 303 CB GLU A 119 86.190 87.911 62.073 1.00 10.08 A C +ATOM 304 CG GLU A 119 87.266 88.577 62.918 1.00 9.36 A C +ATOM 305 CD GLU A 119 87.412 87.929 64.282 1.00 10.88 A C +ATOM 306 OE1 GLU A 119 87.312 86.707 64.355 1.00 10.70 A O +ATOM 307 OE2 GLU A 119 87.620 88.620 65.274 1.00 9.81 A O1- +ATOM 308 N PRO A 120 82.472 88.034 61.394 1.00 12.47 A N +ATOM 309 CA PRO A 120 81.526 87.555 60.393 1.00 13.31 A C +ATOM 310 C PRO A 120 81.591 88.324 59.104 1.00 13.17 A C +ATOM 311 O PRO A 120 82.234 89.388 59.024 1.00 16.41 A O +ATOM 312 CB PRO A 120 80.190 87.709 61.006 1.00 13.14 A C +ATOM 313 CG PRO A 120 80.357 89.047 61.657 1.00 14.29 A C +ATOM 314 CD PRO A 120 81.831 89.093 62.146 1.00 13.11 A C +ATOM 315 N TYR A 121 80.972 87.820 58.054 1.00 12.59 A N +ATOM 316 CA TYR A 121 80.919 88.575 56.796 1.00 9.74 A C +ATOM 317 C TYR A 121 79.927 87.904 55.918 1.00 9.94 A C +ATOM 318 O TYR A 121 79.430 86.837 56.298 1.00 9.78 A O +ATOM 319 CB TYR A 121 82.253 88.697 56.045 1.00 8.67 A C +ATOM 320 CG TYR A 121 83.150 87.552 55.623 1.00 8.07 A C +ATOM 321 CD1 TYR A 121 84.006 86.991 56.533 1.00 8.10 A C +ATOM 322 CD2 TYR A 121 83.071 87.102 54.321 1.00 8.39 A C +ATOM 323 CE1 TYR A 121 84.792 85.960 56.158 1.00 6.36 A C +ATOM 324 CE2 TYR A 121 83.861 86.072 53.942 1.00 7.43 A C +ATOM 325 CZ TYR A 121 84.692 85.509 54.874 1.00 7.06 A C +ATOM 326 OH TYR A 121 85.400 84.403 54.493 1.00 6.02 A O +ATOM 327 N VAL A 122 79.446 88.500 54.846 1.00 8.19 A N +ATOM 328 CA VAL A 122 78.524 87.721 54.050 1.00 10.53 A C +ATOM 329 C VAL A 122 79.063 87.953 52.653 1.00 9.92 A C +ATOM 330 O VAL A 122 79.708 88.976 52.406 1.00 8.88 A O +ATOM 331 CB VAL A 122 76.977 88.155 54.245 1.00 9.85 A C +ATOM 332 CG1 VAL A 122 76.830 89.090 55.374 1.00 9.13 A C +ATOM 333 CG2 VAL A 122 76.374 88.737 52.995 1.00 10.04 A C +ATOM 334 N SER A 123 78.955 86.935 51.806 1.00 11.36 A N +ATOM 335 CA SER A 123 79.445 87.005 50.444 1.00 13.54 A C +ATOM 336 C SER A 123 78.307 86.285 49.730 1.00 16.19 A C +ATOM 337 O SER A 123 77.517 85.458 50.282 1.00 15.86 A O +ATOM 338 CB SER A 123 80.765 86.267 50.193 1.00 12.68 A C +ATOM 339 OG SER A 123 81.099 86.653 48.844 1.00 11.94 A O +ATOM 340 N CYS A 124 78.334 86.504 48.420 1.00 17.15 A N +ATOM 341 CA CYS A 124 77.201 86.072 47.664 1.00 18.72 A C +ATOM 342 C CYS A 124 77.483 85.466 46.305 1.00 19.95 A C +ATOM 343 O CYS A 124 78.180 86.076 45.483 1.00 20.48 A O +ATOM 344 CB CYS A 124 76.554 87.424 47.841 1.00 20.37 A C +ATOM 345 SG CYS A 124 74.814 87.695 47.771 1.00 22.33 A S +ATOM 346 N ASP A 125 77.030 84.251 46.015 1.00 20.76 A N +ATOM 347 CA ASP A 125 77.332 83.694 44.715 1.00 22.74 A C +ATOM 348 C ASP A 125 76.316 84.258 43.753 1.00 22.49 A C +ATOM 349 O ASP A 125 75.501 85.047 44.208 1.00 23.67 A O +ATOM 350 CB ASP A 125 77.307 82.142 44.796 1.00 25.84 A C +ATOM 351 CG ASP A 125 76.005 81.354 44.865 1.00 28.43 A C +ATOM 352 OD1 ASP A 125 75.055 81.615 44.134 1.00 28.36 A O +ATOM 353 OD2 ASP A 125 75.958 80.413 45.643 1.00 30.05 A O1- +ATOM 354 N PRO A 126 76.200 83.948 42.473 1.00 21.93 A N +ATOM 355 CA PRO A 126 75.217 84.593 41.621 1.00 22.42 A C +ATOM 356 C PRO A 126 73.738 84.294 41.840 1.00 23.29 A C +ATOM 357 O PRO A 126 72.899 84.997 41.299 1.00 24.30 A O +ATOM 358 CB PRO A 126 75.671 84.256 40.214 1.00 21.92 A C +ATOM 359 CG PRO A 126 76.530 83.050 40.349 1.00 23.19 A C +ATOM 360 CD PRO A 126 77.209 83.274 41.688 1.00 22.45 A C +ATOM 361 N VAL A 127 73.314 83.273 42.580 1.00 24.02 A N +ATOM 362 CA VAL A 127 71.900 82.990 42.783 1.00 24.73 A C +ATOM 363 C VAL A 127 71.527 83.299 44.211 1.00 24.19 A C +ATOM 364 O VAL A 127 70.438 83.802 44.459 1.00 24.94 A O +ATOM 365 CB VAL A 127 71.546 81.488 42.487 1.00 25.90 A C +ATOM 366 CG1 VAL A 127 72.086 81.127 41.110 1.00 26.49 A C +ATOM 367 CG2 VAL A 127 72.174 80.528 43.460 1.00 26.51 A C +ATOM 368 N LYS A 128 72.410 83.066 45.187 1.00 23.63 A N +ATOM 369 CA LYS A 128 72.058 83.331 46.566 1.00 22.71 A C +ATOM 370 C LYS A 128 73.223 83.740 47.440 1.00 21.85 A C +ATOM 371 O LYS A 128 74.388 83.502 47.119 1.00 24.11 A O +ATOM 372 CB LYS A 128 71.401 82.107 47.140 1.00 24.49 A C +ATOM 373 CG LYS A 128 72.318 80.922 47.252 1.00 25.84 A C +ATOM 374 CD LYS A 128 71.619 79.878 48.103 1.00 28.81 A C +ATOM 375 CE LYS A 128 70.540 79.132 47.314 1.00 30.00 A C +ATOM 376 NZ LYS A 128 69.884 78.150 48.165 1.00 31.01 A N1+ +ATOM 377 N CYS A 129 72.877 84.302 48.579 1.00 18.44 A N +ATOM 378 CA CYS A 129 73.778 84.826 49.553 1.00 17.73 A C +ATOM 379 C CYS A 129 74.090 83.950 50.751 1.00 15.07 A C +ATOM 380 O CYS A 129 73.156 83.432 51.365 1.00 14.13 A O +ATOM 381 CB CYS A 129 73.180 86.124 50.030 1.00 18.64 A C +ATOM 382 SG CYS A 129 73.730 87.726 49.451 1.00 21.55 A S +ATOM 383 N TYR A 130 75.360 83.907 51.173 1.00 12.53 A N +ATOM 384 CA TYR A 130 75.782 83.114 52.304 1.00 10.18 A C +ATOM 385 C TYR A 130 76.437 83.963 53.352 1.00 9.10 A C +ATOM 386 O TYR A 130 77.121 84.908 52.993 1.00 10.54 A O +ATOM 387 CB TYR A 130 76.808 82.095 51.922 1.00 8.93 A C +ATOM 388 CG TYR A 130 76.301 81.157 50.865 1.00 9.36 A C +ATOM 389 CD1 TYR A 130 76.315 81.618 49.577 1.00 8.65 A C +ATOM 390 CD2 TYR A 130 75.808 79.901 51.190 1.00 9.28 A C +ATOM 391 CE1 TYR A 130 75.822 80.829 48.596 1.00 8.48 A C +ATOM 392 CE2 TYR A 130 75.305 79.101 50.185 1.00 9.41 A C +ATOM 393 CZ TYR A 130 75.315 79.593 48.896 1.00 10.24 A C +ATOM 394 OH TYR A 130 74.778 78.854 47.852 1.00 11.90 A O +ATOM 395 N GLN A 131 76.248 83.642 54.624 1.00 8.13 A N +ATOM 396 CA GLN A 131 76.904 84.361 55.657 1.00 7.14 A C +ATOM 397 C GLN A 131 78.079 83.455 56.106 1.00 10.45 A C +ATOM 398 O GLN A 131 77.977 82.200 56.011 1.00 10.86 A O +ATOM 399 CB GLN A 131 75.970 84.589 56.803 1.00 7.66 A C +ATOM 400 CG GLN A 131 75.434 83.427 57.537 1.00 4.18 A C +ATOM 401 CD GLN A 131 74.558 83.827 58.708 1.00 6.66 A C +ATOM 402 OE1 GLN A 131 74.736 83.360 59.826 1.00 6.28 A O +ATOM 403 NE2 GLN A 131 73.554 84.677 58.574 1.00 2.78 A N +ATOM 404 N PHE A 132 79.213 84.069 56.567 1.00 8.59 A N +ATOM 405 CA PHE A 132 80.403 83.372 57.028 1.00 7.17 A C +ATOM 406 C PHE A 132 80.847 83.938 58.367 1.00 8.49 A C +ATOM 407 O PHE A 132 80.432 85.025 58.778 1.00 9.35 A O +ATOM 408 CB PHE A 132 81.616 83.561 56.121 1.00 6.12 A C +ATOM 409 CG PHE A 132 81.429 83.203 54.645 1.00 4.94 A C +ATOM 410 CD1 PHE A 132 80.668 84.005 53.868 1.00 5.24 A C +ATOM 411 CD2 PHE A 132 82.017 82.075 54.130 1.00 5.14 A C +ATOM 412 CE1 PHE A 132 80.486 83.709 52.531 1.00 5.75 A C +ATOM 413 CE2 PHE A 132 81.845 81.776 52.796 1.00 5.74 A C +ATOM 414 CZ PHE A 132 81.063 82.604 51.999 1.00 6.32 A C +ATOM 415 N ALA A 133 81.735 83.231 59.029 1.00 9.12 A N +ATOM 416 CA ALA A 133 82.314 83.679 60.296 1.00 10.36 A C +ATOM 417 C ALA A 133 83.418 82.729 60.727 1.00 11.99 A C +ATOM 418 O ALA A 133 83.452 81.562 60.306 1.00 15.17 A O +ATOM 419 CB ALA A 133 81.318 83.703 61.414 1.00 8.92 A C +ATOM 420 N LEU A 134 84.325 83.173 61.590 1.00 10.47 A N +ATOM 421 CA LEU A 134 85.410 82.357 62.061 1.00 8.80 A C +ATOM 422 C LEU A 134 84.860 81.773 63.347 1.00 10.97 A C +ATOM 423 O LEU A 134 84.548 82.585 64.221 1.00 10.17 A O +ATOM 424 CB LEU A 134 86.622 83.287 62.304 1.00 7.68 A C +ATOM 425 CG LEU A 134 87.754 83.358 61.258 1.00 8.94 A C +ATOM 426 CD1 LEU A 134 87.285 83.268 59.818 1.00 8.48 A C +ATOM 427 CD2 LEU A 134 88.382 84.688 61.388 1.00 7.57 A C +ATOM 428 N GLY A 135 84.687 80.454 63.519 1.00 10.22 A N +ATOM 429 CA GLY A 135 84.173 79.968 64.797 1.00 13.15 A C +ATOM 430 C GLY A 135 85.249 79.765 65.832 1.00 13.05 A C +ATOM 431 O GLY A 135 86.420 79.814 65.519 1.00 15.98 A O +ATOM 432 N GLN A 136 84.978 79.600 67.106 1.00 13.67 A N +ATOM 433 CA GLN A 136 86.036 79.360 68.050 1.00 13.81 A C +ATOM 434 C GLN A 136 86.071 77.876 68.386 1.00 14.24 A C +ATOM 435 O GLN A 136 86.412 77.521 69.519 1.00 13.33 A O +ATOM 436 CB GLN A 136 85.805 80.158 69.322 1.00 15.64 A C +ATOM 437 CG GLN A 136 86.032 81.644 69.202 1.00 17.48 A C +ATOM 438 CD GLN A 136 87.450 82.089 68.852 1.00 19.07 A C +ATOM 439 OE1 GLN A 136 88.396 81.303 68.743 1.00 18.72 A O +ATOM 440 NE2 GLN A 136 87.603 83.405 68.667 1.00 19.81 A N +ATOM 441 N GLY A 137 85.675 76.990 67.460 1.00 13.47 A N +ATOM 442 CA GLY A 137 85.657 75.543 67.687 1.00 15.00 A C +ATOM 443 C GLY A 137 84.861 75.064 68.895 1.00 16.66 A C +ATOM 444 O GLY A 137 85.233 74.082 69.558 1.00 16.74 A O +ATOM 445 N THR A 138 83.758 75.739 69.208 1.00 16.66 A N +ATOM 446 CA THR A 138 82.921 75.408 70.340 1.00 16.40 A C +ATOM 447 C THR A 138 81.562 76.089 70.171 1.00 17.30 A C +ATOM 448 O THR A 138 81.358 76.911 69.261 1.00 17.05 A O +ATOM 449 CB THR A 138 83.649 75.888 71.601 1.00 16.28 A C +ATOM 450 OG1 THR A 138 82.930 75.363 72.702 1.00 17.96 A O +ATOM 451 CG2 THR A 138 83.723 77.390 71.733 1.00 15.67 A C +ATOM 452 N THR A 139 80.578 75.693 70.961 1.00 18.84 A N +ATOM 453 CA THR A 139 79.247 76.275 70.919 1.00 17.95 A C +ATOM 454 C THR A 139 79.243 77.131 72.182 1.00 20.91 A C +ATOM 455 O THR A 139 80.150 76.989 73.027 1.00 21.57 A O +ATOM 456 CB THR A 139 78.163 75.173 70.955 1.00 16.48 A C +ATOM 457 OG1 THR A 139 78.432 74.273 72.023 1.00 16.31 A O +ATOM 458 CG2 THR A 139 78.121 74.453 69.646 1.00 13.54 A C +ATOM 459 N LEU A 140 78.253 78.015 72.379 1.00 20.50 A N +ATOM 460 CA LEU A 140 78.270 78.879 73.540 1.00 21.75 A C +ATOM 461 C LEU A 140 77.960 78.187 74.842 1.00 23.58 A C +ATOM 462 O LEU A 140 78.650 78.421 75.845 1.00 24.36 A O +ATOM 463 CB LEU A 140 77.305 80.004 73.212 1.00 21.31 A C +ATOM 464 CG LEU A 140 77.405 81.328 73.922 1.00 21.60 A C +ATOM 465 CD1 LEU A 140 77.029 82.398 72.914 1.00 20.46 A C +ATOM 466 CD2 LEU A 140 76.567 81.330 75.195 1.00 20.94 A C +ATOM 467 N ASP A 141 76.942 77.313 74.888 1.00 25.56 A N +ATOM 468 CA ASP A 141 76.637 76.658 76.154 1.00 27.09 A C +ATOM 469 C ASP A 141 77.464 75.390 76.057 1.00 27.72 A C +ATOM 470 O ASP A 141 76.992 74.346 75.599 1.00 28.03 A O +ATOM 471 CB ASP A 141 75.158 76.371 76.210 1.00 27.70 A C +ATOM 472 CG ASP A 141 74.624 76.093 77.605 1.00 28.74 A C +ATOM 473 OD1 ASP A 141 75.364 76.034 78.581 1.00 29.54 A O +ATOM 474 OD2 ASP A 141 73.418 75.943 77.724 1.00 30.58 A O1- +ATOM 475 N ASN A 142 78.748 75.573 76.359 1.00 27.55 A N +ATOM 476 CA ASN A 142 79.742 74.523 76.295 1.00 26.85 A C +ATOM 477 C ASN A 142 80.902 75.018 77.153 1.00 27.56 A C +ATOM 478 O ASN A 142 81.357 76.121 76.895 1.00 28.67 A O +ATOM 479 CB ASN A 142 80.154 74.368 74.842 1.00 26.88 A C +ATOM 480 CG ASN A 142 81.205 73.312 74.572 1.00 26.85 A C +ATOM 481 OD1 ASN A 142 81.455 72.926 73.444 1.00 26.03 A O +ATOM 482 ND2 ASN A 142 81.965 72.758 75.492 1.00 26.21 A N +ATOM 483 N LYS A 143 81.523 74.327 78.130 1.00 27.24 A N +ATOM 484 CA LYS A 143 82.623 74.930 78.901 1.00 26.10 A C +ATOM 485 C LYS A 143 83.834 75.415 78.119 1.00 25.88 A C +ATOM 486 O LYS A 143 84.578 76.277 78.577 1.00 25.22 A O +ATOM 487 CB LYS A 143 83.116 73.978 79.952 1.00 26.55 A C +ATOM 488 CG LYS A 143 82.048 73.670 80.985 1.00 27.92 A C +ATOM 489 CD LYS A 143 82.754 73.601 82.313 1.00 29.28 A C +ATOM 490 CE LYS A 143 81.843 73.173 83.451 1.00 30.33 A C +ATOM 491 NZ LYS A 143 81.794 71.724 83.560 1.00 31.30 A N1+ +ATOM 492 N HIS A 144 83.982 74.973 76.869 1.00 24.80 A N +ATOM 493 CA HIS A 144 85.104 75.388 76.060 1.00 25.73 A C +ATOM 494 C HIS A 144 84.896 76.797 75.543 1.00 26.03 A C +ATOM 495 O HIS A 144 85.733 77.257 74.778 1.00 27.10 A O +ATOM 496 CB HIS A 144 85.310 74.503 74.817 1.00 25.88 A C +ATOM 497 CG HIS A 144 85.592 73.046 75.097 1.00 26.35 A C +ATOM 498 ND1 HIS A 144 84.766 72.022 74.896 1.00 26.87 A N +ATOM 499 CD2 HIS A 144 86.742 72.567 75.678 1.00 25.80 A C +ATOM 500 CE1 HIS A 144 85.372 70.955 75.355 1.00 27.09 A C +ATOM 501 NE2 HIS A 144 86.553 71.291 75.823 1.00 26.17 A N +ATOM 502 N SER A 145 83.816 77.513 75.803 1.00 26.38 A N +ATOM 503 CA SER A 145 83.666 78.859 75.297 1.00 27.40 A C +ATOM 504 C SER A 145 84.382 79.846 76.206 1.00 28.60 A C +ATOM 505 O SER A 145 84.504 81.001 75.826 1.00 27.70 A O +ATOM 506 CB SER A 145 82.194 79.207 75.228 1.00 26.80 A C +ATOM 507 OG SER A 145 81.695 79.046 76.552 1.00 28.82 A O +ATOM 508 N ASN A 146 84.834 79.447 77.404 1.00 32.26 A N +ATOM 509 CA ASN A 146 85.529 80.297 78.366 1.00 35.40 A C +ATOM 510 C ASN A 146 86.769 80.828 77.708 1.00 34.12 A C +ATOM 511 O ASN A 146 87.485 80.074 77.071 1.00 33.29 A O +ATOM 512 CB ASN A 146 85.977 79.537 79.618 1.00 40.68 A C +ATOM 513 CG ASN A 146 86.441 80.408 80.791 1.00 46.36 A C +ATOM 514 OD1 ASN A 146 86.749 81.588 80.606 1.00 46.08 A O +ATOM 515 ND2 ASN A 146 86.452 79.873 82.030 1.00 52.87 A N +ATOM 516 N ASP A 147 86.968 82.136 77.793 1.00 33.21 A N +ATOM 517 CA ASP A 147 88.108 82.816 77.233 1.00 32.29 A C +ATOM 518 C ASP A 147 88.250 82.791 75.726 1.00 30.46 A C +ATOM 519 O ASP A 147 89.354 82.704 75.172 1.00 30.89 A O +ATOM 520 CB ASP A 147 89.349 82.242 77.904 1.00 35.09 A C +ATOM 521 CG ASP A 147 90.561 83.142 78.102 1.00 37.47 A C +ATOM 522 OD1 ASP A 147 90.552 84.329 77.755 1.00 38.72 A O +ATOM 523 OD2 ASP A 147 91.545 82.618 78.620 1.00 39.34 A O1- +ATOM 524 N THR A 148 87.153 82.953 75.018 1.00 28.89 A N +ATOM 525 CA THR A 148 87.178 82.981 73.560 1.00 28.49 A C +ATOM 526 C THR A 148 87.491 84.374 72.976 1.00 28.32 A C +ATOM 527 O THR A 148 87.300 84.658 71.777 1.00 29.28 A O +ATOM 528 CB THR A 148 85.816 82.431 73.066 1.00 28.04 A C +ATOM 529 OG1 THR A 148 84.791 82.827 73.980 1.00 27.70 A O +ATOM 530 CG2 THR A 148 85.854 80.929 72.961 1.00 27.65 A C +ATOM 531 N VAL A 149 87.917 85.294 73.865 1.00 27.18 A N +ATOM 532 CA VAL A 149 88.311 86.661 73.528 1.00 26.41 A C +ATOM 533 C VAL A 149 89.476 86.592 72.559 1.00 26.49 A C +ATOM 534 O VAL A 149 89.629 87.445 71.692 1.00 28.25 A O +ATOM 535 CB VAL A 149 88.941 87.546 74.646 1.00 26.56 A C +ATOM 536 CG1 VAL A 149 88.269 88.880 74.571 1.00 26.05 A C +ATOM 537 CG2 VAL A 149 88.851 86.933 76.041 1.00 27.08 A C +ATOM 538 N HIS A 150 90.326 85.570 72.658 1.00 26.11 A N +ATOM 539 CA HIS A 150 91.508 85.456 71.821 1.00 24.88 A C +ATOM 540 C HIS A 150 91.196 85.254 70.370 1.00 24.12 A C +ATOM 541 O HIS A 150 90.280 84.553 69.966 1.00 22.85 A O +ATOM 542 CB HIS A 150 92.357 84.335 72.355 1.00 25.97 A C +ATOM 543 CG HIS A 150 92.699 84.555 73.832 1.00 27.08 A C +ATOM 544 ND1 HIS A 150 93.384 85.539 74.419 1.00 27.34 A N +ATOM 545 CD2 HIS A 150 92.283 83.701 74.832 1.00 27.83 A C +ATOM 546 CE1 HIS A 150 93.389 85.304 75.713 1.00 27.43 A C +ATOM 547 NE2 HIS A 150 92.728 84.201 75.950 1.00 27.22 A N +ATOM 548 N ASP A 151 91.926 86.005 69.589 1.00 24.47 A N +ATOM 549 CA ASP A 151 91.701 85.938 68.171 1.00 25.97 A C +ATOM 550 C ASP A 151 92.271 84.770 67.459 1.00 24.52 A C +ATOM 551 O ASP A 151 91.787 84.433 66.393 1.00 24.83 A O +ATOM 552 CB ASP A 151 92.244 87.169 67.459 1.00 28.10 A C +ATOM 553 CG ASP A 151 91.690 88.507 67.947 1.00 30.62 A C +ATOM 554 OD1 ASP A 151 90.493 88.606 68.227 1.00 31.34 A O +ATOM 555 OD2 ASP A 151 92.480 89.447 68.052 1.00 31.51 A O1- +ATOM 556 N ARG A 152 93.300 84.123 67.962 1.00 23.86 A N +ATOM 557 CA ARG A 152 93.869 83.038 67.187 1.00 23.31 A C +ATOM 558 C ARG A 152 94.121 81.776 67.983 1.00 22.45 A C +ATOM 559 O ARG A 152 94.846 81.846 68.964 1.00 24.27 A O +ATOM 560 CB ARG A 152 95.178 83.507 66.590 1.00 23.02 A C +ATOM 561 CG ARG A 152 95.174 84.700 65.634 1.00 23.67 A C +ATOM 562 CD ARG A 152 96.570 85.321 65.437 1.00 23.52 A C +ATOM 563 NE ARG A 152 96.663 86.591 66.146 1.00 23.75 A N +ATOM 564 CZ ARG A 152 97.347 86.738 67.275 1.00 23.45 A C +ATOM 565 NH1 ARG A 152 98.022 85.771 67.863 1.00 23.42 A N1+ +ATOM 566 NH2 ARG A 152 97.375 87.915 67.844 1.00 25.18 A N +ATOM 567 N ILE A 153 93.507 80.647 67.675 1.00 19.56 A N +ATOM 568 CA ILE A 153 93.759 79.399 68.353 1.00 17.65 A C +ATOM 569 C ILE A 153 93.738 78.372 67.218 1.00 18.68 A C +ATOM 570 O ILE A 153 93.169 78.710 66.168 1.00 20.36 A O +ATOM 571 CB ILE A 153 92.687 78.997 69.402 1.00 16.20 A C +ATOM 572 CG1 ILE A 153 91.296 79.188 68.914 1.00 14.04 A C +ATOM 573 CG2 ILE A 153 92.951 79.812 70.654 1.00 15.27 A C +ATOM 574 CD1 ILE A 153 90.366 78.441 69.833 1.00 13.01 A C +ATOM 575 N PRO A 154 94.277 77.127 67.228 1.00 18.72 A N +ATOM 576 CA PRO A 154 94.229 76.214 66.061 1.00 18.18 A C +ATOM 577 C PRO A 154 92.837 75.682 65.682 1.00 18.17 A C +ATOM 578 O PRO A 154 92.570 75.091 64.639 1.00 19.68 A O +ATOM 579 CB PRO A 154 95.128 75.092 66.422 1.00 17.99 A C +ATOM 580 CG PRO A 154 95.774 75.478 67.710 1.00 17.85 A C +ATOM 581 CD PRO A 154 94.839 76.440 68.387 1.00 17.25 A C +ATOM 582 N HIS A 155 91.895 75.867 66.585 1.00 16.80 A N +ATOM 583 CA HIS A 155 90.547 75.368 66.435 1.00 16.01 A C +ATOM 584 C HIS A 155 89.561 76.240 65.716 1.00 15.37 A C +ATOM 585 O HIS A 155 88.420 75.819 65.573 1.00 16.00 A O +ATOM 586 CB HIS A 155 90.085 75.051 67.838 1.00 16.24 A C +ATOM 587 CG HIS A 155 91.185 74.238 68.510 1.00 17.80 A C +ATOM 588 ND1 HIS A 155 91.967 73.332 67.933 1.00 18.36 A N +ATOM 589 CD2 HIS A 155 91.568 74.338 69.825 1.00 18.45 A C +ATOM 590 CE1 HIS A 155 92.801 72.867 68.834 1.00 19.63 A C +ATOM 591 NE2 HIS A 155 92.549 73.484 69.971 1.00 19.14 A N +ATOM 592 N ARG A 156 89.975 77.428 65.259 1.00 13.16 A N +ATOM 593 CA ARG A 156 89.083 78.314 64.592 1.00 11.78 A C +ATOM 594 C ARG A 156 88.947 77.801 63.177 1.00 10.65 A C +ATOM 595 O ARG A 156 89.958 77.451 62.557 1.00 11.30 A O +ATOM 596 CB ARG A 156 89.646 79.751 64.565 1.00 11.33 A C +ATOM 597 CG ARG A 156 89.891 80.311 65.973 1.00 11.68 A C +ATOM 598 CD ARG A 156 89.837 81.815 65.970 1.00 13.02 A C +ATOM 599 NE ARG A 156 88.451 82.208 65.795 1.00 15.34 A N +ATOM 600 CZ ARG A 156 88.038 83.466 65.652 1.00 17.11 A C +ATOM 601 NH1 ARG A 156 88.857 84.520 65.672 1.00 18.53 A N1+ +ATOM 602 NH2 ARG A 156 86.746 83.682 65.499 1.00 18.37 A N +ATOM 603 N THR A 157 87.732 77.751 62.665 1.00 9.50 A N +ATOM 604 CA THR A 157 87.502 77.312 61.299 1.00 7.58 A C +ATOM 605 C THR A 157 86.514 78.278 60.657 1.00 7.03 A C +ATOM 606 O THR A 157 85.774 79.021 61.311 1.00 3.72 A O +ATOM 607 CB THR A 157 86.976 75.882 61.377 1.00 8.78 A C +ATOM 608 OG1 THR A 157 85.935 75.993 62.325 1.00 8.17 A O +ATOM 609 CG2 THR A 157 87.954 74.815 61.864 1.00 9.48 A C +ATOM 610 N LEU A 158 86.454 78.349 59.345 1.00 6.62 A N +ATOM 611 CA LEU A 158 85.542 79.244 58.679 1.00 6.25 A C +ATOM 612 C LEU A 158 84.222 78.508 58.544 1.00 8.67 A C +ATOM 613 O LEU A 158 84.192 77.406 57.958 1.00 12.02 A O +ATOM 614 CB LEU A 158 86.110 79.626 57.282 1.00 6.10 A C +ATOM 615 CG LEU A 158 85.219 80.504 56.402 1.00 7.34 A C +ATOM 616 CD1 LEU A 158 84.944 81.745 57.252 1.00 7.19 A C +ATOM 617 CD2 LEU A 158 85.810 80.796 55.012 1.00 5.03 A C +ATOM 618 N LEU A 159 83.136 79.088 59.049 1.00 7.37 A N +ATOM 619 CA LEU A 159 81.805 78.496 59.006 1.00 5.84 A C +ATOM 620 C LEU A 159 81.083 79.048 57.829 1.00 6.28 A C +ATOM 621 O LEU A 159 81.302 80.245 57.603 1.00 7.21 A O +ATOM 622 CB LEU A 159 81.092 78.893 60.238 1.00 2.53 A C +ATOM 623 CG LEU A 159 81.753 78.377 61.486 1.00 2.76 A C +ATOM 624 CD1 LEU A 159 80.994 78.842 62.690 1.00 2.00 A C +ATOM 625 CD2 LEU A 159 81.740 76.851 61.458 1.00 2.00 A C +ATOM 626 N MET A 160 80.207 78.358 57.102 1.00 6.20 A N +ATOM 627 CA MET A 160 79.515 78.971 55.967 1.00 8.01 A C +ATOM 628 C MET A 160 78.061 78.480 55.883 1.00 10.71 A C +ATOM 629 O MET A 160 77.823 77.268 55.958 1.00 12.25 A O +ATOM 630 CB MET A 160 80.191 78.599 54.730 1.00 5.35 A C +ATOM 631 CG MET A 160 79.578 79.314 53.575 1.00 5.63 A C +ATOM 632 SD MET A 160 80.313 78.401 52.222 1.00 5.07 A S +ATOM 633 CE MET A 160 79.695 79.098 50.713 1.00 3.33 A C +ATOM 634 N ASN A 161 77.057 79.340 55.757 1.00 13.89 A N +ATOM 635 CA ASN A 161 75.651 78.956 55.700 1.00 15.11 A C +ATOM 636 C ASN A 161 74.876 79.891 54.813 1.00 15.90 A C +ATOM 637 O ASN A 161 75.374 80.964 54.477 1.00 15.64 A O +ATOM 638 CB ASN A 161 74.930 79.101 56.993 1.00 14.83 A C +ATOM 639 CG ASN A 161 74.976 77.933 57.912 1.00 15.90 A C +ATOM 640 OD1 ASN A 161 74.773 78.019 59.120 1.00 16.29 A O +ATOM 641 ND2 ASN A 161 75.198 76.747 57.430 1.00 17.47 A N +ATOM 642 N GLU A 162 73.662 79.542 54.386 1.00 17.72 A N +ATOM 643 CA GLU A 162 72.848 80.458 53.602 1.00 16.64 A C +ATOM 644 C GLU A 162 72.580 81.584 54.596 1.00 15.99 A C +ATOM 645 O GLU A 162 72.516 81.390 55.839 1.00 14.86 A O +ATOM 646 CB GLU A 162 71.523 79.936 53.248 1.00 18.58 A C +ATOM 647 CG GLU A 162 71.692 78.932 52.160 1.00 24.37 A C +ATOM 648 CD GLU A 162 70.420 78.709 51.358 1.00 27.36 A C +ATOM 649 OE1 GLU A 162 69.789 79.680 50.893 1.00 29.87 A O +ATOM 650 OE2 GLU A 162 70.074 77.546 51.189 1.00 29.17 A O1- +ATOM 651 N LEU A 163 72.521 82.795 54.034 1.00 13.96 A N +ATOM 652 CA LEU A 163 72.262 83.992 54.839 1.00 12.43 A C +ATOM 653 C LEU A 163 70.919 83.822 55.548 1.00 11.06 A C +ATOM 654 O LEU A 163 69.920 83.531 54.881 1.00 10.70 A O +ATOM 655 CB LEU A 163 72.212 85.207 53.928 1.00 11.68 A C +ATOM 656 CG LEU A 163 71.961 86.569 54.560 1.00 11.42 A C +ATOM 657 CD1 LEU A 163 73.002 86.875 55.650 1.00 10.68 A C +ATOM 658 CD2 LEU A 163 71.877 87.569 53.423 1.00 12.37 A C +ATOM 659 N GLY A 164 70.979 83.913 56.873 1.00 9.23 A N +ATOM 660 CA GLY A 164 69.791 83.803 57.631 1.00 7.36 A C +ATOM 661 C GLY A 164 69.800 82.501 58.392 1.00 10.35 A C +ATOM 662 O GLY A 164 69.175 82.461 59.483 1.00 9.56 A O +ATOM 663 N VAL A 165 70.424 81.391 57.945 1.00 10.12 A N +ATOM 664 CA VAL A 165 70.291 80.242 58.860 1.00 11.02 A C +ATOM 665 C VAL A 165 71.456 80.384 59.829 1.00 10.80 A C +ATOM 666 O VAL A 165 72.566 80.649 59.396 1.00 10.08 A O +ATOM 667 CB VAL A 165 70.198 78.828 58.040 1.00 11.59 A C +ATOM 668 CG1 VAL A 165 70.181 79.102 56.541 1.00 8.46 A C +ATOM 669 CG2 VAL A 165 71.239 77.841 58.486 1.00 9.15 A C +ATOM 670 N PRO A 166 71.239 80.402 61.151 1.00 11.37 A N +ATOM 671 CA PRO A 166 72.308 80.597 62.124 1.00 11.80 A C +ATOM 672 C PRO A 166 73.284 79.414 62.212 1.00 13.57 A C +ATOM 673 O PRO A 166 72.971 78.294 61.790 1.00 16.23 A O +ATOM 674 CB PRO A 166 71.555 80.867 63.398 1.00 11.04 A C +ATOM 675 CG PRO A 166 70.302 80.041 63.256 1.00 10.96 A C +ATOM 676 CD PRO A 166 69.948 80.197 61.787 1.00 10.84 A C +ATOM 677 N PHE A 167 74.432 79.581 62.891 1.00 12.62 A N +ATOM 678 CA PHE A 167 75.421 78.535 62.991 1.00 10.52 A C +ATOM 679 C PHE A 167 75.175 77.527 64.072 1.00 11.45 A C +ATOM 680 O PHE A 167 75.702 77.563 65.195 1.00 11.74 A O +ATOM 681 CB PHE A 167 76.836 79.120 63.202 1.00 9.36 A C +ATOM 682 CG PHE A 167 77.234 80.110 62.124 1.00 5.43 A C +ATOM 683 CD1 PHE A 167 77.163 79.742 60.809 1.00 5.44 A C +ATOM 684 CD2 PHE A 167 77.550 81.388 62.473 1.00 4.31 A C +ATOM 685 CE1 PHE A 167 77.393 80.676 59.826 1.00 4.64 A C +ATOM 686 CE2 PHE A 167 77.770 82.305 61.474 1.00 4.59 A C +ATOM 687 CZ PHE A 167 77.696 81.957 60.159 1.00 2.94 A C +ATOM 688 N HIS A 168 74.305 76.646 63.641 1.00 10.75 A N +ATOM 689 CA HIS A 168 73.861 75.506 64.419 1.00 11.32 A C +ATOM 690 C HIS A 168 74.879 74.394 64.138 1.00 11.97 A C +ATOM 691 O HIS A 168 75.659 74.489 63.176 1.00 11.48 A O +ATOM 692 CB HIS A 168 72.429 75.118 63.978 1.00 10.29 A C +ATOM 693 CG HIS A 168 72.268 74.718 62.538 1.00 8.56 A C +ATOM 694 ND1 HIS A 168 72.218 73.486 62.094 1.00 11.06 A N +ATOM 695 CD2 HIS A 168 72.197 75.530 61.446 1.00 10.47 A C +ATOM 696 CE1 HIS A 168 72.130 73.513 60.766 1.00 11.07 A C +ATOM 697 NE2 HIS A 168 72.119 74.760 60.385 1.00 9.06 A N +ATOM 698 N LEU A 169 74.824 73.270 64.889 1.00 11.81 A N +ATOM 699 CA LEU A 169 75.778 72.153 64.755 1.00 10.15 A C +ATOM 700 C LEU A 169 75.871 71.424 63.448 1.00 9.51 A C +ATOM 701 O LEU A 169 76.783 70.618 63.266 1.00 10.10 A O +ATOM 702 CB LEU A 169 75.538 71.089 65.802 1.00 7.96 A C +ATOM 703 CG LEU A 169 75.958 71.448 67.210 1.00 8.34 A C +ATOM 704 CD1 LEU A 169 75.525 70.368 68.168 1.00 6.63 A C +ATOM 705 CD2 LEU A 169 77.455 71.528 67.285 1.00 8.00 A C +ATOM 706 N GLY A 170 75.013 71.765 62.510 1.00 9.85 A N +ATOM 707 CA GLY A 170 75.062 71.091 61.244 1.00 10.62 A C +ATOM 708 C GLY A 170 75.723 71.930 60.176 1.00 14.10 A C +ATOM 709 O GLY A 170 75.569 71.581 58.994 1.00 15.76 A O +ATOM 710 N THR A 171 76.352 73.055 60.559 1.00 14.56 A N +ATOM 711 CA THR A 171 77.046 74.004 59.707 1.00 14.16 A C +ATOM 712 C THR A 171 78.369 73.385 59.287 1.00 13.47 A C +ATOM 713 O THR A 171 79.049 72.681 60.046 1.00 9.68 A O +ATOM 714 CB THR A 171 77.344 75.295 60.511 1.00 15.78 A C +ATOM 715 OG1 THR A 171 76.092 75.738 61.043 1.00 16.16 A O +ATOM 716 CG2 THR A 171 78.056 76.339 59.693 1.00 14.20 A C +ATOM 717 N ARG A 172 78.805 73.772 58.111 1.00 14.33 A N +ATOM 718 CA ARG A 172 80.034 73.288 57.553 1.00 14.08 A C +ATOM 719 C ARG A 172 81.262 74.114 57.857 1.00 14.43 A C +ATOM 720 O ARG A 172 81.236 75.332 57.608 1.00 13.56 A O +ATOM 721 CB ARG A 172 79.816 73.244 56.106 1.00 15.29 A C +ATOM 722 CG ARG A 172 80.936 72.680 55.379 1.00 17.86 A C +ATOM 723 CD ARG A 172 80.523 72.647 53.927 1.00 18.79 A C +ATOM 724 NE ARG A 172 81.639 71.887 53.457 1.00 23.27 A N +ATOM 725 CZ ARG A 172 82.531 72.414 52.621 1.00 25.57 A C +ATOM 726 NH1 ARG A 172 82.299 73.646 52.127 1.00 25.16 A N1+ +ATOM 727 NH2 ARG A 172 83.607 71.639 52.274 1.00 25.61 A N +ATOM 728 N GLN A 173 82.351 73.504 58.330 1.00 11.62 A N +ATOM 729 CA GLN A 173 83.605 74.219 58.604 1.00 10.13 A C +ATOM 730 C GLN A 173 84.335 74.137 57.269 1.00 8.36 A C +ATOM 731 O GLN A 173 85.060 73.161 57.113 1.00 9.15 A O +ATOM 732 CB GLN A 173 84.351 73.477 59.699 1.00 10.24 A C +ATOM 733 CG GLN A 173 83.351 73.469 60.821 1.00 12.41 A C +ATOM 734 CD GLN A 173 83.854 72.838 62.075 1.00 12.48 A C +ATOM 735 OE1 GLN A 173 84.734 73.414 62.680 1.00 12.92 A O +ATOM 736 NE2 GLN A 173 83.339 71.692 62.528 1.00 14.63 A N +ATOM 737 N VAL A 174 84.309 75.162 56.435 1.00 5.87 A N +ATOM 738 CA VAL A 174 84.918 75.141 55.116 1.00 6.67 A C +ATOM 739 C VAL A 174 86.430 74.945 55.060 1.00 8.32 A C +ATOM 740 O VAL A 174 86.975 74.493 54.025 1.00 7.37 A O +ATOM 741 CB VAL A 174 84.520 76.437 54.405 1.00 6.71 A C +ATOM 742 CG1 VAL A 174 85.167 76.561 53.006 1.00 6.45 A C +ATOM 743 CG2 VAL A 174 83.042 76.439 54.169 1.00 4.43 A C +ATOM 744 N CYS A 175 87.167 75.357 56.109 1.00 8.34 A N +ATOM 745 CA CYS A 175 88.627 75.280 56.153 1.00 10.85 A C +ATOM 746 C CYS A 175 89.166 75.659 57.558 1.00 9.18 A C +ATOM 747 O CYS A 175 88.324 76.024 58.383 1.00 10.97 A O +ATOM 748 CB CYS A 175 89.228 76.219 55.142 1.00 12.83 A C +ATOM 749 SG CYS A 175 88.943 77.993 55.463 1.00 16.66 A S +ATOM 750 N ILE A 176 90.484 75.514 57.874 1.00 9.96 A N +ATOM 751 CA ILE A 176 91.055 75.927 59.190 1.00 8.08 A C +ATOM 752 C ILE A 176 91.460 77.415 59.018 1.00 10.66 A C +ATOM 753 O ILE A 176 92.156 77.756 58.046 1.00 12.47 A O +ATOM 754 CB ILE A 176 92.289 75.100 59.580 1.00 6.70 A C +ATOM 755 CG1 ILE A 176 91.991 73.621 59.643 1.00 5.37 A C +ATOM 756 CG2 ILE A 176 92.626 75.429 61.018 1.00 5.41 A C +ATOM 757 CD1 ILE A 176 93.120 72.686 60.036 1.00 3.15 A C +ATOM 758 N ALA A 177 91.092 78.346 59.911 1.00 10.22 A N +ATOM 759 CA ALA A 177 91.387 79.737 59.716 1.00 11.28 A C +ATOM 760 C ALA A 177 91.103 80.640 60.894 1.00 12.19 A C +ATOM 761 O ALA A 177 90.139 80.478 61.648 1.00 13.24 A O +ATOM 762 CB ALA A 177 90.564 80.300 58.596 1.00 9.61 A C +ATOM 763 N TRP A 178 92.020 81.549 61.180 1.00 13.26 A N +ATOM 764 CA TRP A 178 91.750 82.510 62.206 1.00 12.22 A C +ATOM 765 C TRP A 178 91.746 83.816 61.427 1.00 13.06 A C +ATOM 766 O TRP A 178 91.857 84.856 62.056 1.00 11.48 A O +ATOM 767 CB TRP A 178 92.798 82.558 63.278 1.00 11.68 A C +ATOM 768 CG TRP A 178 94.274 82.318 63.013 1.00 11.69 A C +ATOM 769 CD1 TRP A 178 94.845 81.231 63.603 1.00 11.90 A C +ATOM 770 CD2 TRP A 178 95.194 83.111 62.356 1.00 13.08 A C +ATOM 771 NE1 TRP A 178 96.121 81.341 63.336 1.00 13.45 A N +ATOM 772 CE2 TRP A 178 96.369 82.424 62.599 1.00 12.71 A C +ATOM 773 CE3 TRP A 178 95.243 84.270 61.614 1.00 13.42 A C +ATOM 774 CZ2 TRP A 178 97.597 82.836 62.150 1.00 12.26 A C +ATOM 775 CZ3 TRP A 178 96.473 84.689 61.147 1.00 12.75 A C +ATOM 776 CH2 TRP A 178 97.634 83.990 61.415 1.00 13.30 A C +ATOM 777 N SER A 179 91.745 83.832 60.076 1.00 11.97 A N +ATOM 778 CA SER A 179 91.668 85.031 59.291 1.00 13.57 A C +ATOM 779 C SER A 179 91.227 84.499 57.911 1.00 14.63 A C +ATOM 780 O SER A 179 91.758 83.468 57.492 1.00 14.94 A O +ATOM 781 CB SER A 179 93.028 85.751 59.237 1.00 14.33 A C +ATOM 782 OG SER A 179 92.860 87.044 58.638 1.00 13.42 A O +ATOM 783 N SER A 180 90.225 85.086 57.219 1.00 15.28 A N +ATOM 784 CA SER A 180 89.748 84.569 55.943 1.00 15.27 A C +ATOM 785 C SER A 180 89.253 85.586 54.949 1.00 15.54 A C +ATOM 786 O SER A 180 89.246 86.787 55.209 1.00 15.64 A O +ATOM 787 CB SER A 180 88.594 83.573 56.217 1.00 15.53 A C +ATOM 788 OG SER A 180 87.347 84.167 56.596 1.00 13.70 A O +ATOM 789 N SER A 181 88.835 85.106 53.782 1.00 14.77 A N +ATOM 790 CA SER A 181 88.290 85.959 52.745 1.00 14.65 A C +ATOM 791 C SER A 181 87.772 84.946 51.742 1.00 14.48 A C +ATOM 792 O SER A 181 88.487 84.000 51.398 1.00 13.79 A O +ATOM 793 CB SER A 181 89.339 86.804 52.066 1.00 13.30 A C +ATOM 794 OG SER A 181 88.732 87.469 50.952 1.00 15.61 A O +ATOM 795 N SER A 182 86.481 85.028 51.374 1.00 15.50 A N +ATOM 796 CA SER A 182 85.927 84.112 50.388 1.00 14.49 A C +ATOM 797 C SER A 182 85.282 84.916 49.290 1.00 15.19 A C +ATOM 798 O SER A 182 84.930 86.072 49.547 1.00 17.12 A O +ATOM 799 CB SER A 182 84.852 83.274 51.014 1.00 14.54 A C +ATOM 800 OG SER A 182 85.275 82.739 52.291 1.00 15.09 A O +ATOM 801 N CYS A 183 85.162 84.459 48.062 1.00 14.97 A N +ATOM 802 CA CYS A 183 84.493 85.231 47.031 1.00 13.75 A C +ATOM 803 C CYS A 183 84.056 84.232 45.978 1.00 14.93 A C +ATOM 804 O CYS A 183 84.604 83.133 46.010 1.00 15.06 A O +ATOM 805 CB CYS A 183 85.375 86.324 46.414 1.00 11.43 A C +ATOM 806 SG CYS A 183 87.049 86.047 45.772 1.00 5.54 A S +ATOM 807 N HIS A 184 83.121 84.506 45.071 1.00 16.31 A N +ATOM 808 CA HIS A 184 82.723 83.516 44.109 1.00 15.25 A C +ATOM 809 C HIS A 184 83.012 84.143 42.774 1.00 16.83 A C +ATOM 810 O HIS A 184 82.461 85.185 42.486 1.00 20.61 A O +ATOM 811 CB HIS A 184 81.284 83.241 44.341 1.00 14.97 A C +ATOM 812 CG HIS A 184 80.735 82.199 43.400 1.00 15.01 A C +ATOM 813 ND1 HIS A 184 80.420 80.962 43.735 1.00 15.49 A N +ATOM 814 CD2 HIS A 184 80.496 82.330 42.053 1.00 13.96 A C +ATOM 815 CE1 HIS A 184 80.008 80.344 42.634 1.00 15.77 A C +ATOM 816 NE2 HIS A 184 80.058 81.182 41.619 1.00 14.48 A N +ATOM 817 N ASP A 185 83.703 83.500 41.890 1.00 15.57 A N +ATOM 818 CA ASP A 185 84.046 84.092 40.623 1.00 15.40 A C +ATOM 819 C ASP A 185 83.114 83.856 39.462 1.00 16.15 A C +ATOM 820 O ASP A 185 83.422 84.075 38.270 1.00 15.09 A O +ATOM 821 CB ASP A 185 85.442 83.591 40.339 1.00 16.78 A C +ATOM 822 CG ASP A 185 85.470 82.114 39.919 1.00 19.35 A C +ATOM 823 OD1 ASP A 185 84.601 81.335 40.321 1.00 19.37 A O +ATOM 824 OD2 ASP A 185 86.369 81.747 39.160 1.00 20.06 A O1- +ATOM 825 N GLY A 186 81.900 83.440 39.758 1.00 17.07 A N +ATOM 826 CA GLY A 186 80.962 83.114 38.685 1.00 19.67 A C +ATOM 827 C GLY A 186 80.865 81.612 38.592 1.00 20.24 A C +ATOM 828 O GLY A 186 79.769 81.098 38.768 1.00 21.47 A O +ATOM 829 N LYS A 187 81.982 80.895 38.475 1.00 19.94 A N +ATOM 830 CA LYS A 187 82.000 79.452 38.418 1.00 19.03 A C +ATOM 831 C LYS A 187 82.273 78.720 39.739 1.00 18.40 A C +ATOM 832 O LYS A 187 81.787 77.603 39.809 1.00 19.20 A O +ATOM 833 CB LYS A 187 83.021 79.009 37.426 1.00 21.47 A C +ATOM 834 CG LYS A 187 82.785 79.628 36.077 1.00 23.30 A C +ATOM 835 CD LYS A 187 83.845 79.068 35.155 1.00 25.91 A C +ATOM 836 CE LYS A 187 83.690 79.724 33.779 1.00 27.90 A C +ATOM 837 NZ LYS A 187 84.527 79.047 32.803 1.00 29.01 A N1+ +ATOM 838 N ALA A 188 82.900 79.189 40.845 1.00 14.82 A N +ATOM 839 CA ALA A 188 83.110 78.384 42.062 1.00 11.33 A C +ATOM 840 C ALA A 188 83.565 79.285 43.162 1.00 11.16 A C +ATOM 841 O ALA A 188 83.820 80.467 42.918 1.00 8.30 A O +ATOM 842 CB ALA A 188 84.197 77.384 41.934 1.00 13.53 A C +ATOM 843 N TRP A 189 83.525 78.812 44.394 1.00 11.57 A N +ATOM 844 CA TRP A 189 83.951 79.632 45.491 1.00 12.34 A C +ATOM 845 C TRP A 189 85.465 79.565 45.666 1.00 12.83 A C +ATOM 846 O TRP A 189 86.016 78.495 45.411 1.00 11.34 A O +ATOM 847 CB TRP A 189 83.290 79.151 46.761 1.00 14.21 A C +ATOM 848 CG TRP A 189 81.849 79.636 46.912 1.00 17.61 A C +ATOM 849 CD1 TRP A 189 80.764 78.912 46.468 1.00 18.69 A C +ATOM 850 CD2 TRP A 189 81.471 80.827 47.475 1.00 18.93 A C +ATOM 851 NE1 TRP A 189 79.705 79.642 46.751 1.00 18.07 A N +ATOM 852 CE2 TRP A 189 80.088 80.785 47.345 1.00 19.70 A C +ATOM 853 CE3 TRP A 189 82.094 81.909 48.052 1.00 20.72 A C +ATOM 854 CZ2 TRP A 189 79.317 81.836 47.794 1.00 21.08 A C +ATOM 855 CZ3 TRP A 189 81.316 82.956 48.499 1.00 21.12 A C +ATOM 856 CH2 TRP A 189 79.946 82.922 48.371 1.00 21.10 A C +ATOM 857 N LEU A 190 86.094 80.638 46.189 1.00 12.48 A N +ATOM 858 CA LEU A 190 87.517 80.787 46.502 1.00 12.76 A C +ATOM 859 C LEU A 190 87.555 81.060 48.006 1.00 13.58 A C +ATOM 860 O LEU A 190 86.773 81.876 48.501 1.00 15.43 A O +ATOM 861 CB LEU A 190 88.180 82.006 45.852 1.00 12.94 A C +ATOM 862 CG LEU A 190 89.672 82.244 46.256 1.00 14.98 A C +ATOM 863 CD1 LEU A 190 90.542 81.114 45.737 1.00 13.04 A C +ATOM 864 CD2 LEU A 190 90.151 83.607 45.732 1.00 15.04 A C +ATOM 865 N HIS A 191 88.328 80.380 48.814 1.00 13.19 A N +ATOM 866 CA HIS A 191 88.356 80.700 50.220 1.00 13.47 A C +ATOM 867 C HIS A 191 89.841 80.846 50.535 1.00 14.28 A C +ATOM 868 O HIS A 191 90.595 79.990 50.047 1.00 14.71 A O +ATOM 869 CB HIS A 191 87.810 79.585 51.073 1.00 14.42 A C +ATOM 870 CG HIS A 191 86.364 79.242 50.788 1.00 16.79 A C +ATOM 871 ND1 HIS A 191 85.259 79.886 51.182 1.00 17.03 A N +ATOM 872 CD2 HIS A 191 85.985 78.123 50.081 1.00 16.21 A C +ATOM 873 CE1 HIS A 191 84.226 79.189 50.748 1.00 17.51 A C +ATOM 874 NE2 HIS A 191 84.677 78.126 50.090 1.00 17.49 A N +ATOM 875 N VAL A 192 90.340 81.918 51.176 1.00 12.16 A N +ATOM 876 CA VAL A 192 91.738 81.958 51.487 1.00 12.14 A C +ATOM 877 C VAL A 192 91.583 81.834 52.999 1.00 12.06 A C +ATOM 878 O VAL A 192 90.840 82.589 53.649 1.00 11.24 A O +ATOM 879 CB VAL A 192 92.494 83.299 51.015 1.00 13.75 A C +ATOM 880 CG1 VAL A 192 91.756 83.931 49.836 1.00 11.51 A C +ATOM 881 CG2 VAL A 192 92.784 84.195 52.211 1.00 13.79 A C +ATOM 882 N CYS A 193 92.304 80.892 53.589 1.00 12.21 A N +ATOM 883 CA CYS A 193 92.151 80.643 55.013 1.00 12.85 A C +ATOM 884 C CYS A 193 93.506 80.732 55.632 1.00 11.76 A C +ATOM 885 O CYS A 193 94.447 80.171 55.054 1.00 12.39 A O +ATOM 886 CB CYS A 193 91.583 79.235 55.211 1.00 15.23 A C +ATOM 887 SG CYS A 193 90.160 78.869 54.131 1.00 17.48 A S +ATOM 888 N ILE A 194 93.676 81.372 56.783 1.00 10.82 A N +ATOM 889 CA ILE A 194 94.984 81.479 57.356 1.00 8.91 A C +ATOM 890 C ILE A 194 95.057 80.855 58.750 1.00 10.99 A C +ATOM 891 O ILE A 194 94.223 81.188 59.614 1.00 9.66 A O +ATOM 892 CB ILE A 194 95.322 83.017 57.309 1.00 9.36 A C +ATOM 893 CG1 ILE A 194 95.455 83.524 55.884 1.00 8.15 A C +ATOM 894 CG2 ILE A 194 96.653 83.263 57.984 1.00 11.10 A C +ATOM 895 CD1 ILE A 194 95.542 85.048 55.755 1.00 8.30 A C +ATOM 896 N THR A 195 95.945 79.890 58.991 1.00 9.74 A N +ATOM 897 CA THR A 195 96.077 79.317 60.331 1.00 11.88 A C +ATOM 898 C THR A 195 97.576 79.169 60.494 1.00 13.25 A C +ATOM 899 O THR A 195 98.350 79.367 59.538 1.00 11.15 A O +ATOM 900 CB THR A 195 95.676 77.861 60.630 1.00 11.37 A C +ATOM 901 OG1 THR A 195 95.343 77.278 59.382 1.00 12.23 A O +ATOM 902 CG2 THR A 195 94.745 77.803 61.832 1.00 10.48 A C +ATOM 903 N GLY A 196 97.962 78.843 61.724 1.00 13.19 A N +ATOM 904 CA GLY A 196 99.350 78.624 61.953 1.00 17.36 A C +ATOM 905 C GLY A 196 99.830 79.525 63.037 1.00 19.58 A C +ATOM 906 O GLY A 196 99.098 80.288 63.677 1.00 21.26 A O +ATOM 907 N ASP A 197 101.129 79.334 63.203 1.00 21.92 A N +ATOM 908 CA ASP A 197 101.843 80.083 64.186 1.00 22.13 A C +ATOM 909 C ASP A 197 101.884 81.533 63.728 1.00 21.35 A C +ATOM 910 O ASP A 197 102.034 81.847 62.524 1.00 17.15 A O +ATOM 911 CB ASP A 197 103.222 79.494 64.312 1.00 24.44 A C +ATOM 912 CG ASP A 197 103.337 78.277 65.209 1.00 24.65 A C +ATOM 913 OD1 ASP A 197 102.648 78.155 66.217 1.00 27.04 A O +ATOM 914 OD2 ASP A 197 104.166 77.443 64.897 1.00 25.93 A O1- +ATOM 915 N ASP A 198 101.760 82.392 64.737 1.00 21.28 A N +ATOM 916 CA ASP A 198 101.769 83.828 64.486 1.00 22.46 A C +ATOM 917 C ASP A 198 103.004 84.202 63.743 1.00 23.48 A C +ATOM 918 O ASP A 198 102.898 84.905 62.754 1.00 22.36 A O +ATOM 919 CB ASP A 198 101.809 84.677 65.720 1.00 21.94 A C +ATOM 920 CG ASP A 198 100.615 84.593 66.648 1.00 22.85 A C +ATOM 921 OD1 ASP A 198 99.520 84.224 66.224 1.00 23.48 A O +ATOM 922 OD2 ASP A 198 100.780 84.927 67.817 1.00 22.62 A O1- +ATOM 923 N LYS A 199 104.148 83.641 64.137 1.00 25.83 A N +ATOM 924 CA LYS A 199 105.399 83.961 63.493 1.00 26.88 A C +ATOM 925 C LYS A 199 105.588 83.196 62.222 1.00 26.53 A C +ATOM 926 O LYS A 199 106.495 83.547 61.476 1.00 25.99 A O +ATOM 927 CB LYS A 199 106.556 83.636 64.381 1.00 28.57 A C +ATOM 928 CG LYS A 199 106.407 84.131 65.817 1.00 32.49 A C +ATOM 929 CD LYS A 199 106.320 85.644 66.021 1.00 34.87 A C +ATOM 930 CE LYS A 199 107.672 86.334 65.835 1.00 36.72 A C +ATOM 931 NZ LYS A 199 107.483 87.781 65.696 1.00 38.96 A N1+ +ATOM 932 N ASN A 200 104.774 82.177 61.899 1.00 26.64 A N +ATOM 933 CA ASN A 200 105.008 81.415 60.677 1.00 25.19 A C +ATOM 934 C ASN A 200 103.741 80.811 60.077 1.00 24.68 A C +ATOM 935 O ASN A 200 103.665 79.626 59.745 1.00 24.85 A O +ATOM 936 CB ASN A 200 106.075 80.356 61.045 1.00 23.81 A C +ATOM 937 CG ASN A 200 106.914 79.902 59.872 1.00 23.44 A C +ATOM 938 OD1 ASN A 200 106.894 80.499 58.803 1.00 21.02 A O +ATOM 939 ND2 ASN A 200 107.652 78.806 60.092 1.00 25.08 A N +ATOM 940 N ALA A 201 102.714 81.646 59.912 1.00 23.63 A N +ATOM 941 CA ALA A 201 101.433 81.232 59.383 1.00 21.25 A C +ATOM 942 C ALA A 201 101.418 80.813 57.921 1.00 20.54 A C +ATOM 943 O ALA A 201 102.339 81.216 57.186 1.00 21.69 A O +ATOM 944 CB ALA A 201 100.471 82.374 59.588 1.00 21.68 A C +ATOM 945 N THR A 202 100.450 79.972 57.505 1.00 18.04 A N +ATOM 946 CA THR A 202 100.304 79.532 56.121 1.00 16.25 A C +ATOM 947 C THR A 202 98.849 79.815 55.774 1.00 16.78 A C +ATOM 948 O THR A 202 97.924 79.746 56.590 1.00 18.06 A O +ATOM 949 CB THR A 202 100.727 77.969 55.937 1.00 16.70 A C +ATOM 950 OG1 THR A 202 100.030 77.315 54.860 1.00 13.73 A O +ATOM 951 CG2 THR A 202 100.407 77.197 57.111 1.00 15.53 A C +ATOM 952 N ALA A 203 98.746 80.357 54.573 1.00 15.58 A N +ATOM 953 CA ALA A 203 97.505 80.733 53.984 1.00 14.25 A C +ATOM 954 C ALA A 203 97.133 79.668 52.958 1.00 14.33 A C +ATOM 955 O ALA A 203 97.960 79.505 52.050 1.00 12.38 A O +ATOM 956 CB ALA A 203 97.651 82.056 53.252 1.00 12.34 A C +ATOM 957 N SER A 204 95.969 78.980 52.986 1.00 13.23 A N +ATOM 958 CA SER A 204 95.626 77.975 51.969 1.00 14.62 A C +ATOM 959 C SER A 204 94.646 78.542 50.951 1.00 14.45 A C +ATOM 960 O SER A 204 93.735 79.271 51.332 1.00 15.02 A O +ATOM 961 CB SER A 204 94.999 76.728 52.621 1.00 13.29 A C +ATOM 962 OG SER A 204 95.874 76.250 53.652 1.00 13.36 A O +ATOM 963 N PHE A 205 94.763 78.246 49.655 1.00 15.31 A N +ATOM 964 CA PHE A 205 93.839 78.789 48.680 1.00 12.99 A C +ATOM 965 C PHE A 205 93.007 77.596 48.246 1.00 12.58 A C +ATOM 966 O PHE A 205 93.481 76.711 47.515 1.00 12.30 A O +ATOM 967 CB PHE A 205 94.621 79.397 47.520 1.00 14.53 A C +ATOM 968 CG PHE A 205 95.393 80.627 47.990 1.00 16.93 A C +ATOM 969 CD1 PHE A 205 96.661 80.496 48.544 1.00 17.89 A C +ATOM 970 CD2 PHE A 205 94.812 81.878 47.960 1.00 17.43 A C +ATOM 971 CE1 PHE A 205 97.328 81.596 49.052 1.00 17.90 A C +ATOM 972 CE2 PHE A 205 95.488 82.974 48.468 1.00 17.96 A C +ATOM 973 CZ PHE A 205 96.739 82.834 49.024 1.00 17.61 A C +ATOM 974 N ILE A 206 91.756 77.535 48.721 1.00 8.96 A N +ATOM 975 CA ILE A 206 90.899 76.426 48.397 1.00 6.99 A C +ATOM 976 C ILE A 206 89.984 76.935 47.338 1.00 8.74 A C +ATOM 977 O ILE A 206 89.284 77.903 47.577 1.00 11.80 A O +ATOM 978 CB ILE A 206 90.177 76.040 49.653 1.00 3.66 A C +ATOM 979 CG1 ILE A 206 91.244 75.442 50.506 1.00 3.13 A C +ATOM 980 CG2 ILE A 206 89.010 75.102 49.437 1.00 2.00 A C +ATOM 981 CD1 ILE A 206 90.799 75.583 51.963 1.00 2.00 A C +ATOM 982 N TYR A 207 89.897 76.292 46.214 1.00 11.12 A N +ATOM 983 CA TYR A 207 89.066 76.703 45.122 1.00 11.13 A C +ATOM 984 C TYR A 207 88.242 75.499 44.676 1.00 14.34 A C +ATOM 985 O TYR A 207 88.775 74.430 44.363 1.00 12.80 A O +ATOM 986 CB TYR A 207 89.873 77.101 43.918 1.00 9.83 A C +ATOM 987 CG TYR A 207 89.020 77.643 42.782 1.00 8.75 A C +ATOM 988 CD1 TYR A 207 88.428 78.871 42.891 1.00 9.85 A C +ATOM 989 CD2 TYR A 207 88.857 76.915 41.645 1.00 8.85 A C +ATOM 990 CE1 TYR A 207 87.662 79.387 41.866 1.00 10.15 A C +ATOM 991 CE2 TYR A 207 88.109 77.412 40.617 1.00 9.04 A C +ATOM 992 CZ TYR A 207 87.520 78.627 40.742 1.00 9.64 A C +ATOM 993 OH TYR A 207 86.690 79.061 39.759 1.00 8.65 A O +ATOM 994 N ASP A 208 86.917 75.663 44.616 1.00 15.77 A N +ATOM 995 CA ASP A 208 86.043 74.624 44.167 1.00 16.39 A C +ATOM 996 C ASP A 208 86.283 73.314 44.878 1.00 16.52 A C +ATOM 997 O ASP A 208 86.467 72.254 44.289 1.00 16.39 A O +ATOM 998 CB ASP A 208 86.256 74.573 42.670 1.00 18.49 A C +ATOM 999 CG ASP A 208 85.312 73.682 41.932 1.00 21.51 A C +ATOM 1000 OD1 ASP A 208 84.107 73.881 41.985 1.00 23.45 A O +ATOM 1001 OD2 ASP A 208 85.799 72.766 41.289 1.00 24.85 A O1- +ATOM 1002 N GLY A 209 86.430 73.426 46.189 1.00 16.47 A N +ATOM 1003 CA GLY A 209 86.597 72.244 46.991 1.00 17.49 A C +ATOM 1004 C GLY A 209 87.988 71.705 47.100 1.00 19.78 A C +ATOM 1005 O GLY A 209 88.232 71.065 48.117 1.00 22.81 A O +ATOM 1006 N ARG A 210 88.923 71.942 46.182 1.00 20.44 A N +ATOM 1007 CA ARG A 210 90.290 71.447 46.252 1.00 19.70 A C +ATOM 1008 C ARG A 210 91.322 72.417 46.823 1.00 18.67 A C +ATOM 1009 O ARG A 210 91.131 73.624 46.685 1.00 18.15 A O +ATOM 1010 CB ARG A 210 90.859 71.108 44.886 1.00 22.59 A C +ATOM 1011 CG ARG A 210 89.981 71.067 43.640 1.00 24.91 A C +ATOM 1012 CD ARG A 210 89.828 69.600 43.364 1.00 28.85 A C +ATOM 1013 NE ARG A 210 89.018 69.297 42.191 1.00 31.54 A N +ATOM 1014 CZ ARG A 210 87.680 69.232 42.226 1.00 31.99 A C +ATOM 1015 NH1 ARG A 210 86.964 69.424 43.352 1.00 32.53 A N1+ +ATOM 1016 NH2 ARG A 210 87.070 68.946 41.079 1.00 32.23 A N +ATOM 1017 N LEU A 211 92.427 72.001 47.483 1.00 16.68 A N +ATOM 1018 CA LEU A 211 93.463 72.936 47.935 1.00 15.50 A C +ATOM 1019 C LEU A 211 94.148 73.196 46.607 1.00 15.96 A C +ATOM 1020 O LEU A 211 94.377 72.203 45.918 1.00 15.13 A O +ATOM 1021 CB LEU A 211 94.558 72.374 48.750 1.00 14.97 A C +ATOM 1022 CG LEU A 211 95.201 73.414 49.646 1.00 16.24 A C +ATOM 1023 CD1 LEU A 211 94.595 73.374 51.029 1.00 15.31 A C +ATOM 1024 CD2 LEU A 211 96.643 73.094 49.834 1.00 16.74 A C +ATOM 1025 N VAL A 212 94.442 74.412 46.129 1.00 16.38 A N +ATOM 1026 CA VAL A 212 95.102 74.624 44.833 1.00 14.08 A C +ATOM 1027 C VAL A 212 96.442 75.362 45.026 1.00 15.50 A C +ATOM 1028 O VAL A 212 97.287 75.323 44.125 1.00 16.40 A O +ATOM 1029 CB VAL A 212 94.182 75.459 43.909 1.00 14.15 A C +ATOM 1030 CG1 VAL A 212 94.822 75.666 42.550 1.00 12.84 A C +ATOM 1031 CG2 VAL A 212 92.918 74.735 43.649 1.00 11.26 A C +ATOM 1032 N ASP A 213 96.729 75.997 46.182 1.00 14.82 A N +ATOM 1033 CA ASP A 213 97.964 76.729 46.395 1.00 12.45 A C +ATOM 1034 C ASP A 213 98.141 77.132 47.851 1.00 11.86 A C +ATOM 1035 O ASP A 213 97.214 76.928 48.611 1.00 9.52 A O +ATOM 1036 CB ASP A 213 97.955 77.985 45.633 1.00 14.33 A C +ATOM 1037 CG ASP A 213 99.269 78.342 44.990 1.00 16.52 A C +ATOM 1038 OD1 ASP A 213 100.308 78.081 45.593 1.00 18.46 A O +ATOM 1039 OD2 ASP A 213 99.246 78.889 43.876 1.00 15.55 A O1- +ATOM 1040 N SER A 214 99.291 77.608 48.294 1.00 11.80 A N +ATOM 1041 CA SER A 214 99.473 78.063 49.665 1.00 14.83 A C +ATOM 1042 C SER A 214 100.660 79.023 49.638 1.00 15.33 A C +ATOM 1043 O SER A 214 101.411 79.059 48.632 1.00 13.50 A O +ATOM 1044 CB SER A 214 99.795 76.921 50.629 1.00 17.49 A C +ATOM 1045 OG SER A 214 100.725 75.994 50.084 1.00 19.42 A O +ATOM 1046 N ILE A 215 100.794 79.857 50.682 1.00 14.98 A N +ATOM 1047 CA ILE A 215 101.871 80.819 50.788 1.00 16.37 A C +ATOM 1048 C ILE A 215 102.236 80.895 52.264 1.00 15.25 A C +ATOM 1049 O ILE A 215 101.375 80.681 53.110 1.00 14.84 A O +ATOM 1050 CB ILE A 215 101.414 82.213 50.241 1.00 18.03 A C +ATOM 1051 CG1 ILE A 215 102.660 82.900 49.719 1.00 18.83 A C +ATOM 1052 CG2 ILE A 215 100.749 83.112 51.332 1.00 17.84 A C +ATOM 1053 CD1 ILE A 215 102.372 84.289 49.138 1.00 20.27 A C +ATOM 1054 N GLY A 216 103.485 81.135 52.629 1.00 15.24 A N +ATOM 1055 CA GLY A 216 103.840 81.220 54.037 1.00 13.48 A C +ATOM 1056 C GLY A 216 104.039 82.695 54.336 1.00 15.52 A C +ATOM 1057 O GLY A 216 104.177 83.532 53.442 1.00 13.66 A O +ATOM 1058 N SER A 217 104.128 82.986 55.612 1.00 14.89 A N +ATOM 1059 CA SER A 217 104.321 84.319 56.087 1.00 17.95 A C +ATOM 1060 C SER A 217 105.604 85.007 55.625 1.00 20.34 A C +ATOM 1061 O SER A 217 106.696 84.522 55.936 1.00 22.42 A O +ATOM 1062 CB SER A 217 104.263 84.221 57.571 1.00 16.67 A C +ATOM 1063 OG SER A 217 104.397 85.508 58.093 1.00 18.21 A O +ATOM 1064 N TRP A 218 105.496 86.158 54.936 1.00 20.99 A N +ATOM 1065 CA TRP A 218 106.632 86.899 54.453 1.00 19.71 A C +ATOM 1066 C TRP A 218 107.262 87.738 55.523 1.00 21.58 A C +ATOM 1067 O TRP A 218 108.484 87.845 55.499 1.00 24.40 A O +ATOM 1068 CB TRP A 218 106.278 87.815 53.290 1.00 20.88 A C +ATOM 1069 CG TRP A 218 104.959 88.581 53.316 1.00 21.72 A C +ATOM 1070 CD1 TRP A 218 104.829 89.822 53.888 1.00 22.16 A C +ATOM 1071 CD2 TRP A 218 103.788 88.158 52.731 1.00 22.34 A C +ATOM 1072 NE1 TRP A 218 103.594 90.195 53.655 1.00 22.16 A N +ATOM 1073 CE2 TRP A 218 102.945 89.239 52.963 1.00 22.83 A C +ATOM 1074 CE3 TRP A 218 103.340 87.052 52.045 1.00 21.05 A C +ATOM 1075 CZ2 TRP A 218 101.635 89.200 52.508 1.00 22.68 A C +ATOM 1076 CZ3 TRP A 218 102.042 87.038 51.599 1.00 20.95 A C +ATOM 1077 CH2 TRP A 218 101.193 88.088 51.826 1.00 21.81 A C +ATOM 1078 N SER A 219 106.589 88.400 56.440 1.00 20.55 A N +ATOM 1079 CA SER A 219 107.295 89.145 57.447 1.00 21.40 A C +ATOM 1080 C SER A 219 107.262 88.448 58.779 1.00 21.82 A C +ATOM 1081 O SER A 219 107.465 89.124 59.778 1.00 22.04 A O +ATOM 1082 CB SER A 219 106.717 90.551 57.639 1.00 21.38 A C +ATOM 1083 OG SER A 219 106.724 91.247 56.422 1.00 23.34 A O +ATOM 1084 N GLN A 220 106.930 87.167 58.908 1.00 22.58 A N +ATOM 1085 CA GLN A 220 106.964 86.501 60.212 1.00 22.98 A C +ATOM 1086 C GLN A 220 106.247 87.127 61.397 1.00 23.98 A C +ATOM 1087 O GLN A 220 106.552 86.925 62.585 1.00 23.73 A O +ATOM 1088 CB GLN A 220 108.434 86.252 60.579 1.00 24.52 A C +ATOM 1089 CG GLN A 220 109.157 85.275 59.642 1.00 28.22 A C +ATOM 1090 CD GLN A 220 109.606 85.895 58.322 1.00 31.58 A C +ATOM 1091 OE1 GLN A 220 110.345 86.885 58.332 1.00 34.49 A O +ATOM 1092 NE2 GLN A 220 109.226 85.453 57.124 1.00 32.02 A N +ATOM 1093 N ASN A 221 105.195 87.873 61.068 1.00 24.29 A N +ATOM 1094 CA ASN A 221 104.412 88.508 62.099 1.00 25.22 A C +ATOM 1095 C ASN A 221 102.951 88.666 61.683 1.00 24.53 A C +ATOM 1096 O ASN A 221 102.599 89.633 60.994 1.00 25.26 A O +ATOM 1097 CB ASN A 221 104.997 89.877 62.430 1.00 27.08 A C +ATOM 1098 CG ASN A 221 104.484 90.308 63.784 1.00 28.43 A C +ATOM 1099 OD1 ASN A 221 104.139 89.486 64.624 1.00 31.35 A O +ATOM 1100 ND2 ASN A 221 104.365 91.578 64.111 1.00 29.71 A N +ATOM 1101 N ILE A 222 102.193 87.601 62.028 1.00 21.08 A N +ATOM 1102 CA ILE A 222 100.765 87.396 61.790 1.00 17.10 A C +ATOM 1103 C ILE A 222 100.259 87.719 60.399 1.00 16.29 A C +ATOM 1104 O ILE A 222 99.796 88.818 60.120 1.00 18.20 A O +ATOM 1105 CB ILE A 222 100.008 88.191 62.863 1.00 15.67 A C +ATOM 1106 CG1 ILE A 222 100.529 87.708 64.182 1.00 15.05 A C +ATOM 1107 CG2 ILE A 222 98.499 87.959 62.828 1.00 16.13 A C +ATOM 1108 CD1 ILE A 222 99.815 88.254 65.414 1.00 15.90 A C +ATOM 1109 N LEU A 223 100.367 86.798 59.456 1.00 15.03 A N +ATOM 1110 CA LEU A 223 99.883 87.035 58.093 1.00 13.93 A C +ATOM 1111 C LEU A 223 98.361 87.204 58.281 1.00 15.13 A C +ATOM 1112 O LEU A 223 97.767 86.336 58.921 1.00 15.59 A O +ATOM 1113 CB LEU A 223 100.283 85.814 57.333 1.00 12.74 A C +ATOM 1114 CG LEU A 223 99.943 85.674 55.891 1.00 13.37 A C +ATOM 1115 CD1 LEU A 223 100.563 86.766 55.036 1.00 12.32 A C +ATOM 1116 CD2 LEU A 223 100.425 84.291 55.493 1.00 13.90 A C +ATOM 1117 N ARG A 224 97.681 88.262 57.822 1.00 14.84 A N +ATOM 1118 CA ARG A 224 96.265 88.469 58.045 1.00 15.69 A C +ATOM 1119 C ARG A 224 95.656 88.873 56.736 1.00 15.66 A C +ATOM 1120 O ARG A 224 96.423 89.226 55.833 1.00 17.32 A O +ATOM 1121 CB ARG A 224 95.971 89.623 58.955 1.00 17.53 A C +ATOM 1122 CG ARG A 224 97.050 90.153 59.859 1.00 19.78 A C +ATOM 1123 CD ARG A 224 97.224 91.678 59.998 1.00 22.38 A C +ATOM 1124 NE ARG A 224 98.392 91.814 60.863 1.00 25.99 A N +ATOM 1125 CZ ARG A 224 99.330 92.763 60.820 1.00 26.25 A C +ATOM 1126 NH1 ARG A 224 99.318 93.835 60.041 1.00 27.78 A N1+ +ATOM 1127 NH2 ARG A 224 100.310 92.669 61.681 1.00 28.54 A N +ATOM 1128 N THR A 225 94.317 88.975 56.627 1.00 15.20 A N +ATOM 1129 CA THR A 225 93.634 89.385 55.394 1.00 14.23 A C +ATOM 1130 C THR A 225 92.278 90.057 55.691 1.00 15.85 A C +ATOM 1131 O THR A 225 91.905 90.301 56.871 1.00 17.01 A O +ATOM 1132 CB THR A 225 93.504 88.128 54.503 1.00 14.21 A C +ATOM 1133 OG1 THR A 225 93.140 88.587 53.204 1.00 11.86 A O +ATOM 1134 CG2 THR A 225 92.540 87.103 55.051 1.00 12.27 A C +ATOM 1135 N GLN A 226 91.560 90.360 54.609 1.00 13.97 A N +ATOM 1136 CA GLN A 226 90.284 91.001 54.627 1.00 14.66 A C +ATOM 1137 C GLN A 226 89.277 90.879 55.776 1.00 15.95 A C +ATOM 1138 O GLN A 226 88.893 91.878 56.395 1.00 19.24 A O +ATOM 1139 CB GLN A 226 89.562 90.582 53.420 1.00 16.46 A C +ATOM 1140 CG GLN A 226 89.181 91.478 52.283 1.00 17.97 A C +ATOM 1141 CD GLN A 226 90.348 91.613 51.387 1.00 17.10 A C +ATOM 1142 OE1 GLN A 226 90.349 91.355 50.202 1.00 17.34 A O +ATOM 1143 NE2 GLN A 226 91.438 92.028 51.992 1.00 21.74 A N +ATOM 1144 N GLU A 227 88.778 89.651 56.000 1.00 13.29 A N +ATOM 1145 CA GLU A 227 87.757 89.258 56.958 1.00 11.35 A C +ATOM 1146 C GLU A 227 86.432 89.696 56.367 1.00 8.55 A C +ATOM 1147 O GLU A 227 85.451 89.981 57.062 1.00 6.37 A O +ATOM 1148 CB GLU A 227 87.881 89.867 58.378 1.00 14.42 A C +ATOM 1149 CG GLU A 227 89.218 89.795 59.017 1.00 18.18 A C +ATOM 1150 CD GLU A 227 89.852 88.415 59.270 1.00 22.37 A C +ATOM 1151 OE1 GLU A 227 89.899 87.645 58.311 1.00 23.33 A O +ATOM 1152 OE2 GLU A 227 90.364 88.130 60.378 1.00 23.57 A O1- +ATOM 1153 N SER A 228 86.336 89.718 55.022 1.00 3.95 A N +ATOM 1154 CA SER A 228 85.130 90.053 54.343 1.00 2.82 A C +ATOM 1155 C SER A 228 85.438 89.587 52.920 1.00 5.50 A C +ATOM 1156 O SER A 228 86.485 88.988 52.614 1.00 4.28 A O +ATOM 1157 CB SER A 228 84.820 91.576 54.434 1.00 4.84 A C +ATOM 1158 OG SER A 228 85.461 92.406 53.438 1.00 2.00 A O +ATOM 1159 N GLU A 229 84.589 89.834 51.978 1.00 8.31 A N +ATOM 1160 CA GLU A 229 84.774 89.338 50.634 1.00 9.87 A C +ATOM 1161 C GLU A 229 85.889 89.774 49.686 1.00 10.90 A C +ATOM 1162 O GLU A 229 86.174 90.978 49.529 1.00 13.31 A O +ATOM 1163 CB GLU A 229 83.381 89.570 50.122 1.00 11.21 A C +ATOM 1164 CG GLU A 229 83.144 89.603 48.669 1.00 14.39 A C +ATOM 1165 CD GLU A 229 81.779 90.151 48.352 1.00 15.02 A C +ATOM 1166 OE1 GLU A 229 81.607 91.341 48.493 1.00 12.93 A O +ATOM 1167 OE2 GLU A 229 80.905 89.404 47.898 1.00 17.48 A O1- +ATOM 1168 N CYS A 230 86.509 88.811 48.990 1.00 9.49 A N +ATOM 1169 CA CYS A 230 87.511 89.185 47.988 1.00 9.50 A C +ATOM 1170 C CYS A 230 86.701 89.507 46.715 1.00 8.22 A C +ATOM 1171 O CYS A 230 85.442 89.455 46.779 1.00 8.38 A O +ATOM 1172 CB CYS A 230 88.488 88.023 47.777 1.00 7.13 A C +ATOM 1173 SG CYS A 230 87.787 86.349 47.654 1.00 6.43 A S +ATOM 1174 N VAL A 231 87.177 89.931 45.532 1.00 5.46 A N +ATOM 1175 CA VAL A 231 86.224 90.152 44.460 1.00 8.01 A C +ATOM 1176 C VAL A 231 86.975 89.674 43.211 1.00 8.50 A C +ATOM 1177 O VAL A 231 88.194 89.770 43.157 1.00 8.28 A O +ATOM 1178 CB VAL A 231 85.723 91.693 44.441 1.00 9.19 A C +ATOM 1179 CG1 VAL A 231 86.263 92.482 45.627 1.00 6.62 A C +ATOM 1180 CG2 VAL A 231 86.120 92.363 43.162 1.00 8.50 A C +ATOM 1181 N CYS A 232 86.292 89.002 42.302 1.00 10.57 A N +ATOM 1182 CA CYS A 232 86.863 88.436 41.104 1.00 13.95 A C +ATOM 1183 C CYS A 232 86.245 89.116 39.890 1.00 15.47 A C +ATOM 1184 O CYS A 232 85.032 89.384 39.916 1.00 17.03 A O +ATOM 1185 CB CYS A 232 86.555 86.903 41.114 1.00 12.56 A C +ATOM 1186 SG CYS A 232 86.753 86.075 42.737 1.00 16.75 A S +ATOM 1187 N ILE A 233 87.024 89.430 38.845 1.00 16.82 A N +ATOM 1188 CA ILE A 233 86.518 90.038 37.623 1.00 18.65 A C +ATOM 1189 C ILE A 233 87.119 89.193 36.510 1.00 23.05 A C +ATOM 1190 O ILE A 233 88.327 88.940 36.525 1.00 24.40 A O +ATOM 1191 CB ILE A 233 86.982 91.485 37.399 1.00 16.90 A C +ATOM 1192 CG1 ILE A 233 86.487 92.376 38.514 1.00 15.24 A C +ATOM 1193 CG2 ILE A 233 86.402 92.007 36.095 1.00 15.91 A C +ATOM 1194 CD1 ILE A 233 86.719 93.863 38.272 1.00 15.24 A C +ATOM 1195 N ASN A 234 86.324 88.652 35.596 1.00 27.64 A N +ATOM 1196 CA ASN A 234 86.810 87.859 34.480 1.00 32.24 A C +ATOM 1197 C ASN A 234 87.628 86.627 34.807 1.00 31.09 A C +ATOM 1198 O ASN A 234 88.299 86.098 33.929 1.00 31.11 A O +ATOM 1199 CB ASN A 234 87.662 88.689 33.544 1.00 38.82 A C +ATOM 1200 CG ASN A 234 86.913 89.762 32.784 1.00 45.53 A C +ATOM 1201 OD1 ASN A 234 86.246 90.623 33.371 1.00 46.98 A O +ATOM 1202 ND2 ASN A 234 87.023 89.787 31.457 1.00 50.99 A N +ATOM 1203 N GLY A 235 87.590 86.069 36.007 1.00 28.93 A N +ATOM 1204 CA GLY A 235 88.380 84.888 36.284 1.00 26.49 A C +ATOM 1205 C GLY A 235 89.465 85.159 37.290 1.00 25.43 A C +ATOM 1206 O GLY A 235 89.842 84.205 37.966 1.00 26.44 A O +ATOM 1207 N THR A 236 89.933 86.402 37.498 1.00 23.58 A N +ATOM 1208 CA THR A 236 90.992 86.685 38.463 1.00 21.15 A C +ATOM 1209 C THR A 236 90.399 87.228 39.754 1.00 20.35 A C +ATOM 1210 O THR A 236 89.586 88.151 39.708 1.00 20.64 A O +ATOM 1211 CB THR A 236 91.923 87.680 37.766 1.00 22.34 A C +ATOM 1212 OG1 THR A 236 92.187 87.100 36.488 1.00 22.65 A O +ATOM 1213 CG2 THR A 236 93.227 87.937 38.484 1.00 20.97 A C +ATOM 1214 N CYS A 237 90.710 86.690 40.916 1.00 18.51 A N +ATOM 1215 CA CYS A 237 90.145 87.182 42.168 1.00 17.44 A C +ATOM 1216 C CYS A 237 91.237 87.935 42.881 1.00 16.47 A C +ATOM 1217 O CYS A 237 92.379 87.463 42.781 1.00 15.70 A O +ATOM 1218 CB CYS A 237 89.665 85.994 42.994 1.00 17.25 A C +ATOM 1219 SG CYS A 237 88.388 85.014 42.148 1.00 18.17 A S +ATOM 1220 N THR A 238 91.058 89.064 43.554 1.00 14.44 A N +ATOM 1221 CA THR A 238 92.231 89.653 44.155 1.00 15.29 A C +ATOM 1222 C THR A 238 92.005 89.704 45.650 1.00 15.56 A C +ATOM 1223 O THR A 238 90.824 89.781 46.017 1.00 15.86 A O +ATOM 1224 CB THR A 238 92.407 91.028 43.462 1.00 16.55 A C +ATOM 1225 OG1 THR A 238 93.521 91.606 44.134 1.00 17.68 A O +ATOM 1226 CG2 THR A 238 91.215 91.963 43.505 1.00 17.45 A C +ATOM 1227 N VAL A 239 92.998 89.518 46.515 1.00 13.91 A N +ATOM 1228 CA VAL A 239 92.727 89.610 47.953 1.00 15.74 A C +ATOM 1229 C VAL A 239 93.858 90.479 48.467 1.00 16.54 A C +ATOM 1230 O VAL A 239 94.898 90.516 47.790 1.00 18.47 A O +ATOM 1231 CB VAL A 239 92.726 88.194 48.695 1.00 15.38 A C +ATOM 1232 CG1 VAL A 239 94.100 87.617 48.752 1.00 15.81 A C +ATOM 1233 CG2 VAL A 239 92.433 88.317 50.180 1.00 15.69 A C +ATOM 1234 N VAL A 240 93.776 91.184 49.598 1.00 15.65 A N +ATOM 1235 CA VAL A 240 94.901 91.984 49.990 1.00 16.02 A C +ATOM 1236 C VAL A 240 95.260 91.379 51.325 1.00 16.33 A C +ATOM 1237 O VAL A 240 94.314 91.173 52.104 1.00 16.66 A O +ATOM 1238 CB VAL A 240 94.597 93.579 50.147 1.00 15.97 A C +ATOM 1239 CG1 VAL A 240 93.605 94.023 49.062 1.00 13.83 A C +ATOM 1240 CG2 VAL A 240 94.068 93.965 51.509 1.00 16.04 A C +ATOM 1241 N MET A 241 96.545 91.106 51.606 1.00 14.36 A N +ATOM 1242 CA MET A 241 96.961 90.526 52.882 1.00 16.32 A C +ATOM 1243 C MET A 241 98.077 91.341 53.506 1.00 15.58 A C +ATOM 1244 O MET A 241 98.739 92.088 52.769 1.00 14.27 A O +ATOM 1245 CB MET A 241 97.524 89.115 52.725 1.00 16.66 A C +ATOM 1246 CG MET A 241 96.609 88.114 52.088 1.00 17.09 A C +ATOM 1247 SD MET A 241 97.336 86.465 52.168 1.00 16.16 A S +ATOM 1248 CE MET A 241 97.112 86.395 50.433 1.00 16.01 A C +ATOM 1249 N THR A 242 98.316 91.323 54.810 1.00 15.88 A N +ATOM 1250 CA THR A 242 99.426 92.089 55.285 1.00 18.11 A C +ATOM 1251 C THR A 242 100.076 91.251 56.359 1.00 19.22 A C +ATOM 1252 O THR A 242 99.429 90.381 56.952 1.00 19.73 A O +ATOM 1253 CB THR A 242 99.005 93.566 55.788 1.00 20.26 A C +ATOM 1254 OG1 THR A 242 99.060 93.680 57.211 1.00 21.00 A O +ATOM 1255 CG2 THR A 242 97.648 93.928 55.273 1.00 19.62 A C +ATOM 1256 N ASP A 243 101.365 91.484 56.591 1.00 19.36 A N +ATOM 1257 CA ASP A 243 102.169 90.755 57.558 1.00 19.19 A C +ATOM 1258 C ASP A 243 103.079 91.806 58.126 1.00 18.94 A C +ATOM 1259 O ASP A 243 103.647 92.543 57.316 1.00 18.09 A O +ATOM 1260 CB ASP A 243 102.951 89.747 56.779 1.00 19.15 A C +ATOM 1261 CG ASP A 243 103.505 88.536 57.478 1.00 19.44 A C +ATOM 1262 OD1 ASP A 243 103.645 88.497 58.706 1.00 17.47 A O +ATOM 1263 OD2 ASP A 243 103.781 87.610 56.710 1.00 20.47 A O1- +ATOM 1264 N GLY A 244 103.291 91.968 59.414 1.00 19.69 A N +ATOM 1265 CA GLY A 244 104.172 93.007 59.857 1.00 21.13 A C +ATOM 1266 C GLY A 244 103.686 93.497 61.191 1.00 24.59 A C +ATOM 1267 O GLY A 244 103.051 92.755 61.936 1.00 24.30 A O +ATOM 1268 N SER A 245 103.985 94.733 61.546 1.00 26.79 A N +ATOM 1269 CA SER A 245 103.543 95.227 62.825 1.00 29.19 A C +ATOM 1270 C SER A 245 102.081 95.637 62.779 1.00 29.95 A C +ATOM 1271 O SER A 245 101.550 95.993 61.723 1.00 31.02 A O +ATOM 1272 CB SER A 245 104.415 96.396 63.191 1.00 29.99 A C +ATOM 1273 OG SER A 245 104.247 96.599 64.590 1.00 31.83 A O +ATOM 1274 N ALA A 246 101.429 95.598 63.944 1.00 31.51 A N +ATOM 1275 CA ALA A 246 100.024 95.973 64.083 1.00 32.60 A C +ATOM 1276 C ALA A 246 99.961 97.473 64.097 1.00 33.80 A C +ATOM 1277 O ALA A 246 99.112 98.080 63.443 1.00 35.06 A O +ATOM 1278 CB ALA A 246 99.389 95.568 65.402 1.00 32.34 A C +ATOM 1279 N SER A 247 100.852 98.050 64.886 1.00 33.86 A N +ATOM 1280 CA SER A 247 100.943 99.480 65.026 1.00 34.52 A C +ATOM 1281 C SER A 247 102.424 99.727 64.876 1.00 33.45 A C +ATOM 1282 O SER A 247 103.190 99.650 65.840 1.00 33.45 A O +ATOM 1283 CB SER A 247 100.444 99.901 66.411 1.00 36.04 A C +ATOM 1284 OG SER A 247 99.073 99.499 66.514 1.00 38.86 A O +ATOM 1285 N GLY A 248 102.732 99.867 63.598 1.00 30.87 A N +ATOM 1286 CA GLY A 248 104.052 100.107 63.115 1.00 31.23 A C +ATOM 1287 C GLY A 248 104.006 99.925 61.615 1.00 31.53 A C +ATOM 1288 O GLY A 248 102.946 99.692 61.052 1.00 30.48 A O +ATOM 1289 N ARG A 249 105.132 100.025 60.931 1.00 33.50 A N +ATOM 1290 CA ARG A 249 105.182 99.853 59.488 1.00 35.38 A C +ATOM 1291 C ARG A 249 104.912 98.366 59.245 1.00 35.20 A C +ATOM 1292 O ARG A 249 105.352 97.561 60.086 1.00 35.69 A O +ATOM 1293 CB ARG A 249 106.573 100.283 59.001 1.00 38.50 A C +ATOM 1294 CG ARG A 249 106.743 100.087 57.481 1.00 42.63 A C +ATOM 1295 CD ARG A 249 107.504 101.182 56.706 1.00 46.33 A C +ATOM 1296 NE ARG A 249 108.929 101.237 56.998 1.00 49.77 A N +ATOM 1297 CZ ARG A 249 109.450 102.107 57.886 1.00 52.17 A C +ATOM 1298 NH1 ARG A 249 108.686 103.000 58.570 1.00 52.87 A N1+ +ATOM 1299 NH2 ARG A 249 110.778 102.082 58.093 1.00 52.90 A N +ATOM 1300 N ALA A 250 104.202 97.939 58.186 1.00 32.59 A N +ATOM 1301 CA ALA A 250 103.927 96.530 57.958 1.00 30.25 A C +ATOM 1302 C ALA A 250 104.030 96.243 56.481 1.00 29.43 A C +ATOM 1303 O ALA A 250 104.056 97.158 55.665 1.00 29.95 A O +ATOM 1304 CB ALA A 250 102.519 96.161 58.394 1.00 30.51 A C +ATOM 1305 N ASP A 251 104.041 95.000 56.056 1.00 28.09 A N +ATOM 1306 CA ASP A 251 104.164 94.679 54.649 1.00 26.88 A C +ATOM 1307 C ASP A 251 102.836 94.173 54.136 1.00 25.52 A C +ATOM 1308 O ASP A 251 102.362 93.146 54.623 1.00 24.94 A O +ATOM 1309 CB ASP A 251 105.210 93.622 54.515 1.00 29.19 A C +ATOM 1310 CG ASP A 251 105.695 93.300 53.117 1.00 30.44 A C +ATOM 1311 OD1 ASP A 251 104.952 93.419 52.131 1.00 31.27 A O +ATOM 1312 OD2 ASP A 251 106.862 92.902 53.038 1.00 32.73 A O1- +ATOM 1313 N THR A 252 102.328 94.842 53.093 1.00 22.09 A N +ATOM 1314 CA THR A 252 101.070 94.577 52.451 1.00 19.13 A C +ATOM 1315 C THR A 252 101.243 94.156 51.022 1.00 19.75 A C +ATOM 1316 O THR A 252 101.927 94.880 50.313 1.00 19.16 A O +ATOM 1317 CB THR A 252 100.212 95.877 52.530 1.00 18.82 A C +ATOM 1318 OG1 THR A 252 99.847 96.093 53.913 1.00 17.94 A O +ATOM 1319 CG2 THR A 252 99.005 95.813 51.594 1.00 17.53 A C +ATOM 1320 N ARG A 253 100.625 93.075 50.540 1.00 20.65 A N +ATOM 1321 CA ARG A 253 100.737 92.638 49.157 1.00 20.42 A C +ATOM 1322 C ARG A 253 99.287 92.339 48.802 1.00 20.62 A C +ATOM 1323 O ARG A 253 98.479 91.974 49.681 1.00 18.85 A O +ATOM 1324 CB ARG A 253 101.524 91.357 49.000 1.00 22.45 A C +ATOM 1325 CG ARG A 253 102.734 91.122 49.918 1.00 23.78 A C +ATOM 1326 CD ARG A 253 104.037 91.639 49.388 1.00 26.35 A C +ATOM 1327 NE ARG A 253 104.943 90.512 49.220 1.00 28.90 A N +ATOM 1328 CZ ARG A 253 105.897 90.138 50.099 1.00 29.79 A C +ATOM 1329 NH1 ARG A 253 106.145 90.785 51.239 1.00 28.19 A N1+ +ATOM 1330 NH2 ARG A 253 106.629 89.059 49.789 1.00 29.61 A N +ATOM 1331 N ILE A 254 98.975 92.558 47.522 1.00 19.26 A N +ATOM 1332 CA ILE A 254 97.676 92.349 46.939 1.00 19.90 A C +ATOM 1333 C ILE A 254 97.950 91.128 46.063 1.00 19.91 A C +ATOM 1334 O ILE A 254 98.882 91.184 45.267 1.00 20.22 A O +ATOM 1335 CB ILE A 254 97.271 93.613 46.098 1.00 20.20 A C +ATOM 1336 CG1 ILE A 254 96.743 94.700 47.001 1.00 19.25 A C +ATOM 1337 CG2 ILE A 254 96.242 93.248 45.027 1.00 20.42 A C +ATOM 1338 CD1 ILE A 254 97.875 95.498 47.618 1.00 21.32 A C +ATOM 1339 N LEU A 255 97.221 90.019 46.167 1.00 20.46 A N +ATOM 1340 CA LEU A 255 97.470 88.838 45.368 1.00 21.41 A C +ATOM 1341 C LEU A 255 96.409 88.694 44.327 1.00 21.60 A C +ATOM 1342 O LEU A 255 95.256 88.966 44.649 1.00 23.35 A O +ATOM 1343 CB LEU A 255 97.389 87.587 46.147 1.00 21.20 A C +ATOM 1344 CG LEU A 255 98.103 87.381 47.441 1.00 21.46 A C +ATOM 1345 CD1 LEU A 255 98.508 85.925 47.367 1.00 22.54 A C +ATOM 1346 CD2 LEU A 255 99.359 88.207 47.663 1.00 21.84 A C +ATOM 1347 N PHE A 256 96.762 88.257 43.136 1.00 22.62 A N +ATOM 1348 CA PHE A 256 95.812 88.054 42.051 1.00 24.46 A C +ATOM 1349 C PHE A 256 95.783 86.540 41.885 1.00 25.11 A C +ATOM 1350 O PHE A 256 96.844 85.910 41.735 1.00 24.19 A O +ATOM 1351 CB PHE A 256 96.292 88.681 40.755 1.00 25.40 A C +ATOM 1352 CG PHE A 256 96.224 90.190 40.837 1.00 27.34 A C +ATOM 1353 CD1 PHE A 256 97.220 90.882 41.500 1.00 27.09 A C +ATOM 1354 CD2 PHE A 256 95.153 90.850 40.251 1.00 27.96 A C +ATOM 1355 CE1 PHE A 256 97.161 92.248 41.567 1.00 27.36 A C +ATOM 1356 CE2 PHE A 256 95.107 92.229 40.326 1.00 28.96 A C +ATOM 1357 CZ PHE A 256 96.109 92.920 40.990 1.00 28.71 A C +ATOM 1358 N ILE A 257 94.616 85.892 41.907 1.00 24.23 A N +ATOM 1359 CA ILE A 257 94.623 84.454 41.791 1.00 24.15 A C +ATOM 1360 C ILE A 257 93.590 83.923 40.823 1.00 24.87 A C +ATOM 1361 O ILE A 257 92.431 84.328 40.832 1.00 26.62 A O +ATOM 1362 CB ILE A 257 94.539 83.836 43.290 1.00 22.86 A C +ATOM 1363 CG1 ILE A 257 93.415 82.885 43.347 1.00 22.35 A C +ATOM 1364 CG2 ILE A 257 94.434 84.886 44.430 1.00 21.01 A C +ATOM 1365 CD1 ILE A 257 93.539 82.208 44.720 1.00 23.79 A C +ATOM 1366 N GLU A 258 94.022 83.040 39.948 1.00 25.56 A N +ATOM 1367 CA GLU A 258 93.139 82.463 38.970 1.00 27.44 A C +ATOM 1368 C GLU A 258 92.919 81.023 39.355 1.00 27.51 A C +ATOM 1369 O GLU A 258 93.890 80.312 39.612 1.00 29.14 A O +ATOM 1370 CB GLU A 258 93.765 82.545 37.630 1.00 28.99 A C +ATOM 1371 CG GLU A 258 93.892 84.019 37.345 1.00 31.91 A C +ATOM 1372 CD GLU A 258 94.560 84.412 36.041 1.00 34.54 A C +ATOM 1373 OE1 GLU A 258 94.760 83.570 35.143 1.00 35.42 A O +ATOM 1374 OE2 GLU A 258 94.876 85.604 35.950 1.00 36.00 A O1- +ATOM 1375 N GLU A 259 91.659 80.595 39.483 1.00 26.36 A N +ATOM 1376 CA GLU A 259 91.279 79.256 39.864 1.00 24.73 A C +ATOM 1377 C GLU A 259 92.014 78.740 41.097 1.00 23.00 A C +ATOM 1378 O GLU A 259 92.422 77.588 41.121 1.00 24.03 A O +ATOM 1379 CB GLU A 259 91.495 78.302 38.684 1.00 26.16 A C +ATOM 1380 CG GLU A 259 90.369 78.433 37.686 1.00 29.47 A C +ATOM 1381 CD GLU A 259 90.556 77.664 36.380 1.00 31.40 A C +ATOM 1382 OE1 GLU A 259 91.596 77.806 35.720 1.00 33.21 A O +ATOM 1383 OE2 GLU A 259 89.658 76.908 36.006 1.00 32.87 A O1- +ATOM 1384 N GLY A 260 92.205 79.511 42.169 1.00 21.05 A N +ATOM 1385 CA GLY A 260 92.904 79.030 43.347 1.00 17.61 A C +ATOM 1386 C GLY A 260 94.441 79.189 43.301 1.00 17.77 A C +ATOM 1387 O GLY A 260 95.094 79.243 44.344 1.00 14.73 A O +ATOM 1388 N LYS A 261 95.038 79.378 42.132 1.00 16.75 A N +ATOM 1389 CA LYS A 261 96.473 79.499 41.930 1.00 18.69 A C +ATOM 1390 C LYS A 261 96.909 80.956 41.909 1.00 18.55 A C +ATOM 1391 O LYS A 261 96.387 81.769 41.120 1.00 17.04 A O +ATOM 1392 CB LYS A 261 96.797 78.805 40.597 1.00 21.22 A C +ATOM 1393 CG LYS A 261 98.191 78.875 39.990 1.00 25.73 A C +ATOM 1394 CD LYS A 261 99.241 78.218 40.884 1.00 29.77 A C +ATOM 1395 CE LYS A 261 99.007 76.723 41.240 1.00 32.07 A C +ATOM 1396 NZ LYS A 261 99.849 76.296 42.368 1.00 33.36 A N1+ +ATOM 1397 N ILE A 262 97.838 81.333 42.789 1.00 17.02 A N +ATOM 1398 CA ILE A 262 98.331 82.679 42.815 1.00 16.89 A C +ATOM 1399 C ILE A 262 99.011 83.006 41.483 1.00 18.78 A C +ATOM 1400 O ILE A 262 99.999 82.358 41.131 1.00 19.95 A O +ATOM 1401 CB ILE A 262 99.297 82.811 43.933 1.00 15.64 A C +ATOM 1402 CG1 ILE A 262 98.590 82.574 45.227 1.00 14.91 A C +ATOM 1403 CG2 ILE A 262 99.943 84.192 43.841 1.00 15.35 A C +ATOM 1404 CD1 ILE A 262 99.508 82.521 46.467 1.00 13.90 A C +ATOM 1405 N VAL A 263 98.501 83.967 40.712 1.00 18.22 A N +ATOM 1406 CA VAL A 263 99.137 84.281 39.456 1.00 18.73 A C +ATOM 1407 C VAL A 263 99.978 85.545 39.499 1.00 19.13 A C +ATOM 1408 O VAL A 263 100.612 85.819 38.485 1.00 20.36 A O +ATOM 1409 CB VAL A 263 98.094 84.409 38.328 1.00 18.60 A C +ATOM 1410 CG1 VAL A 263 97.486 83.035 38.121 1.00 19.07 A C +ATOM 1411 CG2 VAL A 263 97.026 85.450 38.664 1.00 19.05 A C +ATOM 1412 N HIS A 264 100.035 86.374 40.551 1.00 18.29 A N +ATOM 1413 CA HIS A 264 100.870 87.559 40.572 1.00 17.07 A C +ATOM 1414 C HIS A 264 100.760 88.102 41.966 1.00 16.79 A C +ATOM 1415 O HIS A 264 99.783 87.806 42.632 1.00 16.10 A O +ATOM 1416 CB HIS A 264 100.382 88.655 39.631 1.00 19.71 A C +ATOM 1417 CG HIS A 264 101.353 89.834 39.491 1.00 21.47 A C +ATOM 1418 ND1 HIS A 264 101.663 90.839 40.335 1.00 22.10 A N +ATOM 1419 CD2 HIS A 264 102.150 90.001 38.367 1.00 21.65 A C +ATOM 1420 CE1 HIS A 264 102.592 91.576 39.783 1.00 21.98 A C +ATOM 1421 NE2 HIS A 264 102.874 91.065 38.603 1.00 21.98 A N +ATOM 1422 N ILE A 265 101.718 88.847 42.490 1.00 16.22 A N +ATOM 1423 CA ILE A 265 101.613 89.429 43.825 1.00 16.79 A C +ATOM 1424 C ILE A 265 102.113 90.842 43.603 1.00 18.41 A C +ATOM 1425 O ILE A 265 103.074 91.007 42.830 1.00 20.46 A O +ATOM 1426 CB ILE A 265 102.493 88.684 44.787 1.00 16.20 A C +ATOM 1427 CG1 ILE A 265 102.024 87.233 44.975 1.00 16.78 A C +ATOM 1428 CG2 ILE A 265 102.511 89.497 46.038 1.00 16.73 A C +ATOM 1429 CD1 ILE A 265 102.537 86.590 46.286 1.00 18.23 A C +ATOM 1430 N SER A 266 101.427 91.876 44.078 1.00 18.76 A N +ATOM 1431 CA SER A 266 101.876 93.254 43.899 1.00 17.51 A C +ATOM 1432 C SER A 266 102.008 93.851 45.274 1.00 17.42 A C +ATOM 1433 O SER A 266 101.154 93.643 46.142 1.00 18.45 A O +ATOM 1434 CB SER A 266 100.868 94.026 43.098 1.00 17.54 A C +ATOM 1435 OG SER A 266 100.845 93.494 41.782 1.00 17.48 A O +ATOM 1436 N PRO A 267 103.106 94.503 45.595 1.00 17.01 A N +ATOM 1437 CA PRO A 267 103.224 95.237 46.828 1.00 16.11 A C +ATOM 1438 C PRO A 267 102.422 96.520 46.752 1.00 16.58 A C +ATOM 1439 O PRO A 267 102.150 97.080 45.661 1.00 16.92 A O +ATOM 1440 CB PRO A 267 104.688 95.418 46.942 1.00 16.30 A C +ATOM 1441 CG PRO A 267 105.047 95.664 45.507 1.00 16.26 A C +ATOM 1442 CD PRO A 267 104.345 94.514 44.844 1.00 16.94 A C +ATOM 1443 N LEU A 268 102.029 96.937 47.950 1.00 15.19 A N +ATOM 1444 CA LEU A 268 101.278 98.162 48.103 1.00 16.85 A C +ATOM 1445 C LEU A 268 102.125 99.340 47.604 1.00 19.73 A C +ATOM 1446 O LEU A 268 103.359 99.414 47.774 1.00 21.06 A O +ATOM 1447 CB LEU A 268 100.937 98.388 49.565 1.00 15.07 A C +ATOM 1448 CG LEU A 268 100.144 99.593 49.890 1.00 13.63 A C +ATOM 1449 CD1 LEU A 268 98.842 99.594 49.143 1.00 13.32 A C +ATOM 1450 CD2 LEU A 268 99.931 99.600 51.364 1.00 13.51 A C +ATOM 1451 N ALA A 269 101.424 100.304 47.032 1.00 21.38 A N +ATOM 1452 CA ALA A 269 102.055 101.484 46.486 1.00 21.20 A C +ATOM 1453 C ALA A 269 101.172 102.668 46.868 1.00 22.46 A C +ATOM 1454 O ALA A 269 100.068 102.460 47.405 1.00 22.41 A O +ATOM 1455 CB ALA A 269 102.106 101.332 44.987 1.00 19.84 A C +ATOM 1456 N GLY A 270 101.601 103.909 46.579 1.00 22.40 A N +ATOM 1457 CA GLY A 270 100.820 105.105 46.883 1.00 21.12 A C +ATOM 1458 C GLY A 270 101.015 105.597 48.309 1.00 19.98 A C +ATOM 1459 O GLY A 270 102.001 105.221 48.932 1.00 21.39 A O +ATOM 1460 N SER A 271 100.090 106.364 48.874 1.00 20.10 A N +ATOM 1461 CA SER A 271 100.275 106.889 50.196 1.00 19.85 A C +ATOM 1462 C SER A 271 99.747 106.266 51.467 1.00 21.40 A C +ATOM 1463 O SER A 271 100.038 106.836 52.538 1.00 22.31 A O +ATOM 1464 CB SER A 271 99.835 108.362 50.116 1.00 20.43 A C +ATOM 1465 OG SER A 271 98.569 108.694 49.522 1.00 19.55 A O +ATOM 1466 N ALA A 272 99.066 105.104 51.474 1.00 22.31 A N +ATOM 1467 CA ALA A 272 98.545 104.542 52.717 1.00 22.68 A C +ATOM 1468 C ALA A 272 99.700 104.107 53.606 1.00 22.99 A C +ATOM 1469 O ALA A 272 100.691 103.586 53.117 1.00 21.33 A O +ATOM 1470 CB ALA A 272 97.640 103.377 52.385 1.00 22.04 A C +ATOM 1471 N GLN A 273 99.615 104.292 54.913 1.00 24.43 A N +ATOM 1472 CA GLN A 273 100.729 103.951 55.786 1.00 26.37 A C +ATOM 1473 C GLN A 273 100.608 102.640 56.483 1.00 27.25 A C +ATOM 1474 O GLN A 273 101.605 102.121 56.996 1.00 28.55 A O +ATOM 1475 CB GLN A 273 100.947 104.940 56.919 1.00 27.20 A C +ATOM 1476 CG GLN A 273 101.232 106.309 56.383 1.00 30.02 A C +ATOM 1477 CD GLN A 273 102.694 106.666 56.252 1.00 31.44 A C +ATOM 1478 OE1 GLN A 273 103.375 107.033 57.213 1.00 31.51 A O +ATOM 1479 NE2 GLN A 273 103.177 106.540 55.019 1.00 32.54 A N +ATOM 1480 N HIS A 274 99.375 102.177 56.639 1.00 26.49 A N +ATOM 1481 CA HIS A 274 99.106 100.915 57.299 1.00 25.01 A C +ATOM 1482 C HIS A 274 97.807 100.462 56.680 1.00 24.43 A C +ATOM 1483 O HIS A 274 96.942 101.299 56.438 1.00 25.76 A O +ATOM 1484 CB HIS A 274 98.897 101.107 58.736 1.00 24.78 A C +ATOM 1485 CG HIS A 274 99.137 99.829 59.498 1.00 25.33 A C +ATOM 1486 ND1 HIS A 274 100.254 99.125 59.571 1.00 25.80 A N +ATOM 1487 CD2 HIS A 274 98.227 99.245 60.333 1.00 24.83 A C +ATOM 1488 CE1 HIS A 274 100.064 98.155 60.426 1.00 25.85 A C +ATOM 1489 NE2 HIS A 274 98.842 98.241 60.877 1.00 25.79 A N +ATOM 1490 N VAL A 275 97.661 99.201 56.325 1.00 22.04 A N +ATOM 1491 CA VAL A 275 96.460 98.681 55.728 1.00 18.48 A C +ATOM 1492 C VAL A 275 96.106 97.354 56.389 1.00 18.43 A C +ATOM 1493 O VAL A 275 96.902 96.437 56.483 1.00 18.35 A O +ATOM 1494 CB VAL A 275 96.740 98.508 54.267 1.00 17.24 A C +ATOM 1495 CG1 VAL A 275 95.627 97.746 53.595 1.00 14.61 A C +ATOM 1496 CG2 VAL A 275 96.909 99.886 53.659 1.00 16.00 A C +ATOM 1497 N GLU A 276 94.972 97.230 57.029 1.00 18.36 A N +ATOM 1498 CA GLU A 276 94.557 95.969 57.616 1.00 16.37 A C +ATOM 1499 C GLU A 276 93.104 95.834 57.156 1.00 16.48 A C +ATOM 1500 O GLU A 276 92.557 96.752 56.512 1.00 17.74 A O +ATOM 1501 CB GLU A 276 94.613 96.041 59.104 1.00 15.91 A C +ATOM 1502 CG GLU A 276 96.024 96.005 59.577 1.00 15.12 A C +ATOM 1503 CD GLU A 276 96.142 95.652 61.058 1.00 16.62 A C +ATOM 1504 OE1 GLU A 276 95.284 96.033 61.850 1.00 17.02 A O +ATOM 1505 OE2 GLU A 276 97.103 94.986 61.438 1.00 16.74 A O1- +ATOM 1506 N GLU A 277 92.505 94.662 57.321 1.00 13.36 A N +ATOM 1507 CA GLU A 277 91.108 94.387 56.999 1.00 10.99 A C +ATOM 1508 C GLU A 277 90.396 95.072 55.837 1.00 11.51 A C +ATOM 1509 O GLU A 277 89.341 95.693 56.008 1.00 10.69 A O +ATOM 1510 CB GLU A 277 90.355 94.615 58.310 1.00 7.81 A C +ATOM 1511 CG GLU A 277 90.799 93.499 59.204 1.00 6.31 A C +ATOM 1512 CD GLU A 277 90.497 93.679 60.683 1.00 8.38 A C +ATOM 1513 OE1 GLU A 277 90.188 94.767 61.135 1.00 7.68 A O +ATOM 1514 OE2 GLU A 277 90.576 92.690 61.400 1.00 10.01 A O1- +ATOM 1515 N CYS A 278 90.920 95.042 54.620 1.00 11.77 A N +ATOM 1516 CA CYS A 278 90.177 95.716 53.584 1.00 13.07 A C +ATOM 1517 C CYS A 278 88.757 95.247 53.283 1.00 14.21 A C +ATOM 1518 O CYS A 278 88.499 94.047 53.309 1.00 16.63 A O +ATOM 1519 CB CYS A 278 90.935 95.654 52.287 1.00 13.37 A C +ATOM 1520 SG CYS A 278 92.399 96.696 52.492 1.00 15.49 A S +ATOM 1521 N SER A 279 87.829 96.185 53.033 1.00 15.71 A N +ATOM 1522 CA SER A 279 86.433 95.975 52.659 1.00 13.97 A C +ATOM 1523 C SER A 279 86.526 96.373 51.202 1.00 15.10 A C +ATOM 1524 O SER A 279 86.592 97.554 50.879 1.00 17.24 A O +ATOM 1525 CB SER A 279 85.560 96.918 53.474 1.00 14.11 A C +ATOM 1526 OG SER A 279 85.579 96.388 54.810 1.00 13.14 A O +ATOM 1527 N CYS A 280 86.573 95.436 50.277 1.00 14.67 A N +ATOM 1528 CA CYS A 280 86.733 95.722 48.865 1.00 14.55 A C +ATOM 1529 C CYS A 280 85.499 95.530 48.021 1.00 14.70 A C +ATOM 1530 O CYS A 280 84.616 94.734 48.402 1.00 14.75 A O +ATOM 1531 CB CYS A 280 87.841 94.854 48.303 1.00 15.64 A C +ATOM 1532 SG CYS A 280 89.457 95.011 49.102 1.00 18.00 A S +ATOM 1533 N TYR A 281 85.389 96.195 46.856 1.00 12.11 A N +ATOM 1534 CA TYR A 281 84.177 96.024 46.091 1.00 13.38 A C +ATOM 1535 C TYR A 281 84.449 96.195 44.611 1.00 14.49 A C +ATOM 1536 O TYR A 281 85.391 96.918 44.314 1.00 14.48 A O +ATOM 1537 CB TYR A 281 83.114 97.058 46.609 1.00 11.40 A C +ATOM 1538 CG TYR A 281 83.488 98.547 46.639 1.00 10.51 A C +ATOM 1539 CD1 TYR A 281 83.342 99.286 45.484 1.00 9.61 A C +ATOM 1540 CD2 TYR A 281 83.935 99.175 47.802 1.00 10.54 A C +ATOM 1541 CE1 TYR A 281 83.629 100.634 45.468 1.00 9.83 A C +ATOM 1542 CE2 TYR A 281 84.226 100.530 47.787 1.00 10.50 A C +ATOM 1543 CZ TYR A 281 84.068 101.250 46.609 1.00 11.06 A C +ATOM 1544 OH TYR A 281 84.360 102.619 46.534 1.00 12.54 A O +ATOM 1545 N PRO A 282 83.772 95.538 43.673 1.00 17.10 A N +ATOM 1546 CA PRO A 282 83.953 95.721 42.243 1.00 19.06 A C +ATOM 1547 C PRO A 282 83.608 97.108 41.769 1.00 21.90 A C +ATOM 1548 O PRO A 282 82.479 97.583 41.970 1.00 24.27 A O +ATOM 1549 CB PRO A 282 83.071 94.691 41.583 1.00 18.49 A C +ATOM 1550 CG PRO A 282 81.985 94.431 42.602 1.00 17.75 A C +ATOM 1551 CD PRO A 282 82.733 94.543 43.926 1.00 18.02 A C +ATOM 1552 N ARG A 283 84.543 97.729 41.070 1.00 23.06 A N +ATOM 1553 CA ARG A 283 84.302 99.051 40.564 1.00 23.23 A C +ATOM 1554 C ARG A 283 84.893 98.982 39.179 1.00 22.32 A C +ATOM 1555 O ARG A 283 85.898 99.611 38.891 1.00 21.93 A O +ATOM 1556 CB ARG A 283 85.025 100.020 41.472 1.00 25.37 A C +ATOM 1557 CG ARG A 283 84.280 101.323 41.413 1.00 28.30 A C +ATOM 1558 CD ARG A 283 85.106 102.336 42.136 1.00 30.73 A C +ATOM 1559 NE ARG A 283 85.879 102.979 41.104 1.00 33.86 A N +ATOM 1560 CZ ARG A 283 85.457 104.108 40.526 1.00 34.94 A C +ATOM 1561 NH1 ARG A 283 84.374 104.766 40.967 1.00 35.07 A N1+ +ATOM 1562 NH2 ARG A 283 86.209 104.628 39.559 1.00 35.77 A N +ATOM 1563 N TYR A 284 84.330 98.169 38.307 1.00 22.94 A N +ATOM 1564 CA TYR A 284 84.803 97.941 36.954 1.00 22.94 A C +ATOM 1565 C TYR A 284 85.542 99.049 36.231 1.00 22.72 A C +ATOM 1566 O TYR A 284 84.970 100.123 36.079 1.00 24.79 A O +ATOM 1567 CB TYR A 284 83.624 97.508 36.119 1.00 23.79 A C +ATOM 1568 CG TYR A 284 84.072 96.825 34.843 1.00 25.04 A C +ATOM 1569 CD1 TYR A 284 84.610 95.554 34.878 1.00 25.79 A C +ATOM 1570 CD2 TYR A 284 83.970 97.495 33.656 1.00 25.54 A C +ATOM 1571 CE1 TYR A 284 85.061 94.940 33.731 1.00 26.26 A C +ATOM 1572 CE2 TYR A 284 84.412 96.888 32.505 1.00 26.69 A C +ATOM 1573 CZ TYR A 284 84.952 95.625 32.553 1.00 26.85 A C +ATOM 1574 OH TYR A 284 85.393 95.076 31.380 1.00 28.11 A O +ATOM 1575 N PRO A 285 86.756 98.859 35.695 1.00 21.57 A N +ATOM 1576 CA PRO A 285 87.455 97.593 35.654 1.00 20.89 A C +ATOM 1577 C PRO A 285 88.349 97.375 36.842 1.00 19.94 A C +ATOM 1578 O PRO A 285 89.258 96.556 36.757 1.00 21.19 A O +ATOM 1579 CB PRO A 285 88.206 97.619 34.367 1.00 20.29 A C +ATOM 1580 CG PRO A 285 88.676 99.035 34.415 1.00 20.71 A C +ATOM 1581 CD PRO A 285 87.434 99.805 34.838 1.00 20.83 A C +ATOM 1582 N GLY A 286 88.137 98.070 37.936 1.00 19.08 A N +ATOM 1583 CA GLY A 286 89.007 97.876 39.067 1.00 17.50 A C +ATOM 1584 C GLY A 286 88.234 97.295 40.210 1.00 17.07 A C +ATOM 1585 O GLY A 286 87.099 96.833 40.059 1.00 17.30 A O +ATOM 1586 N VAL A 287 88.878 97.383 41.357 1.00 13.43 A N +ATOM 1587 CA VAL A 287 88.347 96.894 42.609 1.00 12.37 A C +ATOM 1588 C VAL A 287 88.758 98.028 43.541 1.00 11.81 A C +ATOM 1589 O VAL A 287 89.866 98.541 43.331 1.00 12.05 A O +ATOM 1590 CB VAL A 287 89.055 95.549 42.971 1.00 11.45 A C +ATOM 1591 CG1 VAL A 287 88.663 95.066 44.376 1.00 10.54 A C +ATOM 1592 CG2 VAL A 287 88.692 94.505 41.942 1.00 9.91 A C +ATOM 1593 N ARG A 288 87.987 98.485 44.532 1.00 11.21 A N +ATOM 1594 CA ARG A 288 88.471 99.532 45.369 1.00 11.13 A C +ATOM 1595 C ARG A 288 88.284 98.996 46.789 1.00 11.63 A C +ATOM 1596 O ARG A 288 87.300 98.278 47.045 1.00 12.41 A O +ATOM 1597 CB ARG A 288 87.657 100.780 45.009 1.00 14.65 A C +ATOM 1598 CG ARG A 288 87.686 101.854 46.091 1.00 16.58 A C +ATOM 1599 CD ARG A 288 88.229 103.176 45.596 1.00 19.68 A C +ATOM 1600 NE ARG A 288 87.275 103.937 44.834 1.00 21.93 A N +ATOM 1601 CZ ARG A 288 87.565 104.613 43.704 1.00 23.70 A C +ATOM 1602 NH1 ARG A 288 88.740 104.595 43.079 1.00 23.68 A N1+ +ATOM 1603 NH2 ARG A 288 86.587 105.303 43.118 1.00 24.39 A N +ATOM 1604 N CYS A 289 89.178 99.308 47.729 1.00 11.37 A N +ATOM 1605 CA CYS A 289 89.074 98.813 49.082 1.00 12.29 A C +ATOM 1606 C CYS A 289 89.179 99.912 50.109 1.00 12.56 A C +ATOM 1607 O CYS A 289 89.967 100.836 49.891 1.00 14.21 A O +ATOM 1608 CB CYS A 289 90.191 97.802 49.359 1.00 15.34 A C +ATOM 1609 SG CYS A 289 90.384 96.498 48.097 1.00 17.18 A S +ATOM 1610 N ILE A 290 88.408 99.917 51.208 1.00 8.87 A N +ATOM 1611 CA ILE A 290 88.514 100.967 52.220 1.00 7.78 A C +ATOM 1612 C ILE A 290 88.968 100.051 53.348 1.00 9.42 A C +ATOM 1613 O ILE A 290 88.333 99.005 53.587 1.00 9.29 A O +ATOM 1614 CB ILE A 290 87.136 101.649 52.456 1.00 5.34 A C +ATOM 1615 CG1 ILE A 290 87.035 102.889 51.603 1.00 2.42 A C +ATOM 1616 CG2 ILE A 290 87.013 102.168 53.911 1.00 2.00 A C +ATOM 1617 CD1 ILE A 290 87.011 102.635 50.042 1.00 4.63 A C +ATOM 1618 N CYS A 291 90.102 100.365 53.983 1.00 9.64 A N +ATOM 1619 CA CYS A 291 90.650 99.445 54.973 1.00 9.89 A C +ATOM 1620 C CYS A 291 90.777 100.007 56.350 1.00 10.13 A C +ATOM 1621 O CYS A 291 90.098 100.989 56.629 1.00 7.17 A O +ATOM 1622 CB CYS A 291 91.986 98.984 54.453 1.00 10.09 A C +ATOM 1623 SG CYS A 291 91.862 98.626 52.667 1.00 14.21 A S +ATOM 1624 N ARG A 292 91.576 99.405 57.226 1.00 10.49 A N +ATOM 1625 CA ARG A 292 91.740 99.893 58.574 1.00 12.37 A C +ATOM 1626 C ARG A 292 93.185 100.354 58.728 1.00 15.72 A C +ATOM 1627 O ARG A 292 94.089 99.624 58.290 1.00 18.46 A O +ATOM 1628 CB ARG A 292 91.470 98.777 59.498 1.00 10.93 A C +ATOM 1629 CG ARG A 292 91.809 98.975 60.952 1.00 11.15 A C +ATOM 1630 CD ARG A 292 91.669 97.577 61.535 1.00 11.71 A C +ATOM 1631 NE ARG A 292 92.075 97.577 62.917 1.00 14.83 A N +ATOM 1632 CZ ARG A 292 91.617 96.717 63.819 1.00 16.20 A C +ATOM 1633 NH1 ARG A 292 90.677 95.821 63.570 1.00 17.01 A N1+ +ATOM 1634 NH2 ARG A 292 92.080 96.817 65.053 1.00 16.82 A N +ATOM 1635 N ASP A 293 93.472 101.562 59.226 1.00 16.94 A N +ATOM 1636 CA ASP A 293 94.833 102.023 59.471 1.00 16.84 A C +ATOM 1637 C ASP A 293 94.816 101.965 61.000 1.00 17.82 A C +ATOM 1638 O ASP A 293 94.123 102.679 61.791 1.00 16.60 A O +ATOM 1639 CB ASP A 293 95.068 103.438 59.053 1.00 16.35 A C +ATOM 1640 CG ASP A 293 96.465 104.020 59.322 1.00 18.27 A C +ATOM 1641 OD1 ASP A 293 97.071 103.817 60.389 1.00 18.50 A O +ATOM 1642 OD2 ASP A 293 96.939 104.761 58.457 1.00 18.61 A O1- +ATOM 1643 N ASN A 294 95.660 100.993 61.361 1.00 18.80 A N +ATOM 1644 CA ASN A 294 95.887 100.631 62.763 1.00 19.77 A C +ATOM 1645 C ASN A 294 97.032 101.289 63.515 1.00 20.60 A C +ATOM 1646 O ASN A 294 97.188 101.166 64.726 1.00 20.90 A O +ATOM 1647 CB ASN A 294 96.047 99.136 62.807 1.00 17.84 A C +ATOM 1648 CG ASN A 294 95.634 98.586 64.146 1.00 17.12 A C +ATOM 1649 OD1 ASN A 294 94.447 98.540 64.443 1.00 16.59 A O +ATOM 1650 ND2 ASN A 294 96.555 98.164 64.989 1.00 16.06 A N +ATOM 1651 N TRP A 295 97.774 102.105 62.774 1.00 22.82 A N +ATOM 1652 CA TRP A 295 98.940 102.790 63.317 1.00 23.70 A C +ATOM 1653 C TRP A 295 98.703 104.277 63.584 1.00 25.86 A C +ATOM 1654 O TRP A 295 98.591 104.706 64.732 1.00 25.76 A O +ATOM 1655 CB TRP A 295 100.076 102.544 62.297 1.00 21.70 A C +ATOM 1656 CG TRP A 295 101.467 103.096 62.573 1.00 21.39 A C +ATOM 1657 CD1 TRP A 295 101.937 103.356 63.839 1.00 21.77 A C +ATOM 1658 CD2 TRP A 295 102.417 103.355 61.621 1.00 21.24 A C +ATOM 1659 NE1 TRP A 295 103.176 103.771 63.673 1.00 21.32 A N +ATOM 1660 CE2 TRP A 295 103.481 103.777 62.381 1.00 20.89 A C +ATOM 1661 CE3 TRP A 295 102.519 103.293 60.254 1.00 20.91 A C +ATOM 1662 CZ2 TRP A 295 104.661 104.139 61.820 1.00 21.49 A C +ATOM 1663 CZ3 TRP A 295 103.698 103.658 59.672 1.00 20.88 A C +ATOM 1664 CH2 TRP A 295 104.755 104.075 60.448 1.00 21.88 A C +ATOM 1665 N LYS A 296 98.619 105.059 62.498 1.00 27.46 A N +ATOM 1666 CA LYS A 296 98.467 106.505 62.549 1.00 29.10 A C +ATOM 1667 C LYS A 296 97.173 107.145 62.091 1.00 29.96 A C +ATOM 1668 O LYS A 296 97.116 108.364 61.977 1.00 31.13 A O +ATOM 1669 CB LYS A 296 99.585 107.095 61.724 1.00 30.53 A C +ATOM 1670 CG LYS A 296 101.005 106.998 62.275 1.00 32.33 A C +ATOM 1671 CD LYS A 296 101.773 107.102 60.981 1.00 33.52 A C +ATOM 1672 CE LYS A 296 103.222 107.472 61.125 1.00 33.86 A C +ATOM 1673 NZ LYS A 296 103.692 107.666 59.766 1.00 34.60 A N1+ +ATOM 1674 N GLY A 297 96.095 106.432 61.838 1.00 30.14 A N +ATOM 1675 CA GLY A 297 94.906 107.106 61.342 1.00 29.96 A C +ATOM 1676 C GLY A 297 93.589 106.566 61.865 1.00 28.96 A C +ATOM 1677 O GLY A 297 93.405 105.414 62.344 1.00 28.90 A O +ATOM 1678 N SER A 298 92.814 107.641 61.913 1.00 28.36 A N +ATOM 1679 CA SER A 298 91.424 107.714 62.279 1.00 25.91 A C +ATOM 1680 C SER A 298 90.790 107.768 60.909 1.00 25.19 A C +ATOM 1681 O SER A 298 89.629 107.402 60.827 1.00 27.10 A O +ATOM 1682 CB SER A 298 91.092 108.984 62.925 1.00 27.05 A C +ATOM 1683 OG SER A 298 91.011 109.050 64.326 1.00 28.97 A O +ATOM 1684 N ASN A 299 91.374 108.329 59.845 1.00 23.69 A N +ATOM 1685 CA ASN A 299 90.725 108.288 58.546 1.00 21.91 A C +ATOM 1686 C ASN A 299 91.114 106.919 58.010 1.00 22.02 A C +ATOM 1687 O ASN A 299 92.104 106.321 58.458 1.00 23.99 A O +ATOM 1688 CB ASN A 299 91.191 109.407 57.580 1.00 22.52 A C +ATOM 1689 CG ASN A 299 92.661 109.811 57.511 1.00 23.54 A C +ATOM 1690 OD1 ASN A 299 93.398 109.677 58.498 1.00 22.57 A O +ATOM 1691 ND2 ASN A 299 93.118 110.318 56.364 1.00 20.69 A N +ATOM 1692 N ARG A 300 90.346 106.347 57.093 1.00 20.26 A N +ATOM 1693 CA ARG A 300 90.583 105.026 56.558 1.00 18.16 A C +ATOM 1694 C ARG A 300 91.323 105.086 55.235 1.00 15.98 A C +ATOM 1695 O ARG A 300 91.001 105.971 54.439 1.00 15.79 A O +ATOM 1696 CB ARG A 300 89.260 104.284 56.310 1.00 19.87 A C +ATOM 1697 CG ARG A 300 88.093 104.540 57.276 1.00 21.38 A C +ATOM 1698 CD ARG A 300 86.976 103.496 57.131 1.00 21.49 A C +ATOM 1699 NE ARG A 300 87.535 102.296 57.681 1.00 23.20 A N +ATOM 1700 CZ ARG A 300 87.317 101.895 58.925 1.00 22.79 A C +ATOM 1701 NH1 ARG A 300 86.470 102.474 59.715 1.00 22.00 A N1+ +ATOM 1702 NH2 ARG A 300 87.912 100.811 59.357 1.00 22.50 A N +ATOM 1703 N PRO A 301 92.275 104.181 54.960 1.00 14.25 A N +ATOM 1704 CA PRO A 301 93.002 104.031 53.711 1.00 12.35 A C +ATOM 1705 C PRO A 301 92.146 103.642 52.562 1.00 13.05 A C +ATOM 1706 O PRO A 301 91.173 102.955 52.786 1.00 15.03 A O +ATOM 1707 CB PRO A 301 94.014 102.970 53.946 1.00 12.94 A C +ATOM 1708 CG PRO A 301 94.228 102.944 55.444 1.00 12.54 A C +ATOM 1709 CD PRO A 301 92.869 103.292 55.962 1.00 13.50 A C +ATOM 1710 N VAL A 302 92.538 103.890 51.336 1.00 12.92 A N +ATOM 1711 CA VAL A 302 91.783 103.528 50.170 1.00 12.37 A C +ATOM 1712 C VAL A 302 92.826 102.744 49.400 1.00 15.60 A C +ATOM 1713 O VAL A 302 93.951 103.264 49.291 1.00 16.22 A O +ATOM 1714 CB VAL A 302 91.440 104.758 49.388 1.00 13.78 A C +ATOM 1715 CG1 VAL A 302 90.821 104.407 48.037 1.00 11.87 A C +ATOM 1716 CG2 VAL A 302 90.560 105.599 50.276 1.00 13.75 A C +ATOM 1717 N VAL A 303 92.600 101.537 48.876 1.00 16.17 A N +ATOM 1718 CA VAL A 303 93.598 100.842 48.096 1.00 16.96 A C +ATOM 1719 C VAL A 303 92.934 100.677 46.737 1.00 17.34 A C +ATOM 1720 O VAL A 303 91.788 100.247 46.748 1.00 17.87 A O +ATOM 1721 CB VAL A 303 93.909 99.477 48.712 1.00 18.19 A C +ATOM 1722 CG1 VAL A 303 94.821 98.802 47.695 1.00 18.48 A C +ATOM 1723 CG2 VAL A 303 94.595 99.533 50.102 1.00 16.34 A C +ATOM 1724 N ASP A 304 93.555 100.974 45.599 1.00 18.61 A N +ATOM 1725 CA ASP A 304 92.978 100.851 44.274 1.00 20.34 A C +ATOM 1726 C ASP A 304 93.833 99.868 43.534 1.00 21.33 A C +ATOM 1727 O ASP A 304 95.044 100.097 43.421 1.00 21.44 A O +ATOM 1728 CB ASP A 304 93.008 102.163 43.500 1.00 23.06 A C +ATOM 1729 CG ASP A 304 91.755 102.999 43.772 1.00 25.76 A C +ATOM 1730 OD1 ASP A 304 90.661 102.437 43.864 1.00 26.11 A O +ATOM 1731 OD2 ASP A 304 91.865 104.220 43.909 1.00 27.96 A O1- +ATOM 1732 N ILE A 305 93.195 98.812 43.020 1.00 21.22 A N +ATOM 1733 CA ILE A 305 93.837 97.700 42.318 1.00 20.71 A C +ATOM 1734 C ILE A 305 93.525 97.755 40.825 1.00 21.47 A C +ATOM 1735 O ILE A 305 92.353 97.759 40.463 1.00 21.82 A O +ATOM 1736 CB ILE A 305 93.294 96.437 43.036 1.00 18.99 A C +ATOM 1737 CG1 ILE A 305 93.912 96.397 44.407 1.00 18.48 A C +ATOM 1738 CG2 ILE A 305 93.586 95.161 42.287 1.00 19.25 A C +ATOM 1739 CD1 ILE A 305 93.031 95.715 45.478 1.00 19.43 A C +ATOM 1740 N ASN A 306 94.478 97.779 39.903 1.00 23.02 A N +ATOM 1741 CA ASN A 306 94.179 97.838 38.470 1.00 24.44 A C +ATOM 1742 C ASN A 306 94.216 96.382 38.075 1.00 26.09 A C +ATOM 1743 O ASN A 306 95.279 95.753 38.026 1.00 25.76 A O +ATOM 1744 CB ASN A 306 95.256 98.633 37.689 1.00 25.24 A C +ATOM 1745 CG ASN A 306 95.057 98.652 36.162 1.00 27.41 A C +ATOM 1746 OD1 ASN A 306 94.945 97.601 35.537 1.00 29.13 A O +ATOM 1747 ND2 ASN A 306 95.014 99.734 35.379 1.00 27.44 A N +ATOM 1748 N MET A 307 93.076 95.812 37.731 1.00 28.07 A N +ATOM 1749 CA MET A 307 93.059 94.416 37.383 1.00 29.77 A C +ATOM 1750 C MET A 307 93.819 94.105 36.126 1.00 32.17 A C +ATOM 1751 O MET A 307 94.250 92.964 35.993 1.00 33.70 A O +ATOM 1752 CB MET A 307 91.632 93.921 37.239 1.00 29.09 A C +ATOM 1753 CG MET A 307 90.862 93.927 38.546 1.00 28.21 A C +ATOM 1754 SD MET A 307 91.602 92.938 39.864 1.00 28.86 A S +ATOM 1755 CE MET A 307 91.158 91.352 39.228 1.00 28.54 A C +ATOM 1756 N GLU A 308 94.061 95.069 35.236 1.00 35.09 A N +ATOM 1757 CA GLU A 308 94.795 94.833 33.994 1.00 38.09 A C +ATOM 1758 C GLU A 308 96.332 94.959 34.099 1.00 38.43 A C +ATOM 1759 O GLU A 308 97.068 94.240 33.431 1.00 38.89 A O +ATOM 1760 CB GLU A 308 94.241 95.802 32.962 1.00 40.16 A C +ATOM 1761 CG GLU A 308 92.739 95.609 32.740 1.00 43.20 A C +ATOM 1762 CD GLU A 308 91.980 96.846 32.223 1.00 45.63 A C +ATOM 1763 OE1 GLU A 308 91.878 97.828 32.988 1.00 46.23 A O +ATOM 1764 OE2 GLU A 308 91.486 96.814 31.076 1.00 45.95 A O1- +ATOM 1765 N ASP A 309 96.916 95.840 34.905 1.00 39.00 A N +ATOM 1766 CA ASP A 309 98.364 95.969 35.025 1.00 39.18 A C +ATOM 1767 C ASP A 309 98.791 95.431 36.378 1.00 38.16 A C +ATOM 1768 O ASP A 309 99.989 95.363 36.637 1.00 39.39 A O +ATOM 1769 CB ASP A 309 98.965 97.354 35.145 1.00 40.29 A C +ATOM 1770 CG ASP A 309 98.481 98.513 34.341 1.00 41.78 A C +ATOM 1771 OD1 ASP A 309 98.537 98.428 33.120 1.00 43.96 A O +ATOM 1772 OD2 ASP A 309 98.099 99.511 34.945 1.00 41.70 A O1- +ATOM 1773 N TYR A 310 97.906 95.141 37.318 1.00 36.18 A N +ATOM 1774 CA TYR A 310 98.245 94.671 38.648 1.00 35.47 A C +ATOM 1775 C TYR A 310 98.846 95.790 39.492 1.00 34.21 A C +ATOM 1776 O TYR A 310 99.366 95.548 40.587 1.00 34.09 A O +ATOM 1777 CB TYR A 310 99.235 93.481 38.624 1.00 37.01 A C +ATOM 1778 CG TYR A 310 98.769 92.298 37.786 1.00 38.21 A C +ATOM 1779 CD1 TYR A 310 97.482 91.838 37.913 1.00 38.72 A C +ATOM 1780 CD2 TYR A 310 99.640 91.659 36.940 1.00 38.17 A C +ATOM 1781 CE1 TYR A 310 97.053 90.744 37.216 1.00 38.91 A C +ATOM 1782 CE2 TYR A 310 99.218 90.559 36.239 1.00 38.83 A C +ATOM 1783 CZ TYR A 310 97.927 90.104 36.388 1.00 38.98 A C +ATOM 1784 OH TYR A 310 97.505 88.953 35.753 1.00 39.54 A O +ATOM 1785 N SER A 311 98.701 97.034 39.022 1.00 32.54 A N +ATOM 1786 CA SER A 311 99.181 98.259 39.681 1.00 31.15 A C +ATOM 1787 C SER A 311 98.329 98.515 40.900 1.00 30.34 A C +ATOM 1788 O SER A 311 97.115 98.293 40.888 1.00 30.40 A O +ATOM 1789 CB SER A 311 99.016 99.507 38.833 1.00 30.85 A C +ATOM 1790 OG SER A 311 98.852 99.217 37.448 1.00 30.24 A O +ATOM 1791 N ILE A 312 98.953 99.015 41.930 1.00 28.96 A N +ATOM 1792 CA ILE A 312 98.254 99.303 43.149 1.00 27.98 A C +ATOM 1793 C ILE A 312 98.426 100.790 43.346 1.00 28.13 A C +ATOM 1794 O ILE A 312 99.442 101.335 42.917 1.00 29.43 A O +ATOM 1795 CB ILE A 312 98.886 98.543 44.315 1.00 27.82 A C +ATOM 1796 CG1 ILE A 312 98.970 97.047 44.037 1.00 27.51 A C +ATOM 1797 CG2 ILE A 312 98.055 98.796 45.555 1.00 27.47 A C +ATOM 1798 CD1 ILE A 312 97.671 96.330 43.650 1.00 27.73 A C +ATOM 1799 N ASP A 313 97.449 101.488 43.921 1.00 27.13 A N +ATOM 1800 CA ASP A 313 97.521 102.902 44.206 1.00 25.01 A C +ATOM 1801 C ASP A 313 96.856 103.016 45.559 1.00 23.54 A C +ATOM 1802 O ASP A 313 96.086 102.129 45.912 1.00 23.34 A O +ATOM 1803 CB ASP A 313 96.769 103.702 43.152 1.00 26.77 A C +ATOM 1804 CG ASP A 313 96.773 105.232 43.357 1.00 28.29 A C +ATOM 1805 OD1 ASP A 313 97.696 105.773 43.991 1.00 27.65 A O +ATOM 1806 OD2 ASP A 313 95.829 105.883 42.868 1.00 29.04 A O1- +ATOM 1807 N SER A 314 97.092 103.985 46.411 1.00 22.50 A N +ATOM 1808 CA SER A 314 96.393 104.014 47.702 1.00 22.34 A C +ATOM 1809 C SER A 314 96.399 105.445 48.223 1.00 21.60 A C +ATOM 1810 O SER A 314 97.361 106.189 47.935 1.00 21.90 A O +ATOM 1811 CB SER A 314 97.077 103.068 48.716 1.00 20.74 A C +ATOM 1812 OG SER A 314 98.323 103.536 49.239 1.00 21.48 A O +ATOM 1813 N SER A 315 95.390 105.829 48.994 1.00 20.07 A N +ATOM 1814 CA SER A 315 95.248 107.184 49.522 1.00 19.18 A C +ATOM 1815 C SER A 315 94.420 107.049 50.750 1.00 19.46 A C +ATOM 1816 O SER A 315 94.439 105.948 51.320 1.00 19.46 A O +ATOM 1817 CB SER A 315 94.512 108.084 48.519 1.00 19.00 A C +ATOM 1818 OG SER A 315 93.553 107.460 47.662 1.00 19.81 A O +ATOM 1819 N TYR A 316 93.783 108.113 51.243 1.00 19.25 A N +ATOM 1820 CA TYR A 316 92.895 108.030 52.391 1.00 19.95 A C +ATOM 1821 C TYR A 316 91.557 108.634 51.947 1.00 21.01 A C +ATOM 1822 O TYR A 316 91.473 109.288 50.878 1.00 21.35 A O +ATOM 1823 CB TYR A 316 93.419 108.788 53.571 1.00 18.56 A C +ATOM 1824 CG TYR A 316 94.477 108.018 54.315 1.00 17.79 A C +ATOM 1825 CD1 TYR A 316 95.699 107.832 53.728 1.00 17.50 A C +ATOM 1826 CD2 TYR A 316 94.225 107.497 55.575 1.00 18.48 A C +ATOM 1827 CE1 TYR A 316 96.657 107.106 54.388 1.00 17.54 A C +ATOM 1828 CE2 TYR A 316 95.187 106.769 56.256 1.00 18.17 A C +ATOM 1829 CZ TYR A 316 96.405 106.576 55.636 1.00 18.37 A C +ATOM 1830 OH TYR A 316 97.383 105.775 56.177 1.00 17.26 A O +ATOM 1831 N VAL A 317 90.472 108.331 52.671 1.00 21.76 A N +ATOM 1832 CA VAL A 317 89.193 108.893 52.238 1.00 22.26 A C +ATOM 1833 C VAL A 317 89.158 110.359 52.621 1.00 21.81 A C +ATOM 1834 O VAL A 317 89.503 110.719 53.759 1.00 24.60 A O +ATOM 1835 CB VAL A 317 87.935 108.152 52.841 1.00 23.11 A C +ATOM 1836 CG1 VAL A 317 87.843 106.831 52.093 1.00 23.67 A C +ATOM 1837 CG2 VAL A 317 88.038 107.718 54.282 1.00 21.45 A C +ATOM 1838 N CYS A 318 88.843 111.223 51.662 1.00 20.04 A N +ATOM 1839 CA CYS A 318 88.764 112.656 51.847 1.00 18.28 A C +ATOM 1840 C CYS A 318 87.871 113.121 52.948 1.00 17.66 A C +ATOM 1841 O CYS A 318 88.314 114.028 53.648 1.00 19.05 A O +ATOM 1842 CB CYS A 318 88.288 113.325 50.603 1.00 18.13 A C +ATOM 1843 SG CYS A 318 89.489 113.222 49.254 1.00 17.47 A S +ATOM 1844 N SER A 319 86.651 112.586 53.114 1.00 17.56 A N +ATOM 1845 CA SER A 319 85.711 112.966 54.155 1.00 16.37 A C +ATOM 1846 C SER A 319 86.390 113.376 55.434 1.00 16.08 A C +ATOM 1847 O SER A 319 87.280 112.700 55.927 1.00 14.51 A O +ATOM 1848 CB SER A 319 84.718 111.810 54.527 1.00 17.91 A C +ATOM 1849 OG SER A 319 84.159 111.729 55.884 1.00 17.00 A O +ATOM 1850 N GLY A 320 86.019 114.561 55.885 1.00 16.59 A N +ATOM 1851 CA GLY A 320 86.528 115.070 57.126 1.00 17.04 A C +ATOM 1852 C GLY A 320 85.769 114.398 58.222 1.00 17.57 A C +ATOM 1853 O GLY A 320 86.191 114.482 59.366 1.00 18.07 A O +ATOM 1854 N LEU A 321 84.634 113.745 57.900 1.00 20.75 A N +ATOM 1855 CA LEU A 321 83.846 113.032 58.910 1.00 21.00 A C +ATOM 1856 C LEU A 321 84.624 111.792 59.306 1.00 21.88 A C +ATOM 1857 O LEU A 321 84.473 111.516 60.485 1.00 24.94 A O +ATOM 1858 CB LEU A 321 82.445 112.740 58.372 1.00 20.46 A C +ATOM 1859 CG LEU A 321 81.578 113.995 58.555 1.00 19.89 A C +ATOM 1860 CD1 LEU A 321 80.210 113.830 57.928 1.00 19.03 A C +ATOM 1861 CD2 LEU A 321 81.429 114.256 60.037 1.00 18.69 A C +ATOM 1862 N VAL A 322 85.349 110.947 58.558 1.00 20.71 A N +ATOM 1863 CA VAL A 322 86.180 109.919 59.235 1.00 20.06 A C +ATOM 1864 C VAL A 322 85.490 108.784 59.986 1.00 21.28 A C +ATOM 1865 O VAL A 322 84.935 108.895 61.089 1.00 20.53 A O +ATOM 1866 CB VAL A 322 87.230 110.769 60.167 1.00 19.34 A C +ATOM 1867 CG1 VAL A 322 87.803 110.043 61.359 1.00 15.20 A C +ATOM 1868 CG2 VAL A 322 88.370 111.204 59.267 1.00 17.67 A C +ATOM 1869 N GLY A 323 85.704 107.600 59.403 1.00 21.73 A N +ATOM 1870 CA GLY A 323 85.068 106.426 59.959 1.00 21.91 A C +ATOM 1871 C GLY A 323 85.828 105.461 60.831 1.00 20.55 A C +ATOM 1872 O GLY A 323 85.235 104.388 61.003 1.00 22.35 A O +ATOM 1873 N ASP A 324 87.010 105.637 61.410 1.00 18.60 A N +ATOM 1874 CA ASP A 324 87.550 104.566 62.200 1.00 16.37 A C +ATOM 1875 C ASP A 324 87.168 104.811 63.638 1.00 16.94 A C +ATOM 1876 O ASP A 324 86.495 105.814 63.889 1.00 17.05 A O +ATOM 1877 CB ASP A 324 89.036 104.569 61.971 1.00 18.25 A C +ATOM 1878 CG ASP A 324 89.871 103.296 62.304 1.00 19.07 A C +ATOM 1879 OD1 ASP A 324 89.330 102.270 62.747 1.00 19.33 A O +ATOM 1880 OD2 ASP A 324 91.090 103.348 62.105 1.00 17.97 A O1- +ATOM 1881 N THR A 325 87.449 103.894 64.572 1.00 15.66 A N +ATOM 1882 CA THR A 325 87.152 104.094 65.994 1.00 17.38 A C +ATOM 1883 C THR A 325 88.450 103.637 66.673 1.00 19.58 A C +ATOM 1884 O THR A 325 88.861 102.530 66.291 1.00 22.53 A O +ATOM 1885 CB THR A 325 85.963 103.208 66.425 1.00 16.52 A C +ATOM 1886 OG1 THR A 325 84.914 103.526 65.516 1.00 13.46 A O +ATOM 1887 CG2 THR A 325 85.511 103.418 67.866 1.00 16.22 A C +ATOM 1888 N PRO A 326 89.233 104.312 67.545 1.00 20.46 A N +ATOM 1889 CA PRO A 326 89.055 105.690 67.995 1.00 21.14 A C +ATOM 1890 C PRO A 326 89.189 106.620 66.832 1.00 23.37 A C +ATOM 1891 O PRO A 326 89.808 106.269 65.822 1.00 23.50 A O +ATOM 1892 CB PRO A 326 90.099 105.907 69.024 1.00 20.82 A C +ATOM 1893 CG PRO A 326 90.247 104.547 69.615 1.00 20.43 A C +ATOM 1894 CD PRO A 326 90.315 103.721 68.326 1.00 20.92 A C +ATOM 1895 N ARG A 327 88.510 107.742 67.050 1.00 26.39 A N +ATOM 1896 CA ARG A 327 88.349 108.850 66.131 1.00 28.54 A C +ATOM 1897 C ARG A 327 88.284 110.048 67.080 1.00 30.94 A C +ATOM 1898 O ARG A 327 88.060 109.889 68.287 1.00 29.95 A O +ATOM 1899 CB ARG A 327 87.058 108.538 65.431 1.00 29.84 A C +ATOM 1900 CG ARG A 327 86.388 109.404 64.411 1.00 32.24 A C +ATOM 1901 CD ARG A 327 84.839 109.336 64.494 1.00 33.81 A C +ATOM 1902 NE ARG A 327 84.290 107.999 64.335 1.00 35.77 A N +ATOM 1903 CZ ARG A 327 83.141 107.595 64.906 1.00 36.81 A C +ATOM 1904 NH1 ARG A 327 82.363 108.362 65.673 1.00 36.95 A N1+ +ATOM 1905 NH2 ARG A 327 82.769 106.338 64.716 1.00 37.99 A N +ATOM 1906 N ASN A 328 88.394 111.276 66.564 1.00 33.26 A N +ATOM 1907 CA ASN A 328 88.384 112.454 67.422 1.00 36.08 A C +ATOM 1908 C ASN A 328 87.056 113.032 67.872 1.00 38.11 A C +ATOM 1909 O ASN A 328 86.879 113.335 69.055 1.00 40.05 A O +ATOM 1910 CB ASN A 328 89.171 113.569 66.759 1.00 35.28 A C +ATOM 1911 CG ASN A 328 90.476 113.910 67.471 1.00 34.96 A C +ATOM 1912 OD1 ASN A 328 90.885 113.387 68.512 1.00 33.49 A O +ATOM 1913 ND2 ASN A 328 91.196 114.845 66.873 1.00 34.61 A N +ATOM 1914 N ASP A 329 86.165 113.247 66.920 1.00 39.09 A N +ATOM 1915 CA ASP A 329 84.800 113.772 67.034 1.00 40.32 A C +ATOM 1916 C ASP A 329 84.808 114.728 65.870 1.00 39.66 A C +ATOM 1917 O ASP A 329 85.823 115.349 65.561 1.00 39.56 A O +ATOM 1918 CB ASP A 329 84.387 114.534 68.346 1.00 41.28 A C +ATOM 1919 CG ASP A 329 84.905 115.903 68.758 1.00 43.36 A C +ATOM 1920 OD1 ASP A 329 84.823 116.835 67.964 1.00 43.88 A O +ATOM 1921 OD2 ASP A 329 85.345 116.042 69.910 1.00 44.14 A O1- +ATOM 1922 N ASP A 330 83.641 114.858 65.256 1.00 38.78 A N +ATOM 1923 CA ASP A 330 83.521 115.631 64.044 1.00 38.25 A C +ATOM 1924 C ASP A 330 83.911 117.076 64.071 1.00 38.62 A C +ATOM 1925 O ASP A 330 84.134 117.673 63.028 1.00 37.91 A O +ATOM 1926 CB ASP A 330 82.086 115.496 63.529 1.00 38.24 A C +ATOM 1927 CG ASP A 330 81.527 114.075 63.432 1.00 37.27 A C +ATOM 1928 OD1 ASP A 330 82.270 113.110 63.289 1.00 37.43 A O +ATOM 1929 OD2 ASP A 330 80.319 113.933 63.493 1.00 37.02 A O1- +ATOM 1930 N ARG A 331 83.978 117.658 65.255 1.00 39.30 A N +ATOM 1931 CA ARG A 331 84.345 119.047 65.323 1.00 40.60 A C +ATOM 1932 C ARG A 331 85.829 119.150 65.005 1.00 38.45 A C +ATOM 1933 O ARG A 331 86.262 119.915 64.137 1.00 38.02 A O +ATOM 1934 CB ARG A 331 84.037 119.554 66.716 1.00 44.66 A C +ATOM 1935 CG ARG A 331 83.567 120.976 66.636 1.00 49.90 A C +ATOM 1936 CD ARG A 331 82.981 121.398 67.966 1.00 54.58 A C +ATOM 1937 NE ARG A 331 82.418 122.758 67.857 1.00 58.79 A N +ATOM 1938 CZ ARG A 331 82.180 123.503 68.968 1.00 60.91 A C +ATOM 1939 NH1 ARG A 331 82.460 123.008 70.221 1.00 62.26 A N1+ +ATOM 1940 NH2 ARG A 331 81.629 124.736 68.835 1.00 61.35 A N +ATOM 1941 N SER A 332 86.588 118.305 65.685 1.00 35.38 A N +ATOM 1942 CA SER A 332 88.017 118.268 65.547 1.00 33.04 A C +ATOM 1943 C SER A 332 88.556 117.133 64.717 1.00 32.15 A C +ATOM 1944 O SER A 332 89.586 116.588 65.129 1.00 32.86 A O +ATOM 1945 CB SER A 332 88.552 118.231 66.958 1.00 32.84 A C +ATOM 1946 OG SER A 332 87.755 117.394 67.793 1.00 32.67 A O +ATOM 1947 N SER A 333 87.977 116.699 63.593 1.00 30.97 A N +ATOM 1948 CA SER A 333 88.570 115.580 62.904 1.00 28.82 A C +ATOM 1949 C SER A 333 88.957 116.066 61.530 1.00 28.73 A C +ATOM 1950 O SER A 333 88.373 117.024 61.018 1.00 29.42 A O +ATOM 1951 CB SER A 333 87.571 114.409 62.891 1.00 28.40 A C +ATOM 1952 OG SER A 333 86.367 114.568 62.164 1.00 27.90 A O +ATOM 1953 N ASN A 334 89.958 115.453 60.879 1.00 26.78 A N +ATOM 1954 CA ASN A 334 90.411 115.941 59.595 1.00 24.72 A C +ATOM 1955 C ASN A 334 90.943 114.830 58.739 1.00 22.60 A C +ATOM 1956 O ASN A 334 91.347 113.799 59.252 1.00 20.37 A O +ATOM 1957 CB ASN A 334 91.576 116.953 59.734 1.00 24.77 A C +ATOM 1958 CG ASN A 334 91.263 118.162 60.582 1.00 25.41 A C +ATOM 1959 OD1 ASN A 334 91.511 118.215 61.800 1.00 24.42 A O +ATOM 1960 ND2 ASN A 334 90.626 119.131 59.940 1.00 24.94 A N +ATOM 1961 N SER A 335 90.960 115.081 57.442 1.00 21.39 A N +ATOM 1962 CA SER A 335 91.500 114.147 56.506 1.00 22.15 A C +ATOM 1963 C SER A 335 91.835 115.036 55.312 1.00 23.41 A C +ATOM 1964 O SER A 335 91.098 115.977 54.991 1.00 23.60 A O +ATOM 1965 CB SER A 335 90.511 113.102 56.051 1.00 22.48 A C +ATOM 1966 OG SER A 335 91.193 112.265 55.121 1.00 22.48 A O +ATOM 1967 N ASN A 336 92.989 114.792 54.701 1.00 22.71 A N +ATOM 1968 CA ASN A 336 93.417 115.542 53.549 1.00 22.66 A C +ATOM 1969 C ASN A 336 93.544 114.686 52.290 1.00 22.62 A C +ATOM 1970 O ASN A 336 94.271 115.071 51.356 1.00 23.39 A O +ATOM 1971 CB ASN A 336 94.751 116.183 53.857 1.00 23.75 A C +ATOM 1972 CG ASN A 336 95.939 115.246 53.803 1.00 23.95 A C +ATOM 1973 OD1 ASN A 336 95.801 114.033 54.029 1.00 23.86 A O +ATOM 1974 ND2 ASN A 336 97.128 115.785 53.490 1.00 24.21 A N +ATOM 1975 N CYS A 337 92.903 113.506 52.276 1.00 21.61 A N +ATOM 1976 CA CYS A 337 92.918 112.539 51.186 1.00 20.25 A C +ATOM 1977 C CYS A 337 94.275 111.870 50.949 1.00 21.81 A C +ATOM 1978 O CYS A 337 94.341 110.812 50.324 1.00 21.05 A O +ATOM 1979 CB CYS A 337 92.531 113.132 49.839 1.00 17.29 A C +ATOM 1980 SG CYS A 337 91.111 114.219 49.997 1.00 16.83 A S +ATOM 1981 N ARG A 338 95.381 112.345 51.502 1.00 23.48 A N +ATOM 1982 CA ARG A 338 96.663 111.749 51.219 1.00 24.46 A C +ATOM 1983 C ARG A 338 97.428 111.071 52.334 1.00 24.42 A C +ATOM 1984 O ARG A 338 97.949 109.996 52.056 1.00 23.97 A O +ATOM 1985 CB ARG A 338 97.504 112.829 50.604 1.00 26.14 A C +ATOM 1986 CG ARG A 338 97.103 113.278 49.191 1.00 29.58 A C +ATOM 1987 CD ARG A 338 97.459 114.753 48.921 1.00 33.04 A C +ATOM 1988 NE ARG A 338 98.739 115.002 49.541 1.00 36.99 A N +ATOM 1989 CZ ARG A 338 98.971 115.942 50.459 1.00 39.40 A C +ATOM 1990 NH1 ARG A 338 98.045 116.846 50.808 1.00 39.71 A N1+ +ATOM 1991 NH2 ARG A 338 100.220 115.974 50.961 1.00 41.37 A N +ATOM 1992 N ASN A 339 97.427 111.556 53.576 1.00 23.73 A N +ATOM 1993 CA ASN A 339 98.212 110.963 54.656 1.00 25.16 A C +ATOM 1994 C ASN A 339 97.336 110.548 55.812 1.00 24.04 A C +ATOM 1995 O ASN A 339 96.190 110.976 55.841 1.00 24.74 A O +ATOM 1996 CB ASN A 339 99.265 111.973 55.217 1.00 26.08 A C +ATOM 1997 CG ASN A 339 99.871 112.901 54.166 1.00 27.67 A C +ATOM 1998 OD1 ASN A 339 99.690 114.118 54.295 1.00 28.36 A O +ATOM 1999 ND2 ASN A 339 100.471 112.404 53.201 1.00 28.28 A N +ATOM 2000 N PRO A 340 97.761 109.744 56.788 1.00 24.57 A N +ATOM 2001 CA PRO A 340 97.033 109.498 58.013 1.00 24.91 A C +ATOM 2002 C PRO A 340 96.793 110.786 58.718 1.00 25.54 A C +ATOM 2003 O PRO A 340 97.700 111.575 58.842 1.00 27.18 A O +ATOM 2004 CB PRO A 340 97.892 108.548 58.838 1.00 24.53 A C +ATOM 2005 CG PRO A 340 99.260 108.694 58.267 1.00 24.22 A C +ATOM 2006 CD PRO A 340 98.958 108.915 56.777 1.00 24.47 A C +ATOM 2007 N ASN A 341 95.656 111.037 59.276 1.00 27.42 A N +ATOM 2008 CA ASN A 341 95.417 112.290 59.957 1.00 28.86 A C +ATOM 2009 C ASN A 341 96.137 112.400 61.285 1.00 29.50 A C +ATOM 2010 O ASN A 341 96.201 113.492 61.858 1.00 30.27 A O +ATOM 2011 CB ASN A 341 93.915 112.478 60.196 1.00 28.61 A C +ATOM 2012 CG ASN A 341 93.206 111.483 61.115 1.00 28.23 A C +ATOM 2013 OD1 ASN A 341 93.744 110.562 61.737 1.00 27.62 A O +ATOM 2014 ND2 ASN A 341 91.910 111.646 61.205 1.00 28.24 A N +ATOM 2015 N ASN A 342 96.659 111.303 61.813 1.00 30.05 A N +ATOM 2016 CA ASN A 342 97.343 111.301 63.084 1.00 31.26 A C +ATOM 2017 C ASN A 342 96.452 111.712 64.240 1.00 31.42 A C +ATOM 2018 O ASN A 342 96.933 112.112 65.296 1.00 30.80 A O +ATOM 2019 CB ASN A 342 98.575 112.219 63.057 1.00 33.21 A C +ATOM 2020 CG ASN A 342 99.854 111.437 63.261 1.00 34.80 A C +ATOM 2021 OD1 ASN A 342 100.159 110.917 64.352 1.00 34.53 A O +ATOM 2022 ND2 ASN A 342 100.611 111.347 62.155 1.00 34.93 A N +ATOM 2023 N GLU A 343 95.124 111.617 64.103 1.00 31.41 A N +ATOM 2024 CA GLU A 343 94.200 111.945 65.192 1.00 31.53 A C +ATOM 2025 C GLU A 343 93.843 110.585 65.740 1.00 31.49 A C +ATOM 2026 O GLU A 343 93.327 109.813 64.951 1.00 32.24 A O +ATOM 2027 CB GLU A 343 92.921 112.598 64.702 1.00 31.97 A C +ATOM 2028 CG GLU A 343 93.002 114.074 64.531 1.00 31.76 A C +ATOM 2029 CD GLU A 343 92.528 114.617 63.210 1.00 33.00 A C +ATOM 2030 OE1 GLU A 343 91.690 114.031 62.544 1.00 33.86 A O +ATOM 2031 OE2 GLU A 343 93.009 115.671 62.830 1.00 35.07 A O1- +ATOM 2032 N ARG A 344 94.135 110.203 66.985 1.00 31.51 A N +ATOM 2033 CA ARG A 344 93.826 108.891 67.572 1.00 32.24 A C +ATOM 2034 C ARG A 344 94.008 107.742 66.592 1.00 33.45 A C +ATOM 2035 O ARG A 344 93.131 106.931 66.289 1.00 34.63 A O +ATOM 2036 CB ARG A 344 92.408 108.929 68.103 1.00 31.14 A C +ATOM 2037 CG ARG A 344 92.375 109.963 69.183 1.00 30.28 A C +ATOM 2038 CD ARG A 344 91.034 110.035 69.833 1.00 32.09 A C +ATOM 2039 NE ARG A 344 90.949 109.112 70.952 1.00 34.14 A N +ATOM 2040 CZ ARG A 344 89.775 108.678 71.434 1.00 34.96 A C +ATOM 2041 NH1 ARG A 344 88.592 109.050 70.897 1.00 35.47 A N1+ +ATOM 2042 NH2 ARG A 344 89.802 107.834 72.469 1.00 34.95 A N +ATOM 2043 N GLY A 345 95.206 107.748 66.014 1.00 34.77 A N +ATOM 2044 CA GLY A 345 95.625 106.799 65.001 1.00 35.10 A C +ATOM 2045 C GLY A 345 95.634 105.309 65.324 1.00 35.38 A C +ATOM 2046 O GLY A 345 95.076 104.499 64.561 1.00 35.76 A O +ATOM 2047 N THR A 346 96.314 104.982 66.423 1.00 35.61 A N +ATOM 2048 CA THR A 346 96.458 103.636 66.899 1.00 35.81 A C +ATOM 2049 C THR A 346 95.131 102.960 67.132 1.00 35.51 A C +ATOM 2050 O THR A 346 94.138 103.601 67.450 1.00 36.54 A O +ATOM 2051 CB THR A 346 97.315 103.749 68.148 1.00 36.58 A C +ATOM 2052 OG1 THR A 346 98.506 104.392 67.698 1.00 37.90 A O +ATOM 2053 CG2 THR A 346 97.663 102.438 68.813 1.00 37.61 A C +ATOM 2054 N GLN A 347 95.105 101.665 66.843 1.00 34.81 A N +ATOM 2055 CA GLN A 347 93.964 100.767 66.947 1.00 33.36 A C +ATOM 2056 C GLN A 347 92.963 101.047 65.839 1.00 31.41 A C +ATOM 2057 O GLN A 347 93.219 101.913 64.953 1.00 31.39 A O +ATOM 2058 CB GLN A 347 93.312 100.886 68.281 1.00 34.76 A C +ATOM 2059 CG GLN A 347 94.144 100.088 69.247 1.00 37.94 A C +ATOM 2060 CD GLN A 347 93.823 100.508 70.670 1.00 40.33 A C +ATOM 2061 OE1 GLN A 347 92.661 100.670 71.070 1.00 41.76 A O +ATOM 2062 NE2 GLN A 347 94.857 100.746 71.471 1.00 41.53 A N +ATOM 2063 N GLY A 348 91.816 100.358 65.821 1.00 28.93 A N +ATOM 2064 CA GLY A 348 90.858 100.573 64.763 1.00 24.85 A C +ATOM 2065 C GLY A 348 89.772 99.528 64.826 1.00 22.79 A C +ATOM 2066 O GLY A 348 89.543 98.894 65.864 1.00 21.15 A O +ATOM 2067 N VAL A 349 89.073 99.394 63.717 1.00 19.93 A N +ATOM 2068 CA VAL A 349 87.999 98.425 63.649 1.00 18.15 A C +ATOM 2069 C VAL A 349 87.749 98.256 62.161 1.00 17.69 A C +ATOM 2070 O VAL A 349 87.983 99.181 61.406 1.00 16.84 A O +ATOM 2071 CB VAL A 349 86.782 98.993 64.459 1.00 18.77 A C +ATOM 2072 CG1 VAL A 349 86.277 100.282 63.780 1.00 18.53 A C +ATOM 2073 CG2 VAL A 349 85.684 97.917 64.625 1.00 17.57 A C +ATOM 2074 N LYS A 350 87.445 97.068 61.661 1.00 15.78 A N +ATOM 2075 CA LYS A 350 87.174 96.912 60.241 1.00 13.67 A C +ATOM 2076 C LYS A 350 85.938 97.771 59.876 1.00 14.13 A C +ATOM 2077 O LYS A 350 84.934 97.794 60.609 1.00 13.80 A O +ATOM 2078 CB LYS A 350 86.907 95.428 59.969 1.00 12.24 A C +ATOM 2079 CG LYS A 350 86.592 95.197 58.510 1.00 10.03 A C +ATOM 2080 CD LYS A 350 86.371 93.761 58.246 1.00 8.35 A C +ATOM 2081 CE LYS A 350 85.794 93.644 56.871 1.00 9.31 A C +ATOM 2082 NZ LYS A 350 86.757 93.894 55.809 1.00 8.29 A N1+ +ATOM 2083 N GLY A 351 85.942 98.423 58.723 1.00 14.06 A N +ATOM 2084 CA GLY A 351 84.830 99.255 58.315 1.00 12.08 A C +ATOM 2085 C GLY A 351 84.755 99.282 56.814 1.00 11.93 A C +ATOM 2086 O GLY A 351 85.603 98.664 56.161 1.00 12.66 A O +ATOM 2087 N TRP A 352 83.812 100.024 56.255 1.00 9.49 A N +ATOM 2088 CA TRP A 352 83.633 100.117 54.809 1.00 8.56 A C +ATOM 2089 C TRP A 352 83.244 101.573 54.507 1.00 8.29 A C +ATOM 2090 O TRP A 352 82.994 102.398 55.409 1.00 3.14 A O +ATOM 2091 CB TRP A 352 82.470 99.156 54.341 1.00 9.51 A C +ATOM 2092 CG TRP A 352 81.101 99.454 54.994 1.00 9.41 A C +ATOM 2093 CD1 TRP A 352 80.812 99.052 56.278 1.00 10.13 A C +ATOM 2094 CD2 TRP A 352 80.120 100.230 54.452 1.00 9.55 A C +ATOM 2095 NE1 TRP A 352 79.664 99.603 56.562 1.00 10.37 A N +ATOM 2096 CE2 TRP A 352 79.217 100.319 55.501 1.00 10.97 A C +ATOM 2097 CE3 TRP A 352 79.877 100.887 53.247 1.00 11.39 A C +ATOM 2098 CZ2 TRP A 352 78.059 101.078 55.345 1.00 9.54 A C +ATOM 2099 CZ3 TRP A 352 78.719 101.642 53.091 1.00 10.32 A C +ATOM 2100 CH2 TRP A 352 77.823 101.735 54.141 1.00 10.62 A C +ATOM 2101 N ALA A 353 83.116 101.898 53.213 1.00 7.00 A N +ATOM 2102 CA ALA A 353 82.683 103.183 52.734 1.00 6.78 A C +ATOM 2103 C ALA A 353 82.653 103.025 51.215 1.00 8.30 A C +ATOM 2104 O ALA A 353 83.229 102.059 50.721 1.00 9.16 A O +ATOM 2105 CB ALA A 353 83.666 104.231 53.084 1.00 7.16 A C +ATOM 2106 N PHE A 354 81.933 103.742 50.392 1.00 12.02 A N +ATOM 2107 CA PHE A 354 82.046 103.536 48.957 1.00 15.68 A C +ATOM 2108 C PHE A 354 81.636 104.870 48.380 1.00 19.27 A C +ATOM 2109 O PHE A 354 80.966 105.700 49.029 1.00 19.53 A O +ATOM 2110 CB PHE A 354 81.165 102.410 48.447 1.00 16.40 A C +ATOM 2111 CG PHE A 354 79.658 102.564 48.501 1.00 17.33 A C +ATOM 2112 CD1 PHE A 354 78.971 102.122 49.623 1.00 17.18 A C +ATOM 2113 CD2 PHE A 354 78.973 103.068 47.415 1.00 17.34 A C +ATOM 2114 CE1 PHE A 354 77.589 102.207 49.640 1.00 17.78 A C +ATOM 2115 CE2 PHE A 354 77.588 103.150 47.440 1.00 17.87 A C +ATOM 2116 CZ PHE A 354 76.901 102.709 48.548 1.00 16.95 A C +ATOM 2117 N ASP A 355 82.117 105.071 47.165 1.00 21.87 A N +ATOM 2118 CA ASP A 355 81.926 106.314 46.472 1.00 24.85 A C +ATOM 2119 C ASP A 355 80.726 106.357 45.569 1.00 26.62 A C +ATOM 2120 O ASP A 355 80.256 105.335 45.077 1.00 27.33 A O +ATOM 2121 CB ASP A 355 83.205 106.619 45.657 1.00 24.62 A C +ATOM 2122 CG ASP A 355 83.392 105.768 44.414 1.00 25.79 A C +ATOM 2123 OD1 ASP A 355 83.758 104.606 44.538 1.00 27.26 A O +ATOM 2124 OD2 ASP A 355 83.161 106.255 43.312 1.00 25.68 A O1- +ATOM 2125 N ASN A 356 80.245 107.564 45.345 1.00 27.60 A N +ATOM 2126 CA ASN A 356 79.123 107.795 44.467 1.00 28.63 A C +ATOM 2127 C ASN A 356 79.437 109.207 43.997 1.00 28.00 A C +ATOM 2128 O ASN A 356 79.298 110.198 44.720 1.00 27.80 A O +ATOM 2129 CB ASN A 356 77.794 107.713 45.246 1.00 29.35 A C +ATOM 2130 CG ASN A 356 76.649 108.026 44.309 1.00 29.60 A C +ATOM 2131 OD1 ASN A 356 75.843 108.912 44.568 1.00 31.60 A O +ATOM 2132 ND2 ASN A 356 76.554 107.388 43.157 1.00 29.12 A N +ATOM 2133 N GLY A 357 80.009 109.273 42.790 1.00 27.89 A N +ATOM 2134 CA GLY A 357 80.425 110.533 42.186 1.00 26.43 A C +ATOM 2135 C GLY A 357 81.505 111.157 43.087 1.00 26.26 A C +ATOM 2136 O GLY A 357 82.583 110.584 43.335 1.00 26.21 A O +ATOM 2137 N ASN A 358 81.160 112.297 43.684 1.00 24.78 A N +ATOM 2138 CA ASN A 358 82.102 112.974 44.554 1.00 22.97 A C +ATOM 2139 C ASN A 358 81.694 112.757 45.986 1.00 23.09 A C +ATOM 2140 O ASN A 358 82.314 113.235 46.954 1.00 23.32 A O +ATOM 2141 CB ASN A 358 82.108 114.446 44.286 1.00 23.42 A C +ATOM 2142 CG ASN A 358 82.687 114.795 42.928 1.00 25.50 A C +ATOM 2143 OD1 ASN A 358 83.893 114.959 42.784 1.00 27.12 A O +ATOM 2144 ND2 ASN A 358 81.938 114.934 41.844 1.00 25.29 A N +ATOM 2145 N ASP A 359 80.590 112.049 46.136 1.00 22.68 A N +ATOM 2146 CA ASP A 359 80.021 111.752 47.434 1.00 21.69 A C +ATOM 2147 C ASP A 359 80.497 110.411 47.948 1.00 20.09 A C +ATOM 2148 O ASP A 359 81.024 109.564 47.224 1.00 17.35 A O +ATOM 2149 CB ASP A 359 78.515 111.800 47.282 1.00 23.83 A C +ATOM 2150 CG ASP A 359 78.068 113.115 46.648 1.00 25.19 A C +ATOM 2151 OD1 ASP A 359 78.363 114.165 47.228 1.00 27.51 A O +ATOM 2152 OD2 ASP A 359 77.462 113.088 45.575 1.00 25.50 A O1- +ATOM 2153 N LEU A 360 80.265 110.249 49.245 1.00 18.53 A N +ATOM 2154 CA LEU A 360 80.677 109.055 49.921 1.00 17.86 A C +ATOM 2155 C LEU A 360 79.561 108.513 50.796 1.00 17.21 A C +ATOM 2156 O LEU A 360 78.889 109.305 51.461 1.00 19.70 A O +ATOM 2157 CB LEU A 360 81.889 109.366 50.792 1.00 18.36 A C +ATOM 2158 CG LEU A 360 82.575 108.204 51.509 1.00 18.39 A C +ATOM 2159 CD1 LEU A 360 83.678 107.613 50.634 1.00 18.56 A C +ATOM 2160 CD2 LEU A 360 83.120 108.713 52.828 1.00 19.01 A C +ATOM 2161 N TRP A 361 79.297 107.220 50.734 1.00 14.37 A N +ATOM 2162 CA TRP A 361 78.309 106.585 51.566 1.00 11.99 A C +ATOM 2163 C TRP A 361 79.174 105.889 52.612 1.00 12.20 A C +ATOM 2164 O TRP A 361 80.246 105.402 52.282 1.00 8.87 A O +ATOM 2165 CB TRP A 361 77.506 105.586 50.789 1.00 10.32 A C +ATOM 2166 CG TRP A 361 76.326 106.235 50.122 1.00 9.21 A C +ATOM 2167 CD1 TRP A 361 76.312 106.442 48.762 1.00 10.31 A C +ATOM 2168 CD2 TRP A 361 75.169 106.628 50.743 1.00 8.43 A C +ATOM 2169 NE1 TRP A 361 75.125 106.961 48.532 1.00 9.06 A N +ATOM 2170 CE2 TRP A 361 74.431 107.080 49.686 1.00 9.33 A C +ATOM 2171 CE3 TRP A 361 74.653 106.661 52.011 1.00 9.51 A C +ATOM 2172 CZ2 TRP A 361 73.152 107.581 49.829 1.00 10.00 A C +ATOM 2173 CZ3 TRP A 361 73.377 107.166 52.176 1.00 10.32 A C +ATOM 2174 CH2 TRP A 361 72.631 107.609 51.101 1.00 10.62 A C +ATOM 2175 N MET A 362 78.839 105.850 53.895 1.00 10.65 A N +ATOM 2176 CA MET A 362 79.729 105.197 54.839 1.00 12.26 A C +ATOM 2177 C MET A 362 79.023 104.885 56.105 1.00 12.02 A C +ATOM 2178 O MET A 362 77.902 105.349 56.283 1.00 13.50 A O +ATOM 2179 CB MET A 362 80.902 106.096 55.137 1.00 11.82 A C +ATOM 2180 CG MET A 362 80.599 107.567 55.389 1.00 13.57 A C +ATOM 2181 SD MET A 362 82.051 108.376 56.125 1.00 16.22 A S +ATOM 2182 CE MET A 362 82.021 107.998 57.880 1.00 11.99 A C +ATOM 2183 N GLY A 363 79.672 104.129 56.971 1.00 12.38 A N +ATOM 2184 CA GLY A 363 79.121 103.745 58.243 1.00 11.39 A C +ATOM 2185 C GLY A 363 80.290 103.788 59.195 1.00 12.58 A C +ATOM 2186 O GLY A 363 81.462 103.801 58.772 1.00 13.59 A O +ATOM 2187 N ARG A 364 80.021 103.944 60.462 1.00 10.47 A N +ATOM 2188 CA ARG A 364 81.072 103.963 61.451 1.00 13.02 A C +ATOM 2189 C ARG A 364 80.331 103.651 62.729 1.00 13.54 A C +ATOM 2190 O ARG A 364 79.103 103.559 62.703 1.00 11.23 A O +ATOM 2191 CB ARG A 364 81.726 105.329 61.598 1.00 13.95 A C +ATOM 2192 CG ARG A 364 80.815 106.529 61.386 1.00 17.21 A C +ATOM 2193 CD ARG A 364 81.011 107.642 62.383 1.00 18.10 A C +ATOM 2194 NE ARG A 364 81.170 108.890 61.646 1.00 21.96 A N +ATOM 2195 CZ ARG A 364 80.833 110.099 62.100 1.00 21.11 A C +ATOM 2196 NH1 ARG A 364 80.300 110.343 63.295 1.00 22.61 A N1+ +ATOM 2197 NH2 ARG A 364 81.049 111.108 61.302 1.00 21.41 A N +ATOM 2198 N THR A 365 81.006 103.458 63.855 1.00 16.54 A N +ATOM 2199 CA THR A 365 80.281 103.204 65.087 1.00 19.68 A C +ATOM 2200 C THR A 365 79.693 104.559 65.544 1.00 22.07 A C +ATOM 2201 O THR A 365 80.096 105.613 65.034 1.00 23.50 A O +ATOM 2202 CB THR A 365 81.266 102.635 66.101 1.00 19.90 A C +ATOM 2203 OG1 THR A 365 82.304 103.575 66.181 1.00 21.78 A O +ATOM 2204 CG2 THR A 365 81.937 101.338 65.682 1.00 21.68 A C +ATOM 2205 N ILE A 366 78.700 104.652 66.431 1.00 23.06 A N +ATOM 2206 CA ILE A 366 78.237 105.977 66.818 1.00 23.83 A C +ATOM 2207 C ILE A 366 79.227 106.492 67.849 1.00 25.30 A C +ATOM 2208 O ILE A 366 79.476 107.689 67.934 1.00 27.20 A O +ATOM 2209 CB ILE A 366 76.790 105.905 67.388 1.00 23.02 A C +ATOM 2210 CG1 ILE A 366 75.832 105.660 66.219 1.00 21.13 A C +ATOM 2211 CG2 ILE A 366 76.408 107.187 68.104 1.00 21.79 A C +ATOM 2212 CD1 ILE A 366 74.354 105.566 66.635 1.00 21.62 A C +ATOM 2213 N SER A 367 79.823 105.653 68.678 1.00 26.81 A N +ATOM 2214 CA SER A 367 80.777 106.130 69.661 1.00 27.41 A C +ATOM 2215 C SER A 367 82.070 106.420 68.913 1.00 28.15 A C +ATOM 2216 O SER A 367 82.325 105.914 67.831 1.00 28.70 A O +ATOM 2217 CB SER A 367 80.942 105.042 70.677 1.00 27.20 A C +ATOM 2218 OG SER A 367 81.679 105.368 71.847 1.00 28.79 A O +ATOM 2219 N LYS A 368 82.874 107.346 69.409 1.00 29.21 A N +ATOM 2220 CA LYS A 368 84.162 107.650 68.766 1.00 29.74 A C +ATOM 2221 C LYS A 368 85.266 106.933 69.553 1.00 29.73 A C +ATOM 2222 O LYS A 368 86.439 106.921 69.166 1.00 30.49 A O +ATOM 2223 CB LYS A 368 84.430 109.172 68.762 1.00 29.34 A C +ATOM 2224 CG LYS A 368 84.401 109.767 70.184 1.00 29.81 A C +ATOM 2225 CD LYS A 368 84.696 111.247 70.151 1.00 29.71 A C +ATOM 2226 CE LYS A 368 84.700 111.763 71.566 1.00 30.45 A C +ATOM 2227 NZ LYS A 368 85.774 111.174 72.348 1.00 31.47 A N1+ +ATOM 2228 N ASP A 369 84.903 106.295 70.664 1.00 29.75 A N +ATOM 2229 CA ASP A 369 85.852 105.595 71.495 1.00 30.81 A C +ATOM 2230 C ASP A 369 85.620 104.106 71.621 1.00 30.14 A C +ATOM 2231 O ASP A 369 86.574 103.342 71.685 1.00 31.47 A O +ATOM 2232 CB ASP A 369 85.854 106.089 72.925 1.00 32.28 A C +ATOM 2233 CG ASP A 369 85.939 107.586 73.127 1.00 34.01 A C +ATOM 2234 OD1 ASP A 369 87.041 108.126 73.194 1.00 34.23 A O +ATOM 2235 OD2 ASP A 369 84.882 108.203 73.239 1.00 35.61 A O1- +ATOM 2236 N LEU A 370 84.371 103.678 71.728 1.00 28.93 A N +ATOM 2237 CA LEU A 370 84.021 102.287 71.909 1.00 26.97 A C +ATOM 2238 C LEU A 370 83.339 101.747 70.696 1.00 26.10 A C +ATOM 2239 O LEU A 370 82.865 102.513 69.861 1.00 26.94 A O +ATOM 2240 CB LEU A 370 83.106 102.221 73.109 1.00 26.39 A C +ATOM 2241 CG LEU A 370 83.603 101.662 74.408 1.00 26.18 A C +ATOM 2242 CD1 LEU A 370 85.045 102.027 74.662 1.00 27.57 A C +ATOM 2243 CD2 LEU A 370 82.739 102.204 75.482 1.00 26.32 A C +ATOM 2244 N ARG A 371 83.217 100.436 70.547 1.00 25.84 A N +ATOM 2245 CA ARG A 371 82.518 99.890 69.368 1.00 24.32 A C +ATOM 2246 C ARG A 371 81.050 99.766 69.789 1.00 23.47 A C +ATOM 2247 O ARG A 371 80.617 98.706 70.253 1.00 24.75 A O +ATOM 2248 CB ARG A 371 83.107 98.534 69.007 1.00 23.05 A C +ATOM 2249 CG ARG A 371 84.444 98.654 68.357 1.00 23.19 A C +ATOM 2250 CD ARG A 371 85.127 97.326 68.461 1.00 24.24 A C +ATOM 2251 NE ARG A 371 86.259 97.302 67.559 1.00 24.81 A N +ATOM 2252 CZ ARG A 371 87.045 96.240 67.407 1.00 25.85 A C +ATOM 2253 NH1 ARG A 371 86.859 95.093 68.072 1.00 26.21 A N1+ +ATOM 2254 NH2 ARG A 371 88.056 96.337 66.563 1.00 25.78 A N +ATOM 2255 N SER A 372 80.300 100.885 69.796 1.00 21.68 A N +ATOM 2256 CA SER A 372 78.889 100.917 70.179 1.00 19.22 A C +ATOM 2257 C SER A 372 78.080 101.716 69.173 1.00 17.19 A C +ATOM 2258 O SER A 372 78.566 102.736 68.655 1.00 18.05 A O +ATOM 2259 CB SER A 372 78.754 101.544 71.538 1.00 20.86 A C +ATOM 2260 OG SER A 372 79.509 100.758 72.457 1.00 23.12 A O +ATOM 2261 N GLY A 373 76.891 101.240 68.824 1.00 11.83 A N +ATOM 2262 CA GLY A 373 76.015 101.891 67.882 1.00 9.56 A C +ATOM 2263 C GLY A 373 76.571 101.850 66.487 1.00 9.08 A C +ATOM 2264 O GLY A 373 77.766 101.572 66.333 1.00 8.23 A O +ATOM 2265 N TYR A 374 75.765 102.103 65.463 1.00 8.95 A N +ATOM 2266 CA TYR A 374 76.321 102.076 64.155 1.00 10.03 A C +ATOM 2267 C TYR A 374 75.437 103.025 63.362 1.00 12.95 A C +ATOM 2268 O TYR A 374 74.222 102.966 63.531 1.00 16.13 A O +ATOM 2269 CB TYR A 374 76.282 100.658 63.651 1.00 7.81 A C +ATOM 2270 CG TYR A 374 77.130 100.536 62.393 1.00 6.72 A C +ATOM 2271 CD1 TYR A 374 78.492 100.231 62.535 1.00 6.95 A C +ATOM 2272 CD2 TYR A 374 76.581 100.740 61.155 1.00 5.79 A C +ATOM 2273 CE1 TYR A 374 79.326 100.122 61.453 1.00 4.21 A C +ATOM 2274 CE2 TYR A 374 77.422 100.651 60.050 1.00 4.62 A C +ATOM 2275 CZ TYR A 374 78.770 100.344 60.221 1.00 5.86 A C +ATOM 2276 OH TYR A 374 79.611 100.243 59.136 1.00 7.36 A O +ATOM 2277 N GLU A 375 75.933 103.892 62.478 1.00 15.39 A N +ATOM 2278 CA GLU A 375 75.087 104.823 61.765 1.00 16.52 A C +ATOM 2279 C GLU A 375 75.586 104.890 60.333 1.00 17.20 A C +ATOM 2280 O GLU A 375 76.765 104.570 60.124 1.00 17.96 A O +ATOM 2281 CB GLU A 375 75.217 106.187 62.460 1.00 19.44 A C +ATOM 2282 CG GLU A 375 76.657 106.752 62.400 1.00 23.90 A C +ATOM 2283 CD GLU A 375 76.956 108.068 63.114 1.00 26.45 A C +ATOM 2284 OE1 GLU A 375 76.228 109.030 62.878 1.00 29.74 A O +ATOM 2285 OE2 GLU A 375 77.915 108.162 63.895 1.00 27.59 A O1- +ATOM 2286 N THR A 376 74.796 105.166 59.303 1.00 16.62 A N +ATOM 2287 CA THR A 376 75.346 105.289 57.977 1.00 17.38 A C +ATOM 2288 C THR A 376 74.972 106.662 57.413 1.00 17.96 A C +ATOM 2289 O THR A 376 73.998 107.231 57.914 1.00 19.16 A O +ATOM 2290 CB THR A 376 74.814 104.209 57.062 1.00 18.69 A C +ATOM 2291 OG1 THR A 376 73.400 104.286 56.955 1.00 20.41 A O +ATOM 2292 CG2 THR A 376 75.184 102.866 57.630 1.00 19.64 A C +ATOM 2293 N PHE A 377 75.660 107.299 56.447 1.00 16.42 A N +ATOM 2294 CA PHE A 377 75.241 108.583 55.915 1.00 15.12 A C +ATOM 2295 C PHE A 377 75.953 108.862 54.630 1.00 16.13 A C +ATOM 2296 O PHE A 377 76.886 108.106 54.286 1.00 17.54 A O +ATOM 2297 CB PHE A 377 75.548 109.724 56.878 1.00 14.48 A C +ATOM 2298 CG PHE A 377 76.882 109.761 57.644 1.00 13.40 A C +ATOM 2299 CD1 PHE A 377 78.045 110.199 57.036 1.00 12.63 A C +ATOM 2300 CD2 PHE A 377 76.892 109.409 58.986 1.00 13.01 A C +ATOM 2301 CE1 PHE A 377 79.203 110.280 57.769 1.00 11.78 A C +ATOM 2302 CE2 PHE A 377 78.058 109.505 59.708 1.00 13.40 A C +ATOM 2303 CZ PHE A 377 79.209 109.945 59.091 1.00 12.52 A C +ATOM 2304 N LYS A 378 75.544 109.901 53.917 1.00 15.73 A N +ATOM 2305 CA LYS A 378 76.223 110.273 52.673 1.00 16.76 A C +ATOM 2306 C LYS A 378 76.977 111.530 53.051 1.00 17.30 A C +ATOM 2307 O LYS A 378 76.482 112.315 53.861 1.00 16.79 A O +ATOM 2308 CB LYS A 378 75.289 110.647 51.582 1.00 15.45 A C +ATOM 2309 CG LYS A 378 75.878 110.777 50.196 1.00 14.37 A C +ATOM 2310 CD LYS A 378 74.752 111.608 49.641 1.00 14.85 A C +ATOM 2311 CE LYS A 378 73.965 110.978 48.537 1.00 16.23 A C +ATOM 2312 NZ LYS A 378 74.694 111.046 47.280 1.00 18.57 A N1+ +ATOM 2313 N VAL A 379 78.193 111.751 52.576 1.00 19.21 A N +ATOM 2314 CA VAL A 379 78.965 112.958 52.890 1.00 19.29 A C +ATOM 2315 C VAL A 379 79.098 113.597 51.529 1.00 21.26 A C +ATOM 2316 O VAL A 379 79.695 113.058 50.571 1.00 21.16 A O +ATOM 2317 CB VAL A 379 80.375 112.664 53.447 1.00 19.21 A C +ATOM 2318 CG1 VAL A 379 81.116 113.946 53.705 1.00 18.13 A C +ATOM 2319 CG2 VAL A 379 80.278 111.973 54.796 1.00 18.88 A C +ATOM 2320 N ILE A 380 78.439 114.743 51.406 1.00 22.55 A N +ATOM 2321 CA ILE A 380 78.468 115.472 50.158 1.00 23.51 A C +ATOM 2322 C ILE A 380 79.900 115.951 50.019 1.00 24.03 A C +ATOM 2323 O ILE A 380 80.505 116.491 50.963 1.00 25.20 A O +ATOM 2324 CB ILE A 380 77.518 116.608 50.241 1.00 23.09 A C +ATOM 2325 CG1 ILE A 380 76.169 116.207 50.767 1.00 23.70 A C +ATOM 2326 CG2 ILE A 380 77.331 117.068 48.804 1.00 24.47 A C +ATOM 2327 CD1 ILE A 380 75.315 117.466 51.009 1.00 25.64 A C +ATOM 2328 N GLY A 381 80.483 115.567 48.894 1.00 24.48 A N +ATOM 2329 CA GLY A 381 81.876 115.923 48.627 1.00 24.40 A C +ATOM 2330 C GLY A 381 82.858 114.942 49.302 1.00 24.93 A C +ATOM 2331 O GLY A 381 84.034 114.895 48.931 1.00 24.22 A O +ATOM 2332 N GLY A 382 82.396 114.046 50.195 1.00 24.26 A N +ATOM 2333 CA GLY A 382 83.206 113.086 50.931 1.00 22.84 A C +ATOM 2334 C GLY A 382 84.212 112.271 50.150 1.00 22.75 A C +ATOM 2335 O GLY A 382 85.181 111.806 50.742 1.00 21.49 A O +ATOM 2336 N TRP A 383 84.034 112.090 48.856 1.00 22.17 A N +ATOM 2337 CA TRP A 383 84.972 111.314 48.093 1.00 23.31 A C +ATOM 2338 C TRP A 383 86.063 112.168 47.483 1.00 24.77 A C +ATOM 2339 O TRP A 383 87.209 111.726 47.359 1.00 27.05 A O +ATOM 2340 CB TRP A 383 84.288 110.555 46.924 1.00 23.33 A C +ATOM 2341 CG TRP A 383 85.277 109.656 46.206 1.00 23.06 A C +ATOM 2342 CD1 TRP A 383 85.619 109.924 44.914 1.00 23.66 A C +ATOM 2343 CD2 TRP A 383 86.003 108.607 46.759 1.00 23.45 A C +ATOM 2344 NE1 TRP A 383 86.589 109.059 44.642 1.00 24.82 A N +ATOM 2345 CE2 TRP A 383 86.859 108.257 45.699 1.00 24.45 A C +ATOM 2346 CE3 TRP A 383 86.081 107.912 47.963 1.00 23.02 A C +ATOM 2347 CZ2 TRP A 383 87.791 107.228 45.831 1.00 23.04 A C +ATOM 2348 CZ3 TRP A 383 87.008 106.886 48.091 1.00 23.17 A C +ATOM 2349 CH2 TRP A 383 87.853 106.550 47.038 1.00 22.64 A C +ATOM 2350 N SER A 384 85.718 113.400 47.131 1.00 24.99 A N +ATOM 2351 CA SER A 384 86.644 114.289 46.470 1.00 23.57 A C +ATOM 2352 C SER A 384 87.058 115.552 47.147 1.00 23.01 A C +ATOM 2353 O SER A 384 88.033 116.121 46.647 1.00 24.22 A O +ATOM 2354 CB SER A 384 86.093 114.708 45.150 1.00 24.35 A C +ATOM 2355 OG SER A 384 85.671 113.556 44.464 1.00 25.97 A O +ATOM 2356 N THR A 385 86.481 116.099 48.193 1.00 20.86 A N +ATOM 2357 CA THR A 385 87.066 117.324 48.615 1.00 22.00 A C +ATOM 2358 C THR A 385 87.725 117.085 49.936 1.00 20.70 A C +ATOM 2359 O THR A 385 87.067 116.613 50.873 1.00 20.82 A O +ATOM 2360 CB THR A 385 85.969 118.402 48.632 1.00 23.27 A C +ATOM 2361 OG1 THR A 385 85.008 118.077 49.619 1.00 27.16 A O +ATOM 2362 CG2 THR A 385 85.232 118.450 47.295 1.00 22.86 A C +ATOM 2363 N PRO A 386 89.039 117.329 50.016 1.00 19.84 A N +ATOM 2364 CA PRO A 386 89.781 117.278 51.257 1.00 18.48 A C +ATOM 2365 C PRO A 386 88.897 117.834 52.363 1.00 18.86 A C +ATOM 2366 O PRO A 386 88.206 118.839 52.179 1.00 20.80 A O +ATOM 2367 CB PRO A 386 91.009 118.083 50.923 1.00 17.59 A C +ATOM 2368 CG PRO A 386 91.041 118.296 49.396 1.00 18.62 A C +ATOM 2369 CD PRO A 386 89.966 117.384 48.879 1.00 18.48 A C +ATOM 2370 N ASN A 387 88.712 117.093 53.433 1.00 18.70 A N +ATOM 2371 CA ASN A 387 87.907 117.521 54.551 1.00 18.30 A C +ATOM 2372 C ASN A 387 86.399 117.791 54.460 1.00 19.40 A C +ATOM 2373 O ASN A 387 85.823 118.225 55.464 1.00 19.22 A O +ATOM 2374 CB ASN A 387 88.589 118.719 55.147 1.00 16.99 A C +ATOM 2375 CG ASN A 387 88.777 118.464 56.629 1.00 18.23 A C +ATOM 2376 OD1 ASN A 387 89.165 119.341 57.399 1.00 17.91 A O +ATOM 2377 ND2 ASN A 387 88.683 117.273 57.188 1.00 17.99 A N +ATOM 2378 N SER A 388 85.669 117.466 53.379 1.00 19.40 A N +ATOM 2379 CA SER A 388 84.228 117.699 53.299 1.00 20.13 A C +ATOM 2380 C SER A 388 83.510 117.094 54.454 1.00 21.15 A C +ATOM 2381 O SER A 388 83.789 115.934 54.733 1.00 22.71 A O +ATOM 2382 CB SER A 388 83.582 117.079 52.109 1.00 20.96 A C +ATOM 2383 OG SER A 388 84.430 116.079 51.559 1.00 22.12 A O +ATOM 2384 N LYS A 389 82.650 117.831 55.143 1.00 22.63 A N +ATOM 2385 CA LYS A 389 81.904 117.332 56.286 1.00 22.69 A C +ATOM 2386 C LYS A 389 80.411 117.598 56.131 1.00 23.29 A C +ATOM 2387 O LYS A 389 79.692 117.624 57.127 1.00 22.36 A O +ATOM 2388 CB LYS A 389 82.367 117.994 57.587 1.00 22.17 A C +ATOM 2389 CG LYS A 389 83.820 117.852 57.933 1.00 21.84 A C +ATOM 2390 CD LYS A 389 84.073 118.332 59.373 1.00 21.38 A C +ATOM 2391 CE LYS A 389 85.551 118.100 59.681 1.00 22.35 A C +ATOM 2392 NZ LYS A 389 85.804 118.231 61.100 1.00 22.94 A N1+ +ATOM 2393 N SER A 390 79.873 117.830 54.941 1.00 23.62 A N +ATOM 2394 CA SER A 390 78.452 118.058 54.846 1.00 26.70 A C +ATOM 2395 C SER A 390 77.817 116.685 54.751 1.00 26.80 A C +ATOM 2396 O SER A 390 77.986 115.971 53.758 1.00 27.14 A O +ATOM 2397 CB SER A 390 78.112 118.861 53.593 1.00 28.83 A C +ATOM 2398 OG SER A 390 78.835 120.096 53.493 1.00 33.33 A O +ATOM 2399 N GLN A 391 77.085 116.332 55.793 1.00 27.39 A N +ATOM 2400 CA GLN A 391 76.387 115.055 55.910 1.00 26.95 A C +ATOM 2401 C GLN A 391 74.929 115.162 55.513 1.00 27.76 A C +ATOM 2402 O GLN A 391 74.369 116.257 55.652 1.00 29.93 A O +ATOM 2403 CB GLN A 391 76.497 114.639 57.346 1.00 25.09 A C +ATOM 2404 CG GLN A 391 75.804 113.384 57.667 1.00 25.61 A C +ATOM 2405 CD GLN A 391 75.800 113.070 59.143 1.00 26.32 A C +ATOM 2406 OE1 GLN A 391 74.900 112.364 59.584 1.00 26.73 A O +ATOM 2407 NE2 GLN A 391 76.714 113.520 59.996 1.00 25.23 A N +ATOM 2408 N ILE A 392 74.264 114.107 55.039 1.00 27.63 A N +ATOM 2409 CA ILE A 392 72.843 114.116 54.711 1.00 26.34 A C +ATOM 2410 C ILE A 392 72.397 112.643 54.690 1.00 26.41 A C +ATOM 2411 O ILE A 392 73.270 111.764 54.692 1.00 28.90 A O +ATOM 2412 CB ILE A 392 72.573 114.792 53.340 1.00 27.04 A C +ATOM 2413 CG1 ILE A 392 71.056 115.090 53.334 1.00 28.15 A C +ATOM 2414 CG2 ILE A 392 73.005 113.948 52.146 1.00 25.80 A C +ATOM 2415 CD1 ILE A 392 70.467 116.103 52.334 1.00 27.76 A C +ATOM 2416 N ASN A 393 71.102 112.274 54.746 1.00 23.38 A N +ATOM 2417 CA ASN A 393 70.631 110.896 54.697 1.00 19.26 A C +ATOM 2418 C ASN A 393 71.146 110.002 55.779 1.00 17.41 A C +ATOM 2419 O ASN A 393 71.283 108.805 55.561 1.00 19.09 A O +ATOM 2420 CB ASN A 393 70.956 110.287 53.335 1.00 19.29 A C +ATOM 2421 CG ASN A 393 70.054 110.848 52.248 1.00 21.75 A C +ATOM 2422 OD1 ASN A 393 70.413 110.930 51.066 1.00 22.23 A O +ATOM 2423 ND2 ASN A 393 68.827 111.298 52.535 1.00 22.63 A N +ATOM 2424 N ARG A 394 71.375 110.474 56.995 1.00 15.97 A N +ATOM 2425 CA ARG A 394 71.875 109.558 58.000 1.00 15.84 A C +ATOM 2426 C ARG A 394 70.800 108.567 58.446 1.00 15.89 A C +ATOM 2427 O ARG A 394 69.604 108.859 58.302 1.00 16.32 A O +ATOM 2428 CB ARG A 394 72.442 110.412 59.172 1.00 14.45 A C +ATOM 2429 CG ARG A 394 71.900 110.213 60.549 1.00 13.83 A C +ATOM 2430 CD ARG A 394 72.959 109.894 61.556 1.00 10.98 A C +ATOM 2431 NE ARG A 394 72.145 109.928 62.730 1.00 12.85 A N +ATOM 2432 CZ ARG A 394 72.538 109.567 63.945 1.00 14.04 A C +ATOM 2433 NH1 ARG A 394 73.733 109.112 64.158 1.00 14.50 A N1+ +ATOM 2434 NH2 ARG A 394 71.704 109.629 64.999 1.00 16.89 A N +ATOM 2435 N GLN A 395 71.149 107.358 58.914 1.00 14.90 A N +ATOM 2436 CA GLN A 395 70.221 106.344 59.385 1.00 13.29 A C +ATOM 2437 C GLN A 395 70.829 105.691 60.591 1.00 13.42 A C +ATOM 2438 O GLN A 395 72.037 105.471 60.569 1.00 14.54 A O +ATOM 2439 CB GLN A 395 70.026 105.201 58.419 1.00 12.59 A C +ATOM 2440 CG GLN A 395 69.457 105.632 57.099 1.00 11.75 A C +ATOM 2441 CD GLN A 395 69.225 104.536 56.101 1.00 11.40 A C +ATOM 2442 OE1 GLN A 395 69.625 104.663 54.943 1.00 12.29 A O +ATOM 2443 NE2 GLN A 395 68.539 103.472 56.422 1.00 12.04 A N +ATOM 2444 N VAL A 396 70.160 105.467 61.707 1.00 14.05 A N +ATOM 2445 CA VAL A 396 70.773 104.737 62.794 1.00 15.08 A C +ATOM 2446 C VAL A 396 70.488 103.264 62.385 1.00 17.08 A C +ATOM 2447 O VAL A 396 69.525 102.958 61.663 1.00 20.89 A O +ATOM 2448 CB VAL A 396 70.090 105.053 64.086 1.00 14.83 A C +ATOM 2449 CG1 VAL A 396 70.410 104.019 65.136 1.00 15.26 A C +ATOM 2450 CG2 VAL A 396 70.572 106.397 64.555 1.00 14.93 A C +ATOM 2451 N ILE A 397 71.384 102.324 62.659 1.00 17.94 A N +ATOM 2452 CA ILE A 397 71.203 100.917 62.343 1.00 16.20 A C +ATOM 2453 C ILE A 397 71.257 100.261 63.725 1.00 17.34 A C +ATOM 2454 O ILE A 397 70.491 99.332 63.979 1.00 17.87 A O +ATOM 2455 CB ILE A 397 72.339 100.414 61.472 1.00 16.17 A C +ATOM 2456 CG1 ILE A 397 72.374 101.247 60.190 1.00 16.06 A C +ATOM 2457 CG2 ILE A 397 72.195 98.905 61.247 1.00 14.97 A C +ATOM 2458 CD1 ILE A 397 71.326 101.093 59.057 1.00 14.46 A C +ATOM 2459 N VAL A 398 72.096 100.651 64.668 1.00 16.76 A N +ATOM 2460 CA VAL A 398 72.104 100.026 65.986 1.00 18.72 A C +ATOM 2461 C VAL A 398 72.234 101.269 66.849 1.00 21.45 A C +ATOM 2462 O VAL A 398 73.141 102.086 66.618 1.00 22.17 A O +ATOM 2463 CB VAL A 398 73.340 99.135 66.259 1.00 17.29 A C +ATOM 2464 CG1 VAL A 398 73.264 98.555 67.662 1.00 15.74 A C +ATOM 2465 CG2 VAL A 398 73.401 98.018 65.269 1.00 16.83 A C +ATOM 2466 N ASP A 399 71.297 101.514 67.754 1.00 23.94 A N +ATOM 2467 CA ASP A 399 71.410 102.681 68.594 1.00 26.77 A C +ATOM 2468 C ASP A 399 72.668 102.637 69.444 1.00 27.74 A C +ATOM 2469 O ASP A 399 73.156 101.582 69.848 1.00 27.92 A O +ATOM 2470 CB ASP A 399 70.207 102.804 69.515 1.00 27.53 A C +ATOM 2471 CG ASP A 399 70.025 101.627 70.447 1.00 28.81 A C +ATOM 2472 OD1 ASP A 399 69.546 100.615 69.953 1.00 30.40 A O +ATOM 2473 OD2 ASP A 399 70.349 101.701 71.636 1.00 28.86 A O1- +ATOM 2474 N SER A 400 73.074 103.827 69.844 1.00 29.59 A N +ATOM 2475 CA SER A 400 74.250 104.101 70.643 1.00 30.41 A C +ATOM 2476 C SER A 400 74.290 103.500 72.006 1.00 30.23 A C +ATOM 2477 O SER A 400 75.233 103.749 72.736 1.00 31.14 A O +ATOM 2478 CB SER A 400 74.396 105.608 70.749 1.00 31.87 A C +ATOM 2479 OG SER A 400 73.124 106.185 71.029 1.00 33.83 A O +ATOM 2480 N ASP A 401 73.276 102.781 72.414 1.00 30.42 A N +ATOM 2481 CA ASP A 401 73.337 102.162 73.716 1.00 31.44 A C +ATOM 2482 C ASP A 401 73.585 100.678 73.581 1.00 30.84 A C +ATOM 2483 O ASP A 401 73.651 99.969 74.586 1.00 30.95 A O +ATOM 2484 CB ASP A 401 72.044 102.405 74.475 1.00 34.37 A C +ATOM 2485 CG ASP A 401 72.212 103.624 75.367 1.00 36.89 A C +ATOM 2486 OD1 ASP A 401 72.724 104.657 74.914 1.00 38.84 A O +ATOM 2487 OD2 ASP A 401 71.860 103.528 76.537 1.00 38.62 A O1- +ATOM 2488 N ASN A 402 73.758 100.191 72.351 1.00 28.64 A N +ATOM 2489 CA ASN A 402 73.992 98.785 72.110 1.00 26.92 A C +ATOM 2490 C ASN A 402 75.313 98.629 71.411 1.00 26.72 A C +ATOM 2491 O ASN A 402 75.813 99.563 70.752 1.00 27.24 A O +ATOM 2492 CB ASN A 402 72.925 98.227 71.239 1.00 27.34 A C +ATOM 2493 CG ASN A 402 71.724 97.988 72.094 1.00 28.09 A C +ATOM 2494 OD1 ASN A 402 71.680 97.107 72.945 1.00 29.51 A O +ATOM 2495 ND2 ASN A 402 70.700 98.783 71.915 1.00 27.46 A N +ATOM 2496 N ARG A 403 75.836 97.408 71.483 1.00 24.22 A N +ATOM 2497 CA ARG A 403 77.118 97.084 70.908 1.00 21.00 A C +ATOM 2498 C ARG A 403 77.106 96.779 69.438 1.00 19.72 A C +ATOM 2499 O ARG A 403 76.116 96.209 68.961 1.00 19.81 A O +ATOM 2500 CB ARG A 403 77.680 95.886 71.624 1.00 20.88 A C +ATOM 2501 CG ARG A 403 77.602 95.913 73.141 1.00 20.10 A C +ATOM 2502 CD ARG A 403 78.992 95.728 73.659 1.00 18.00 A C +ATOM 2503 NE ARG A 403 79.327 94.406 74.124 1.00 17.87 A N +ATOM 2504 CZ ARG A 403 80.510 93.881 73.800 1.00 18.20 A C +ATOM 2505 NH1 ARG A 403 81.337 94.459 72.937 1.00 18.58 A N1+ +ATOM 2506 NH2 ARG A 403 80.867 92.697 74.244 1.00 18.01 A N +ATOM 2507 N SER A 404 78.159 97.180 68.723 1.00 18.20 A N +ATOM 2508 CA SER A 404 78.291 96.857 67.308 1.00 17.11 A C +ATOM 2509 C SER A 404 79.662 96.143 67.148 1.00 15.17 A C +ATOM 2510 O SER A 404 80.049 95.334 68.014 1.00 14.25 A O +ATOM 2511 CB SER A 404 78.246 98.117 66.498 1.00 18.27 A C +ATOM 2512 OG SER A 404 79.230 98.931 67.108 1.00 21.54 A O +ATOM 2513 N GLY A 405 80.484 96.368 66.106 1.00 14.33 A N +ATOM 2514 CA GLY A 405 81.761 95.701 65.934 1.00 11.47 A C +ATOM 2515 C GLY A 405 82.236 96.007 64.525 1.00 11.95 A C +ATOM 2516 O GLY A 405 82.137 97.151 64.039 1.00 11.10 A O +ATOM 2517 N TYR A 406 82.746 94.968 63.870 1.00 11.06 A N +ATOM 2518 CA TYR A 406 83.271 95.033 62.518 1.00 10.50 A C +ATOM 2519 C TYR A 406 82.197 95.305 61.499 1.00 9.32 A C +ATOM 2520 O TYR A 406 81.052 95.095 61.846 1.00 9.12 A O +ATOM 2521 CB TYR A 406 83.960 93.695 62.126 1.00 10.17 A C +ATOM 2522 CG TYR A 406 85.395 93.501 62.637 1.00 12.49 A C +ATOM 2523 CD1 TYR A 406 85.913 94.246 63.686 1.00 11.75 A C +ATOM 2524 CD2 TYR A 406 86.230 92.621 61.953 1.00 12.46 A C +ATOM 2525 CE1 TYR A 406 87.261 94.130 64.030 1.00 13.42 A C +ATOM 2526 CE2 TYR A 406 87.582 92.502 62.296 1.00 13.09 A C +ATOM 2527 CZ TYR A 406 88.094 93.272 63.327 1.00 13.96 A C +ATOM 2528 OH TYR A 406 89.468 93.232 63.558 1.00 15.41 A O +ATOM 2529 N SER A 407 82.452 95.753 60.260 1.00 8.60 A N +ATOM 2530 CA SER A 407 81.379 95.925 59.307 1.00 7.52 A C +ATOM 2531 C SER A 407 82.037 95.802 57.945 1.00 8.30 A C +ATOM 2532 O SER A 407 83.246 95.988 57.832 1.00 10.59 A O +ATOM 2533 CB SER A 407 80.724 97.267 59.460 1.00 10.43 A C +ATOM 2534 OG SER A 407 81.575 98.422 59.496 1.00 11.89 A O +ATOM 2535 N GLY A 408 81.359 95.429 56.896 1.00 7.23 A N +ATOM 2536 CA GLY A 408 82.082 95.307 55.649 1.00 6.91 A C +ATOM 2537 C GLY A 408 81.091 95.458 54.537 1.00 6.88 A C +ATOM 2538 O GLY A 408 79.885 95.374 54.794 1.00 6.83 A O +ATOM 2539 N ILE A 409 81.550 95.435 53.304 1.00 6.35 A N +ATOM 2540 CA ILE A 409 80.670 95.649 52.231 1.00 6.74 A C +ATOM 2541 C ILE A 409 80.520 94.390 51.413 1.00 10.95 A C +ATOM 2542 O ILE A 409 81.384 93.504 51.526 1.00 12.02 A O +ATOM 2543 CB ILE A 409 81.314 96.809 51.473 1.00 7.76 A C +ATOM 2544 CG1 ILE A 409 80.201 97.606 50.826 1.00 7.65 A C +ATOM 2545 CG2 ILE A 409 82.386 96.283 50.494 1.00 8.01 A C +ATOM 2546 CD1 ILE A 409 80.557 98.237 49.465 1.00 8.26 A C +ATOM 2547 N PHE A 410 79.464 94.258 50.598 1.00 10.18 A N +ATOM 2548 CA PHE A 410 79.346 93.087 49.749 1.00 11.97 A C +ATOM 2549 C PHE A 410 78.478 93.549 48.568 1.00 12.52 A C +ATOM 2550 O PHE A 410 77.582 94.391 48.722 1.00 13.67 A O +ATOM 2551 CB PHE A 410 78.766 91.901 50.594 1.00 9.70 A C +ATOM 2552 CG PHE A 410 77.329 91.818 51.041 1.00 5.96 A C +ATOM 2553 CD1 PHE A 410 76.392 91.254 50.211 1.00 4.88 A C +ATOM 2554 CD2 PHE A 410 76.965 92.238 52.300 1.00 5.03 A C +ATOM 2555 CE1 PHE A 410 75.091 91.102 50.616 1.00 3.58 A C +ATOM 2556 CE2 PHE A 410 75.641 92.084 52.703 1.00 5.89 A C +ATOM 2557 CZ PHE A 410 74.706 91.514 51.864 1.00 3.60 A C +ATOM 2558 N SER A 411 78.777 93.122 47.367 1.00 13.94 A N +ATOM 2559 CA SER A 411 78.015 93.607 46.258 1.00 13.35 A C +ATOM 2560 C SER A 411 77.123 92.543 45.700 1.00 16.18 A C +ATOM 2561 O SER A 411 77.571 91.386 45.632 1.00 16.37 A O +ATOM 2562 CB SER A 411 79.037 94.113 45.239 1.00 15.22 A C +ATOM 2563 OG SER A 411 79.853 95.197 45.709 1.00 14.32 A O +ATOM 2564 N VAL A 412 75.870 92.840 45.331 1.00 16.23 A N +ATOM 2565 CA VAL A 412 75.026 91.789 44.765 1.00 18.58 A C +ATOM 2566 C VAL A 412 74.758 92.228 43.325 1.00 19.33 A C +ATOM 2567 O VAL A 412 74.493 93.411 43.145 1.00 19.11 A O +ATOM 2568 CB VAL A 412 73.744 91.664 45.637 1.00 18.27 A C +ATOM 2569 CG1 VAL A 412 74.082 91.582 47.146 1.00 16.21 A C +ATOM 2570 CG2 VAL A 412 72.932 92.928 45.502 1.00 21.21 A C +ATOM 2571 N GLU A 413 74.888 91.441 42.257 1.00 20.79 A N +ATOM 2572 CA GLU A 413 74.618 91.994 40.945 1.00 23.98 A C +ATOM 2573 C GLU A 413 73.123 92.063 40.730 1.00 26.06 A C +ATOM 2574 O GLU A 413 72.398 91.088 40.916 1.00 26.92 A O +ATOM 2575 CB GLU A 413 75.184 91.161 39.831 1.00 25.33 A C +ATOM 2576 CG GLU A 413 75.288 92.027 38.620 1.00 28.41 A C +ATOM 2577 CD GLU A 413 75.378 91.261 37.316 1.00 30.57 A C +ATOM 2578 OE1 GLU A 413 74.389 90.651 36.950 1.00 33.57 A O +ATOM 2579 OE2 GLU A 413 76.383 91.302 36.611 1.00 32.57 A O1- +ATOM 2580 N GLY A 414 72.629 93.235 40.384 1.00 27.96 A N +ATOM 2581 CA GLY A 414 71.219 93.382 40.155 1.00 28.86 A C +ATOM 2582 C GLY A 414 70.976 93.221 38.679 1.00 30.53 A C +ATOM 2583 O GLY A 414 71.887 92.940 37.892 1.00 31.19 A O +ATOM 2584 N LYS A 415 69.724 93.470 38.306 1.00 31.15 A N +ATOM 2585 CA LYS A 415 69.284 93.366 36.935 1.00 32.14 A C +ATOM 2586 C LYS A 415 69.863 94.397 35.996 1.00 31.60 A C +ATOM 2587 O LYS A 415 70.130 94.122 34.828 1.00 32.04 A O +ATOM 2588 CB LYS A 415 67.776 93.482 36.884 1.00 33.93 A C +ATOM 2589 CG LYS A 415 67.165 92.869 35.617 1.00 36.86 A C +ATOM 2590 CD LYS A 415 65.667 93.239 35.432 1.00 38.80 A C +ATOM 2591 CE LYS A 415 64.764 92.862 36.633 1.00 39.89 A C +ATOM 2592 NZ LYS A 415 64.817 91.425 36.927 1.00 40.82 A N1+ +ATOM 2593 N SER A 416 70.016 95.615 36.472 1.00 30.79 A N +ATOM 2594 CA SER A 416 70.521 96.674 35.603 1.00 30.23 A C +ATOM 2595 C SER A 416 71.759 97.395 36.134 1.00 28.92 A C +ATOM 2596 O SER A 416 72.520 98.010 35.381 1.00 28.80 A O +ATOM 2597 CB SER A 416 69.344 97.620 35.405 1.00 31.77 A C +ATOM 2598 OG SER A 416 68.748 97.921 36.693 1.00 32.91 A O +ATOM 2599 N CYS A 417 71.958 97.314 37.444 1.00 26.21 A N +ATOM 2600 CA CYS A 417 73.075 97.933 38.102 1.00 24.15 A C +ATOM 2601 C CYS A 417 73.594 97.004 39.207 1.00 24.18 A C +ATOM 2602 O CYS A 417 72.986 95.947 39.452 1.00 23.38 A O +ATOM 2603 CB CYS A 417 72.584 99.228 38.670 1.00 23.42 A C +ATOM 2604 SG CYS A 417 71.248 98.915 39.829 1.00 20.19 A S +ATOM 2605 N ILE A 418 74.749 97.254 39.849 1.00 22.88 A N +ATOM 2606 CA ILE A 418 75.167 96.344 40.893 1.00 20.66 A C +ATOM 2607 C ILE A 418 75.005 97.172 42.170 1.00 19.36 A C +ATOM 2608 O ILE A 418 75.369 98.358 42.308 1.00 19.04 A O +ATOM 2609 CB ILE A 418 76.676 95.727 40.636 1.00 20.89 A C +ATOM 2610 CG1 ILE A 418 77.709 96.577 41.203 1.00 21.24 A C +ATOM 2611 CG2 ILE A 418 77.001 95.531 39.160 1.00 19.63 A C +ATOM 2612 CD1 ILE A 418 78.010 95.890 42.539 1.00 21.94 A C +ATOM 2613 N ASN A 419 74.430 96.511 43.157 1.00 18.65 A N +ATOM 2614 CA ASN A 419 74.131 97.167 44.403 1.00 18.19 A C +ATOM 2615 C ASN A 419 75.137 96.917 45.485 1.00 17.07 A C +ATOM 2616 O ASN A 419 75.863 95.938 45.418 1.00 16.26 A O +ATOM 2617 CB ASN A 419 72.729 96.707 44.772 1.00 19.70 A C +ATOM 2618 CG ASN A 419 72.101 97.384 45.970 1.00 20.99 A C +ATOM 2619 OD1 ASN A 419 71.302 96.781 46.690 1.00 22.43 A O +ATOM 2620 ND2 ASN A 419 72.325 98.661 46.268 1.00 21.80 A N +ATOM 2621 N ARG A 420 75.156 97.744 46.533 1.00 15.74 A N +ATOM 2622 CA ARG A 420 76.112 97.611 47.601 1.00 13.51 A C +ATOM 2623 C ARG A 420 75.335 97.371 48.864 1.00 12.96 A C +ATOM 2624 O ARG A 420 74.327 98.044 49.095 1.00 11.93 A O +ATOM 2625 CB ARG A 420 76.924 98.900 47.752 1.00 13.90 A C +ATOM 2626 CG ARG A 420 77.570 99.408 46.467 1.00 13.35 A C +ATOM 2627 CD ARG A 420 78.794 98.648 46.031 1.00 12.09 A C +ATOM 2628 NE ARG A 420 79.272 99.335 44.863 1.00 12.39 A N +ATOM 2629 CZ ARG A 420 80.022 98.764 43.934 1.00 13.28 A C +ATOM 2630 NH1 ARG A 420 80.392 97.488 44.001 1.00 13.97 A N1+ +ATOM 2631 NH2 ARG A 420 80.402 99.503 42.883 1.00 14.40 A N +ATOM 2632 N CYS A 421 75.794 96.444 49.672 1.00 12.11 A N +ATOM 2633 CA CYS A 421 75.141 96.103 50.914 1.00 11.98 A C +ATOM 2634 C CYS A 421 76.218 96.023 52.000 1.00 11.69 A C +ATOM 2635 O CYS A 421 77.415 96.027 51.664 1.00 9.84 A O +ATOM 2636 CB CYS A 421 74.457 94.757 50.771 1.00 12.72 A C +ATOM 2637 SG CYS A 421 73.330 94.481 49.377 1.00 15.34 A S +ATOM 2638 N PHE A 422 75.885 95.883 53.292 1.00 10.86 A N +ATOM 2639 CA PHE A 422 76.921 95.834 54.312 1.00 8.55 A C +ATOM 2640 C PHE A 422 76.463 94.973 55.464 1.00 8.81 A C +ATOM 2641 O PHE A 422 75.277 94.736 55.582 1.00 8.22 A O +ATOM 2642 CB PHE A 422 77.266 97.223 54.925 1.00 10.00 A C +ATOM 2643 CG PHE A 422 76.187 98.004 55.668 1.00 7.53 A C +ATOM 2644 CD1 PHE A 422 75.305 98.808 54.950 1.00 7.61 A C +ATOM 2645 CD2 PHE A 422 76.091 97.923 57.029 1.00 7.85 A C +ATOM 2646 CE1 PHE A 422 74.322 99.534 55.592 1.00 5.50 A C +ATOM 2647 CE2 PHE A 422 75.102 98.651 57.664 1.00 7.32 A C +ATOM 2648 CZ PHE A 422 74.220 99.452 56.963 1.00 6.55 A C +ATOM 2649 N TYR A 423 77.314 94.494 56.356 1.00 6.10 A N +ATOM 2650 CA TYR A 423 76.793 93.672 57.463 1.00 5.58 A C +ATOM 2651 C TYR A 423 77.340 94.348 58.679 1.00 3.86 A C +ATOM 2652 O TYR A 423 78.355 95.043 58.546 1.00 2.00 A O +ATOM 2653 CB TYR A 423 77.356 92.208 57.451 1.00 4.33 A C +ATOM 2654 CG TYR A 423 78.889 92.155 57.311 1.00 3.59 A C +ATOM 2655 CD1 TYR A 423 79.441 92.124 56.020 1.00 4.38 A C +ATOM 2656 CD2 TYR A 423 79.713 92.174 58.415 1.00 2.86 A C +ATOM 2657 CE1 TYR A 423 80.815 92.118 55.865 1.00 5.30 A C +ATOM 2658 CE2 TYR A 423 81.085 92.172 58.257 1.00 3.06 A C +ATOM 2659 CZ TYR A 423 81.605 92.143 56.992 1.00 6.02 A C +ATOM 2660 OH TYR A 423 82.970 92.150 56.854 1.00 10.03 A O +ATOM 2661 N VAL A 424 76.809 94.249 59.881 1.00 7.49 A N +ATOM 2662 CA VAL A 424 77.504 94.893 60.998 1.00 10.51 A C +ATOM 2663 C VAL A 424 77.374 93.798 62.039 1.00 11.67 A C +ATOM 2664 O VAL A 424 76.364 93.129 62.158 1.00 13.75 A O +ATOM 2665 CB VAL A 424 76.887 96.329 61.404 1.00 11.28 A C +ATOM 2666 CG1 VAL A 424 75.500 96.536 60.880 1.00 12.38 A C +ATOM 2667 CG2 VAL A 424 76.925 96.476 62.893 1.00 12.36 A C +ATOM 2668 N GLU A 425 78.543 93.441 62.540 1.00 13.62 A N +ATOM 2669 CA GLU A 425 78.777 92.411 63.510 1.00 14.72 A C +ATOM 2670 C GLU A 425 78.377 92.935 64.855 1.00 15.86 A C +ATOM 2671 O GLU A 425 78.908 93.986 65.190 1.00 16.97 A O +ATOM 2672 CB GLU A 425 80.272 92.086 63.459 1.00 16.14 A C +ATOM 2673 CG GLU A 425 80.829 91.419 64.724 1.00 15.75 A C +ATOM 2674 CD GLU A 425 82.325 91.149 64.807 1.00 17.45 A C +ATOM 2675 OE1 GLU A 425 83.137 92.046 64.612 1.00 19.34 A O +ATOM 2676 OE2 GLU A 425 82.710 90.043 65.153 1.00 18.96 A O1- +ATOM 2677 N LEU A 426 77.560 92.311 65.685 1.00 16.52 A N +ATOM 2678 CA LEU A 426 77.232 92.903 66.984 1.00 17.50 A C +ATOM 2679 C LEU A 426 77.997 92.058 67.960 1.00 18.36 A C +ATOM 2680 O LEU A 426 77.573 90.902 68.120 1.00 18.65 A O +ATOM 2681 CB LEU A 426 75.755 92.774 67.207 1.00 18.29 A C +ATOM 2682 CG LEU A 426 74.926 93.071 65.974 1.00 18.49 A C +ATOM 2683 CD1 LEU A 426 73.545 92.505 66.209 1.00 18.97 A C +ATOM 2684 CD2 LEU A 426 74.940 94.557 65.658 1.00 18.05 A C +ATOM 2685 N ILE A 427 79.095 92.471 68.599 1.00 19.13 A N +ATOM 2686 CA ILE A 427 79.712 91.486 69.460 1.00 19.69 A C +ATOM 2687 C ILE A 427 79.141 91.559 70.868 1.00 20.19 A C +ATOM 2688 O ILE A 427 78.622 92.587 71.284 1.00 21.28 A O +ATOM 2689 CB ILE A 427 81.350 91.583 69.430 1.00 18.61 A C +ATOM 2690 CG1 ILE A 427 81.823 92.115 70.723 1.00 19.69 A C +ATOM 2691 CG2 ILE A 427 81.958 92.470 68.360 1.00 15.94 A C +ATOM 2692 CD1 ILE A 427 82.497 91.009 71.552 1.00 22.06 A C +ATOM 2693 N ARG A 428 79.208 90.459 71.617 1.00 21.14 A N +ATOM 2694 CA ARG A 428 78.737 90.337 72.987 1.00 21.02 A C +ATOM 2695 C ARG A 428 79.774 89.559 73.734 1.00 21.36 A C +ATOM 2696 O ARG A 428 80.514 88.759 73.143 1.00 20.65 A O +ATOM 2697 CB ARG A 428 77.468 89.504 73.178 1.00 21.45 A C +ATOM 2698 CG ARG A 428 76.228 90.118 72.611 1.00 20.26 A C +ATOM 2699 CD ARG A 428 76.067 91.487 73.241 1.00 19.97 A C +ATOM 2700 NE ARG A 428 74.654 91.635 73.331 1.00 20.95 A N +ATOM 2701 CZ ARG A 428 74.022 91.643 74.474 1.00 20.90 A C +ATOM 2702 NH1 ARG A 428 74.600 91.637 75.668 1.00 20.36 A N1+ +ATOM 2703 NH2 ARG A 428 72.744 91.744 74.375 1.00 21.66 A N +ATOM 2704 N GLY A 429 79.738 89.747 75.041 1.00 22.10 A N +ATOM 2705 CA GLY A 429 80.654 89.033 75.890 1.00 25.41 A C +ATOM 2706 C GLY A 429 81.839 89.852 76.355 1.00 27.79 A C +ATOM 2707 O GLY A 429 81.817 91.091 76.362 1.00 28.23 A O +ATOM 2708 N ARG A 430 82.858 89.123 76.798 1.00 29.32 A N +ATOM 2709 CA ARG A 430 84.051 89.741 77.294 1.00 30.75 A C +ATOM 2710 C ARG A 430 84.804 90.426 76.170 1.00 31.78 A C +ATOM 2711 O ARG A 430 84.663 90.101 74.998 1.00 32.78 A O +ATOM 2712 CB ARG A 430 84.894 88.677 77.983 1.00 31.16 A C +ATOM 2713 CG ARG A 430 84.223 88.382 79.298 1.00 31.97 A C +ATOM 2714 CD ARG A 430 85.186 88.010 80.403 1.00 32.30 A C +ATOM 2715 NE ARG A 430 84.428 87.878 81.638 1.00 34.03 A N +ATOM 2716 CZ ARG A 430 84.999 87.671 82.830 1.00 35.15 A C +ATOM 2717 NH1 ARG A 430 86.312 87.607 82.970 1.00 36.85 A N1+ +ATOM 2718 NH2 ARG A 430 84.274 87.544 83.933 1.00 35.72 A N +ATOM 2719 N LYS A 431 85.613 91.456 76.360 1.00 33.86 A N +ATOM 2720 CA LYS A 431 85.881 92.042 77.657 1.00 34.76 A C +ATOM 2721 C LYS A 431 84.876 93.035 78.197 1.00 34.94 A C +ATOM 2722 O LYS A 431 84.743 93.101 79.421 1.00 34.58 A O +ATOM 2723 CB LYS A 431 87.247 92.687 77.598 1.00 35.96 A C +ATOM 2724 CG LYS A 431 88.269 91.599 77.738 1.00 37.44 A C +ATOM 2725 CD LYS A 431 89.644 92.052 77.313 1.00 39.68 A C +ATOM 2726 CE LYS A 431 90.557 90.935 77.802 1.00 41.27 A C +ATOM 2727 NZ LYS A 431 91.890 91.024 77.223 1.00 43.64 A N1+ +ATOM 2728 N GLN A 432 84.127 93.716 77.317 1.00 34.64 A N +ATOM 2729 CA GLN A 432 83.169 94.710 77.765 1.00 34.82 A C +ATOM 2730 C GLN A 432 82.113 94.175 78.716 1.00 34.81 A C +ATOM 2731 O GLN A 432 81.852 94.853 79.701 1.00 35.52 A O +ATOM 2732 CB GLN A 432 82.488 95.355 76.559 1.00 36.23 A C +ATOM 2733 CG GLN A 432 81.722 96.626 76.925 1.00 38.63 A C +ATOM 2734 CD GLN A 432 81.257 97.540 75.781 1.00 41.01 A C +ATOM 2735 OE1 GLN A 432 81.843 97.630 74.691 1.00 42.94 A O +ATOM 2736 NE2 GLN A 432 80.166 98.284 75.964 1.00 41.34 A N +ATOM 2737 N GLU A 433 81.489 93.015 78.514 1.00 33.78 A N +ATOM 2738 CA GLU A 433 80.476 92.525 79.427 1.00 32.54 A C +ATOM 2739 C GLU A 433 81.101 91.358 80.150 1.00 32.60 A C +ATOM 2740 O GLU A 433 81.472 90.341 79.583 1.00 32.61 A O +ATOM 2741 CB GLU A 433 79.282 92.071 78.664 1.00 32.30 A C +ATOM 2742 CG GLU A 433 78.809 93.139 77.720 1.00 32.38 A C +ATOM 2743 CD GLU A 433 77.546 92.757 76.996 1.00 31.92 A C +ATOM 2744 OE1 GLU A 433 76.471 92.932 77.558 1.00 31.98 A O +ATOM 2745 OE2 GLU A 433 77.649 92.293 75.871 1.00 32.59 A O1- +ATOM 2746 N THR A 434 81.203 91.546 81.434 1.00 33.16 A N +ATOM 2747 CA THR A 434 81.788 90.671 82.420 1.00 33.43 A C +ATOM 2748 C THR A 434 80.964 89.567 83.044 1.00 33.01 A C +ATOM 2749 O THR A 434 81.522 88.756 83.785 1.00 33.23 A O +ATOM 2750 CB THR A 434 82.325 91.688 83.441 1.00 34.29 A C +ATOM 2751 OG1 THR A 434 83.251 92.459 82.683 1.00 36.19 A O +ATOM 2752 CG2 THR A 434 83.029 91.150 84.647 1.00 35.48 A C +ATOM 2753 N ARG A 435 79.657 89.464 82.833 1.00 31.99 A N +ATOM 2754 CA ARG A 435 78.910 88.401 83.498 1.00 30.91 A C +ATOM 2755 C ARG A 435 79.223 86.994 82.988 1.00 30.52 A C +ATOM 2756 O ARG A 435 79.108 85.989 83.695 1.00 29.72 A O +ATOM 2757 CB ARG A 435 77.404 88.631 83.350 1.00 30.83 A C +ATOM 2758 CG ARG A 435 76.705 87.942 84.514 1.00 32.12 A C +ATOM 2759 CD ARG A 435 75.203 87.987 84.480 1.00 32.67 A C +ATOM 2760 NE ARG A 435 74.779 87.076 83.451 1.00 33.70 A N +ATOM 2761 CZ ARG A 435 74.333 85.861 83.721 1.00 32.99 A C +ATOM 2762 NH1 ARG A 435 74.195 85.393 84.951 1.00 32.83 A N1+ +ATOM 2763 NH2 ARG A 435 73.991 85.125 82.698 1.00 33.37 A N +ATOM 2764 N VAL A 436 79.606 86.947 81.717 1.00 28.90 A N +ATOM 2765 CA VAL A 436 79.889 85.704 81.057 1.00 27.15 A C +ATOM 2766 C VAL A 436 81.370 85.625 80.740 1.00 26.65 A C +ATOM 2767 O VAL A 436 82.030 86.660 80.745 1.00 26.28 A O +ATOM 2768 CB VAL A 436 79.019 85.658 79.801 1.00 26.94 A C +ATOM 2769 CG1 VAL A 436 77.567 85.791 80.222 1.00 26.62 A C +ATOM 2770 CG2 VAL A 436 79.415 86.745 78.824 1.00 27.00 A C +ATOM 2771 N TRP A 437 81.914 84.448 80.434 1.00 25.24 A N +ATOM 2772 CA TRP A 437 83.307 84.302 80.118 1.00 23.12 A C +ATOM 2773 C TRP A 437 83.591 84.125 78.667 1.00 22.82 A C +ATOM 2774 O TRP A 437 84.765 83.987 78.318 1.00 23.48 A O +ATOM 2775 CB TRP A 437 83.868 83.147 80.822 1.00 23.48 A C +ATOM 2776 CG TRP A 437 83.863 83.411 82.304 1.00 24.48 A C +ATOM 2777 CD1 TRP A 437 82.749 83.131 83.037 1.00 25.21 A C +ATOM 2778 CD2 TRP A 437 84.900 83.892 83.050 1.00 25.18 A C +ATOM 2779 NE1 TRP A 437 83.085 83.425 84.258 1.00 25.96 A N +ATOM 2780 CE2 TRP A 437 84.346 83.873 84.312 1.00 25.93 A C +ATOM 2781 CE3 TRP A 437 86.194 84.325 82.876 1.00 26.16 A C +ATOM 2782 CZ2 TRP A 437 85.061 84.284 85.417 1.00 26.04 A C +ATOM 2783 CZ3 TRP A 437 86.917 84.733 83.980 1.00 26.00 A C +ATOM 2784 CH2 TRP A 437 86.355 84.717 85.235 1.00 25.81 A C +ATOM 2785 N TRP A 438 82.591 84.147 77.795 1.00 21.14 A N +ATOM 2786 CA TRP A 438 82.768 83.973 76.358 1.00 19.49 A C +ATOM 2787 C TRP A 438 82.716 85.286 75.609 1.00 19.21 A C +ATOM 2788 O TRP A 438 82.361 86.311 76.182 1.00 19.30 A O +ATOM 2789 CB TRP A 438 81.670 83.050 75.802 1.00 19.29 A C +ATOM 2790 CG TRP A 438 80.253 83.436 76.209 1.00 19.68 A C +ATOM 2791 CD1 TRP A 438 79.699 82.844 77.315 1.00 19.96 A C +ATOM 2792 CD2 TRP A 438 79.406 84.357 75.626 1.00 19.13 A C +ATOM 2793 NE1 TRP A 438 78.512 83.389 77.441 1.00 20.28 A N +ATOM 2794 CE2 TRP A 438 78.309 84.291 76.471 1.00 19.13 A C +ATOM 2795 CE3 TRP A 438 79.385 85.229 74.557 1.00 18.90 A C +ATOM 2796 CZ2 TRP A 438 77.190 85.059 76.292 1.00 19.09 A C +ATOM 2797 CZ3 TRP A 438 78.261 86.012 74.369 1.00 19.42 A C +ATOM 2798 CH2 TRP A 438 77.174 85.927 75.222 1.00 19.72 A C +ATOM 2799 N THR A 439 83.007 85.272 74.324 1.00 19.32 A N +ATOM 2800 CA THR A 439 82.954 86.445 73.494 1.00 19.74 A C +ATOM 2801 C THR A 439 82.332 85.885 72.225 1.00 20.95 A C +ATOM 2802 O THR A 439 82.773 84.823 71.773 1.00 21.93 A O +ATOM 2803 CB THR A 439 84.369 86.925 73.257 1.00 20.04 A C +ATOM 2804 OG1 THR A 439 84.951 87.188 74.541 1.00 22.35 A O +ATOM 2805 CG2 THR A 439 84.401 88.108 72.348 1.00 19.45 A C +ATOM 2806 N SER A 440 81.278 86.459 71.658 1.00 21.53 A N +ATOM 2807 CA SER A 440 80.674 85.955 70.434 1.00 20.05 A C +ATOM 2808 C SER A 440 80.031 87.152 69.739 1.00 19.49 A C +ATOM 2809 O SER A 440 80.104 88.270 70.241 1.00 19.77 A O +ATOM 2810 CB SER A 440 79.604 84.931 70.753 1.00 20.79 A C +ATOM 2811 OG SER A 440 79.351 84.065 69.642 1.00 22.26 A O +ATOM 2812 N ASN A 441 79.454 87.020 68.568 1.00 18.50 A N +ATOM 2813 CA ASN A 441 78.797 88.090 67.879 1.00 18.17 A C +ATOM 2814 C ASN A 441 77.514 87.531 67.276 1.00 19.85 A C +ATOM 2815 O ASN A 441 77.151 86.346 67.458 1.00 21.77 A O +ATOM 2816 CB ASN A 441 79.633 88.611 66.743 1.00 16.18 A C +ATOM 2817 CG ASN A 441 79.703 87.661 65.583 1.00 16.46 A C +ATOM 2818 OD1 ASN A 441 80.256 86.589 65.727 1.00 18.15 A O +ATOM 2819 ND2 ASN A 441 79.184 87.929 64.401 1.00 14.36 A N +ATOM 2820 N SER A 442 76.740 88.422 66.650 1.00 19.31 A N +ATOM 2821 CA SER A 442 75.554 88.008 65.931 1.00 17.73 A C +ATOM 2822 C SER A 442 75.534 88.965 64.734 1.00 16.83 A C +ATOM 2823 O SER A 442 76.477 89.765 64.587 1.00 18.10 A O +ATOM 2824 CB SER A 442 74.305 88.105 66.807 1.00 17.60 A C +ATOM 2825 OG SER A 442 73.672 89.330 67.066 1.00 17.42 A O +ATOM 2826 N ILE A 443 74.668 88.920 63.733 1.00 13.95 A N +ATOM 2827 CA ILE A 443 74.820 89.900 62.694 1.00 12.55 A C +ATOM 2828 C ILE A 443 73.440 90.471 62.348 1.00 13.56 A C +ATOM 2829 O ILE A 443 72.395 89.877 62.700 1.00 11.40 A O +ATOM 2830 CB ILE A 443 75.468 89.278 61.407 1.00 12.10 A C +ATOM 2831 CG1 ILE A 443 74.609 88.319 60.677 1.00 10.43 A C +ATOM 2832 CG2 ILE A 443 76.680 88.487 61.811 1.00 11.73 A C +ATOM 2833 CD1 ILE A 443 75.269 88.292 59.292 1.00 10.19 A C +ATOM 2834 N VAL A 444 73.498 91.637 61.683 1.00 11.93 A N +ATOM 2835 CA VAL A 444 72.350 92.343 61.176 1.00 9.61 A C +ATOM 2836 C VAL A 444 72.923 92.837 59.832 1.00 8.06 A C +ATOM 2837 O VAL A 444 74.114 93.166 59.779 1.00 7.18 A O +ATOM 2838 CB VAL A 444 71.933 93.467 62.199 1.00 9.79 A C +ATOM 2839 CG1 VAL A 444 72.889 94.637 62.304 1.00 11.59 A C +ATOM 2840 CG2 VAL A 444 70.607 93.984 61.753 1.00 7.12 A C +ATOM 2841 N VAL A 445 72.196 92.829 58.726 1.00 8.70 A N +ATOM 2842 CA VAL A 445 72.682 93.264 57.408 1.00 9.45 A C +ATOM 2843 C VAL A 445 71.570 93.983 56.669 1.00 10.94 A C +ATOM 2844 O VAL A 445 70.367 93.666 56.777 1.00 13.91 A O +ATOM 2845 CB VAL A 445 73.263 92.024 56.579 1.00 10.23 A C +ATOM 2846 CG1 VAL A 445 72.655 90.756 56.994 1.00 9.12 A C +ATOM 2847 CG2 VAL A 445 73.017 92.162 55.076 1.00 7.86 A C +ATOM 2848 N PHE A 446 71.994 95.078 56.050 1.00 11.60 A N +ATOM 2849 CA PHE A 446 71.171 96.010 55.295 1.00 11.82 A C +ATOM 2850 C PHE A 446 71.654 96.098 53.856 1.00 13.30 A C +ATOM 2851 O PHE A 446 72.855 95.866 53.642 1.00 14.57 A O +ATOM 2852 CB PHE A 446 71.274 97.380 55.916 1.00 11.56 A C +ATOM 2853 CG PHE A 446 70.385 97.521 57.145 1.00 11.93 A C +ATOM 2854 CD1 PHE A 446 70.574 96.709 58.236 1.00 12.46 A C +ATOM 2855 CD2 PHE A 446 69.397 98.483 57.134 1.00 10.51 A C +ATOM 2856 CE1 PHE A 446 69.755 96.865 59.328 1.00 12.35 A C +ATOM 2857 CE2 PHE A 446 68.583 98.640 58.223 1.00 11.23 A C +ATOM 2858 CZ PHE A 446 68.766 97.834 59.321 1.00 12.09 A C +ATOM 2859 N CYS A 447 70.800 96.388 52.863 1.00 15.02 A N +ATOM 2860 CA CYS A 447 71.259 96.529 51.490 1.00 15.93 A C +ATOM 2861 C CYS A 447 70.864 97.882 50.940 1.00 17.94 A C +ATOM 2862 O CYS A 447 69.913 98.486 51.444 1.00 19.22 A O +ATOM 2863 CB CYS A 447 70.677 95.544 50.524 1.00 16.02 A C +ATOM 2864 SG CYS A 447 71.640 94.024 50.411 1.00 15.64 A S +ATOM 2865 N GLY A 448 71.582 98.456 49.971 1.00 20.01 A N +ATOM 2866 CA GLY A 448 71.212 99.740 49.409 1.00 21.22 A C +ATOM 2867 C GLY A 448 69.818 99.671 48.803 1.00 21.24 A C +ATOM 2868 O GLY A 448 69.319 98.589 48.487 1.00 20.75 A O +ATOM 2869 N THR A 449 69.148 100.806 48.665 1.00 21.69 A N +ATOM 2870 CA THR A 449 67.816 100.835 48.087 1.00 23.33 A C +ATOM 2871 C THR A 449 67.648 102.189 47.421 1.00 24.79 A C +ATOM 2872 O THR A 449 68.273 103.161 47.862 1.00 26.54 A O +ATOM 2873 CB THR A 449 66.733 100.645 49.171 1.00 22.30 A C +ATOM 2874 OG1 THR A 449 65.516 100.924 48.503 1.00 22.49 A O +ATOM 2875 CG2 THR A 449 66.795 101.574 50.350 1.00 22.95 A C +ATOM 2876 N SER A 450 66.896 102.259 46.327 1.00 24.12 A N +ATOM 2877 CA SER A 450 66.635 103.511 45.655 1.00 24.25 A C +ATOM 2878 C SER A 450 65.209 103.955 45.995 1.00 24.34 A C +ATOM 2879 O SER A 450 64.724 104.988 45.531 1.00 26.13 A O +ATOM 2880 CB SER A 450 66.786 103.303 44.193 1.00 24.56 A C +ATOM 2881 OG SER A 450 66.148 102.070 43.875 1.00 28.32 A O +ATOM 2882 N GLY A 451 64.517 103.174 46.831 1.00 22.74 A N +ATOM 2883 CA GLY A 451 63.179 103.476 47.246 1.00 19.46 A C +ATOM 2884 C GLY A 451 63.215 104.326 48.486 1.00 17.58 A C +ATOM 2885 O GLY A 451 64.219 104.982 48.749 1.00 18.71 A O +ATOM 2886 N THR A 452 62.241 104.107 49.349 1.00 15.37 A N +ATOM 2887 CA THR A 452 62.050 104.878 50.565 1.00 16.64 A C +ATOM 2888 C THR A 452 62.196 104.048 51.810 1.00 13.84 A C +ATOM 2889 O THR A 452 62.138 102.836 51.723 1.00 16.46 A O +ATOM 2890 CB THR A 452 60.642 105.501 50.432 1.00 18.62 A C +ATOM 2891 OG1 THR A 452 60.702 106.235 49.221 1.00 20.94 A O +ATOM 2892 CG2 THR A 452 60.224 106.441 51.527 1.00 20.41 A C +ATOM 2893 N TYR A 453 62.292 104.605 53.002 1.00 11.95 A N +ATOM 2894 CA TYR A 453 62.473 103.789 54.164 1.00 9.87 A C +ATOM 2895 C TYR A 453 62.141 104.634 55.378 1.00 10.07 A C +ATOM 2896 O TYR A 453 61.943 105.842 55.228 1.00 9.74 A O +ATOM 2897 CB TYR A 453 63.926 103.302 54.137 1.00 12.34 A C +ATOM 2898 CG TYR A 453 64.967 104.388 53.967 1.00 12.78 A C +ATOM 2899 CD1 TYR A 453 65.410 105.045 55.107 1.00 13.87 A C +ATOM 2900 CD2 TYR A 453 65.468 104.711 52.705 1.00 12.94 A C +ATOM 2901 CE1 TYR A 453 66.356 106.036 54.972 1.00 13.61 A C +ATOM 2902 CE2 TYR A 453 66.425 105.696 52.588 1.00 12.60 A C +ATOM 2903 CZ TYR A 453 66.860 106.358 53.725 1.00 13.02 A C +ATOM 2904 OH TYR A 453 67.822 107.393 53.638 1.00 15.06 A O +ATOM 2905 N GLY A 454 62.160 104.074 56.570 1.00 9.82 A N +ATOM 2906 CA GLY A 454 61.792 104.812 57.732 1.00 8.17 A C +ATOM 2907 C GLY A 454 62.920 104.742 58.708 1.00 11.13 A C +ATOM 2908 O GLY A 454 64.090 104.802 58.319 1.00 10.48 A O +ATOM 2909 N THR A 455 62.630 104.533 59.969 1.00 11.75 A N +ATOM 2910 CA THR A 455 63.655 104.502 60.976 1.00 14.15 A C +ATOM 2911 C THR A 455 63.556 103.245 61.857 1.00 16.96 A C +ATOM 2912 O THR A 455 62.535 102.517 61.857 1.00 18.07 A O +ATOM 2913 CB THR A 455 63.380 105.908 61.596 1.00 17.13 A C +ATOM 2914 OG1 THR A 455 64.105 106.862 60.767 1.00 17.25 A O +ATOM 2915 CG2 THR A 455 63.756 106.032 63.042 1.00 16.56 A C +ATOM 2916 N GLY A 456 64.588 102.925 62.628 1.00 15.84 A N +ATOM 2917 CA GLY A 456 64.558 101.796 63.526 1.00 15.95 A C +ATOM 2918 C GLY A 456 65.937 101.684 64.162 1.00 18.06 A C +ATOM 2919 O GLY A 456 66.773 102.558 63.949 1.00 18.51 A O +ATOM 2920 N SER A 457 66.170 100.631 64.942 1.00 18.08 A N +ATOM 2921 CA SER A 457 67.426 100.323 65.591 1.00 18.80 A C +ATOM 2922 C SER A 457 67.287 98.829 65.677 1.00 18.66 A C +ATOM 2923 O SER A 457 66.306 98.335 66.247 1.00 19.99 A O +ATOM 2924 CB SER A 457 67.529 100.820 66.994 1.00 18.80 A C +ATOM 2925 OG SER A 457 68.667 100.239 67.610 1.00 18.83 A O +ATOM 2926 N TRP A 458 68.241 98.072 65.186 1.00 18.61 A N +ATOM 2927 CA TRP A 458 68.152 96.620 65.231 1.00 17.71 A C +ATOM 2928 C TRP A 458 69.404 96.035 65.865 1.00 16.37 A C +ATOM 2929 O TRP A 458 70.344 95.619 65.193 1.00 13.99 A O +ATOM 2930 CB TRP A 458 67.984 96.093 63.804 1.00 18.94 A C +ATOM 2931 CG TRP A 458 66.751 96.577 63.033 1.00 19.61 A C +ATOM 2932 CD1 TRP A 458 65.691 95.742 62.868 1.00 19.51 A C +ATOM 2933 CD2 TRP A 458 66.608 97.757 62.343 1.00 19.72 A C +ATOM 2934 NE1 TRP A 458 64.896 96.365 62.057 1.00 19.92 A N +ATOM 2935 CE2 TRP A 458 65.387 97.562 61.733 1.00 19.95 A C +ATOM 2936 CE3 TRP A 458 67.303 98.931 62.146 1.00 20.00 A C +ATOM 2937 CZ2 TRP A 458 64.828 98.505 60.903 1.00 19.65 A C +ATOM 2938 CZ3 TRP A 458 66.745 99.886 61.319 1.00 19.81 A C +ATOM 2939 CH2 TRP A 458 65.528 99.673 60.693 1.00 20.01 A C +ATOM 2940 N PRO A 459 69.478 96.016 67.174 1.00 15.18 A N +ATOM 2941 CA PRO A 459 70.601 95.481 67.922 1.00 15.68 A C +ATOM 2942 C PRO A 459 70.638 93.972 68.105 1.00 17.34 A C +ATOM 2943 O PRO A 459 69.677 93.270 67.775 1.00 20.09 A O +ATOM 2944 CB PRO A 459 70.504 96.216 69.243 1.00 14.92 A C +ATOM 2945 CG PRO A 459 69.040 96.250 69.471 1.00 13.87 A C +ATOM 2946 CD PRO A 459 68.508 96.638 68.084 1.00 15.50 A C +ATOM 2947 N ASP A 460 71.660 93.457 68.785 1.00 17.89 A N +ATOM 2948 CA ASP A 460 71.776 92.038 69.050 1.00 19.38 A C +ATOM 2949 C ASP A 460 70.511 91.520 69.734 1.00 19.75 A C +ATOM 2950 O ASP A 460 69.877 90.593 69.220 1.00 20.58 A O +ATOM 2951 CB ASP A 460 73.007 91.778 69.926 1.00 18.70 A C +ATOM 2952 CG ASP A 460 73.069 90.352 70.437 1.00 20.18 A C +ATOM 2953 OD1 ASP A 460 73.231 89.439 69.640 1.00 19.93 A O +ATOM 2954 OD2 ASP A 460 72.912 90.160 71.646 1.00 20.48 A O1- +ATOM 2955 N GLY A 461 70.154 92.018 70.910 1.00 19.64 A N +ATOM 2956 CA GLY A 461 68.934 91.568 71.547 1.00 19.30 A C +ATOM 2957 C GLY A 461 69.086 90.664 72.750 1.00 19.97 A C +ATOM 2958 O GLY A 461 68.168 90.609 73.578 1.00 20.93 A O +ATOM 2959 N ALA A 462 70.192 89.951 72.913 1.00 18.61 A N +ATOM 2960 CA ALA A 462 70.305 89.059 74.049 1.00 19.37 A C +ATOM 2961 C ALA A 462 70.295 89.735 75.379 1.00 20.07 A C +ATOM 2962 O ALA A 462 70.779 90.834 75.473 1.00 20.89 A O +ATOM 2963 CB ALA A 462 71.572 88.258 73.980 1.00 18.69 A C +ATOM 2964 N ASN A 463 69.656 89.238 76.422 1.00 22.31 A N +ATOM 2965 CA ASN A 463 69.713 89.904 77.719 1.00 24.03 A C +ATOM 2966 C ASN A 463 70.816 89.132 78.359 1.00 25.69 A C +ATOM 2967 O ASN A 463 70.647 87.940 78.624 1.00 26.41 A O +ATOM 2968 CB ASN A 463 68.431 89.723 78.507 1.00 25.14 A C +ATOM 2969 CG ASN A 463 68.460 90.265 79.923 1.00 25.99 A C +ATOM 2970 OD1 ASN A 463 69.455 90.222 80.640 1.00 27.33 A O +ATOM 2971 ND2 ASN A 463 67.347 90.743 80.431 1.00 27.35 A N +ATOM 2972 N ILE A 464 71.935 89.790 78.610 1.00 28.25 A N +ATOM 2973 CA ILE A 464 73.114 89.176 79.205 1.00 28.76 A C +ATOM 2974 C ILE A 464 72.835 88.414 80.493 1.00 30.41 A C +ATOM 2975 O ILE A 464 73.551 87.453 80.802 1.00 31.32 A O +ATOM 2976 CB ILE A 464 74.146 90.364 79.327 1.00 28.47 A C +ATOM 2977 CG1 ILE A 464 75.381 89.970 78.509 1.00 27.84 A C +ATOM 2978 CG2 ILE A 464 74.466 90.739 80.752 1.00 28.37 A C +ATOM 2979 CD1 ILE A 464 76.283 88.856 79.000 1.00 27.80 A C +ATOM 2980 N ASN A 465 71.777 88.763 81.225 1.00 30.88 A N +ATOM 2981 CA ASN A 465 71.474 88.066 82.458 1.00 31.94 A C +ATOM 2982 C ASN A 465 70.801 86.719 82.277 1.00 32.27 A C +ATOM 2983 O ASN A 465 70.577 85.986 83.246 1.00 32.96 A O +ATOM 2984 CB ASN A 465 70.587 88.897 83.320 1.00 33.53 A C +ATOM 2985 CG ASN A 465 71.316 90.093 83.875 1.00 35.18 A C +ATOM 2986 OD1 ASN A 465 70.953 91.217 83.549 1.00 36.95 A O +ATOM 2987 ND2 ASN A 465 72.347 89.958 84.702 1.00 35.43 A N +ATOM 2988 N PHE A 466 70.418 86.394 81.049 1.00 30.72 A N +ATOM 2989 CA PHE A 466 69.782 85.131 80.759 1.00 29.49 A C +ATOM 2990 C PHE A 466 70.737 84.129 80.169 1.00 29.53 A C +ATOM 2991 O PHE A 466 70.410 82.949 80.057 1.00 30.38 A O +ATOM 2992 CB PHE A 466 68.693 85.291 79.744 1.00 29.38 A C +ATOM 2993 CG PHE A 466 67.527 86.136 80.183 1.00 29.13 A C +ATOM 2994 CD1 PHE A 466 67.340 86.478 81.511 1.00 28.54 A C +ATOM 2995 CD2 PHE A 466 66.647 86.535 79.210 1.00 29.06 A C +ATOM 2996 CE1 PHE A 466 66.276 87.251 81.878 1.00 28.25 A C +ATOM 2997 CE2 PHE A 466 65.577 87.311 79.581 1.00 29.08 A C +ATOM 2998 CZ PHE A 466 65.389 87.656 80.907 1.00 29.58 A C +ATOM 2999 N MET A 467 71.889 84.615 79.710 1.00 28.70 A N +ATOM 3000 CA MET A 467 72.891 83.798 79.053 1.00 26.78 A C +ATOM 3001 C MET A 467 73.532 82.780 79.931 1.00 26.93 A C +ATOM 3002 O MET A 467 73.768 83.055 81.095 1.00 27.41 A O +ATOM 3003 CB MET A 467 73.951 84.675 78.505 1.00 25.43 A C +ATOM 3004 CG MET A 467 73.411 85.653 77.497 1.00 24.55 A C +ATOM 3005 SD MET A 467 72.504 84.824 76.190 1.00 24.21 A S +ATOM 3006 CE MET A 467 73.803 84.022 75.317 1.00 23.05 A C +ATOM 3007 N PRO A 468 73.828 81.582 79.465 1.00 27.55 A N +ATOM 3008 CA PRO A 468 74.835 80.752 80.083 1.00 28.45 A C +ATOM 3009 C PRO A 468 76.136 81.561 80.204 1.00 30.11 A C +ATOM 3010 O PRO A 468 76.436 82.386 79.319 1.00 31.04 A O +ATOM 3011 CB PRO A 468 74.863 79.564 79.158 1.00 28.04 A C +ATOM 3012 CG PRO A 468 74.312 80.034 77.842 1.00 27.52 A C +ATOM 3013 CD PRO A 468 73.219 80.952 78.306 1.00 27.88 A C +ATOM 3014 N ILE A 469 76.873 81.393 81.303 1.00 30.36 A N +ATOM 3015 CA ILE A 469 78.104 82.144 81.477 1.00 31.35 A C +ATOM 3016 C ILE A 469 79.320 81.418 80.923 1.00 32.25 A C +ATOM 3017 O ILE A 469 79.262 80.208 80.763 1.00 34.23 A O +ATOM 3018 CB ILE A 469 78.365 82.463 82.955 1.00 30.28 A C +ATOM 3019 CG1 ILE A 469 78.405 81.234 83.806 1.00 30.06 A C +ATOM 3020 CG2 ILE A 469 77.291 83.423 83.387 1.00 29.81 A C +ATOM 3021 CD1 ILE A 469 79.160 81.569 85.086 1.00 30.84 A C +ATOM 3022 OXT ILE A 469 80.310 82.065 80.626 1.00 32.42 A O1- +END diff --git a/examples/thirdparty/openmm/data/oseltamivir_zwitterion.pdb b/examples/thirdparty/openmm/data/oseltamivir_zwitterion.pdb new file mode 100644 index 000000000..18ab2a8b1 --- /dev/null +++ b/examples/thirdparty/openmm/data/oseltamivir_zwitterion.pdb @@ -0,0 +1,101 @@ +REMARK 200 Generated with PyMOL and psico +HETATM 1 C1 G39 B 500 -30.374 -53.143 6.122 1.00 31.18 B C +HETATM 2 O1A G39 B 500 -31.439 -52.533 5.850 1.00 30.30 B O +HETATM 3 O1B G39 B 500 -29.257 -52.625 5.879 1.00 31.23 B O +HETATM 4 C2 G39 B 500 -30.437 -54.486 6.725 1.00 30.48 B C +HETATM 5 C3 G39 B 500 -29.159 -55.188 7.132 1.00 30.04 B C +HETATM 6 C4 G39 B 500 -29.380 -56.162 8.294 1.00 30.37 B C +HETATM 7 N4 G39 B 500 -28.195 -56.994 8.430 1.00 30.09 B N1+ +HETATM 8 C5 G39 B 500 -30.627 -57.033 8.097 1.00 29.53 B C +HETATM 9 N5 G39 B 500 -30.803 -57.955 9.206 1.00 28.16 B N +HETATM 10 C6 G39 B 500 -31.883 -56.178 7.937 1.00 30.53 B C +HETATM 11 C7 G39 B 500 -31.632 -55.093 6.901 1.00 30.75 B C +HETATM 12 O7 G39 B 500 -33.007 -56.989 7.531 1.00 31.80 B O +HETATM 13 C8 G39 B 500 -34.158 -56.905 8.398 1.00 30.52 B C +HETATM 14 C9 G39 B 500 -34.879 -55.553 8.283 1.00 31.36 B C +HETATM 15 C10 G39 B 500 -30.683 -59.283 9.087 1.00 27.13 B C +HETATM 16 O10 G39 B 500 -30.629 -59.863 8.010 1.00 26.14 B O +HETATM 17 C11 G39 B 500 -30.611 -60.040 10.380 1.00 26.05 B C +HETATM 18 C81 G39 B 500 -35.153 -58.020 8.079 1.00 29.88 B C +HETATM 19 C82 G39 B 500 -34.654 -59.395 8.467 1.00 28.23 B C +HETATM 20 C91 G39 B 500 -35.425 -55.279 6.891 1.00 32.33 B C +HETATM 21 H01 G39 B 500 -27.912 -57.328 7.520 1.00 30.09 B H +HETATM 22 H02 G39 B 500 -35.696 -56.221 6.414 1.00 32.33 B H +HETATM 23 H03 G39 B 500 -28.427 -54.439 7.435 1.00 30.04 B H +HETATM 24 H04 G39 B 500 -29.547 -55.584 9.203 1.00 30.37 B H +HETATM 25 H05 G39 B 500 -28.402 -57.780 9.029 1.00 30.09 B H +HETATM 26 H06 G39 B 500 -30.476 -57.606 7.182 1.00 29.53 B H +HETATM 27 H07 G39 B 500 -31.028 -57.574 10.114 1.00 28.16 B H +HETATM 28 H08 G39 B 500 -32.117 -55.721 8.898 1.00 30.53 B H +HETATM 29 H09 G39 B 500 -32.463 -54.788 6.265 1.00 30.75 B H +HETATM 30 H10 G39 B 500 -33.786 -57.011 9.417 1.00 30.52 B H +HETATM 31 H11 G39 B 500 -34.175 -54.762 8.541 1.00 31.36 B H +HETATM 32 H12 G39 B 500 -29.917 -60.874 10.275 1.00 26.05 B H +HETATM 33 H13 G39 B 500 -35.351 -58.012 7.007 1.00 29.88 B H +HETATM 34 H14 G39 B 500 -34.494 -59.991 7.568 1.00 28.23 B H +HETATM 35 H15 G39 B 500 -34.665 -54.775 6.295 1.00 32.33 B H +HETATM 36 H16 G39 B 500 -28.805 -55.763 6.276 1.00 30.04 B H +HETATM 37 H17 G39 B 500 -27.447 -56.450 8.836 1.00 30.09 B H +HETATM 38 H18 G39 B 500 -35.730 -55.583 8.963 1.00 31.36 B H +HETATM 39 H19 G39 B 500 -31.600 -60.420 10.635 1.00 26.05 B H +HETATM 40 H20 G39 B 500 -36.053 -57.826 8.662 1.00 29.88 B H +HETATM 41 H21 G39 B 500 -35.393 -59.885 9.101 1.00 28.23 B H +HETATM 42 H22 G39 B 500 -36.307 -54.643 6.966 1.00 32.33 B H +HETATM 43 H23 G39 B 500 -30.263 -59.375 11.171 1.00 26.05 B H +HETATM 44 H24 G39 B 500 -33.714 -59.300 9.011 1.00 28.23 B H +CONECT 1 2 +CONECT 1 2 +CONECT 1 3 4 +CONECT 2 1 +CONECT 2 1 +CONECT 3 1 +CONECT 4 1 5 +CONECT 4 11 +CONECT 4 11 +CONECT 5 4 6 23 36 +CONECT 6 5 7 8 24 +CONECT 7 6 21 25 37 +CONECT 8 6 9 10 26 +CONECT 9 8 15 27 +CONECT 10 8 11 12 28 +CONECT 11 4 +CONECT 11 4 +CONECT 11 10 29 +CONECT 12 10 13 +CONECT 13 12 14 18 30 +CONECT 14 13 20 31 38 +CONECT 15 9 +CONECT 15 16 +CONECT 15 16 +CONECT 15 17 +CONECT 16 15 +CONECT 16 15 +CONECT 17 15 32 39 43 +CONECT 18 13 19 33 40 +CONECT 19 18 34 41 44 +CONECT 20 14 22 35 42 +CONECT 21 7 +CONECT 22 20 +CONECT 23 5 +CONECT 24 6 +CONECT 25 7 +CONECT 26 8 +CONECT 27 9 +CONECT 28 10 +CONECT 29 11 +CONECT 30 13 +CONECT 31 14 +CONECT 32 17 +CONECT 33 18 +CONECT 34 19 +CONECT 35 20 +CONECT 36 5 +CONECT 37 7 +CONECT 38 14 +CONECT 39 17 +CONECT 40 18 +CONECT 41 19 +CONECT 42 20 +CONECT 43 17 +CONECT 44 19 +END diff --git a/examples/thirdparty/openmm/openmm-ligand-test.cfg b/examples/thirdparty/openmm/openmm-ligand-test.cfg new file mode 100644 index 000000000..407a1fefe --- /dev/null +++ b/examples/thirdparty/openmm/openmm-ligand-test.cfg @@ -0,0 +1,45 @@ +# ==================================================================== +# protein-peptide OpenMM example + +# directory in which the scoring will be done +run_dir = "run1-omm-ligand-test" +ncores = 40 +# cns_exec = "path/to/bin/cns" # optional + +# molecules to be simulated. +# molecules to be docked +molecules = [ + "data/neuraminidase-2BAT.pdb", + "data/oseltamivir_zwitterion.pdb" + ] + +# ==================================================================== +# Parameters for each stage are defined below +# ==================================================================== +[topoaa] +autohis = true +ligand_param_fname = "data/ligand-prodrg.param" +ligand_top_fname = "data/ligand-prodrg.top" +delenph = false + +[rigidbody] +tolerance = 20 +ambig_fname = "data/ambig-active-rigidbody.tbl" +ligand_param_fname = "data/ligand-prodrg.param" +ligand_top_fname = "data/ligand-prodrg.top" +sampling = 20 +w_vdw = 1.0 + +[seletop] +select = 3 + +[openmm] +forcefield = 'amber14-all.xml' +explicit_solvent_model = 'amber14/tip3p.xml' +timestep_ps = 0.002 +constraints = 'HBonds' +equilibration_timesteps = 200 +simulation_timesteps = 1000 + +# ==================================================================== + diff --git a/src/haddock/libs/libprodigy.py b/src/haddock/libs/libprodigy.py new file mode 100644 index 000000000..41345a0fc --- /dev/null +++ b/src/haddock/libs/libprodigy.py @@ -0,0 +1,176 @@ +"""Set of functionalities to run prodigy.""" + +from abc import ABC, abstractmethod + +import numpy as np + +from haddock import log +from haddock.core.exceptions import ModuleError +from haddock.core.typing import FilePath, Optional, ParamDict, Union +from haddock.libs.libontology import PDBFile + + +# Define conversion constants +R_GAZ_CONST = 8.314 +CALS_TO_JOULES = 4.184 +KELVIN_TO_CELCIUS = 273.15 + + +class CheckInstall: + """Verify that installation of prodigy is ok.""" + + def __init__(self): + """Verify that installation of prodigy is ok. + + Raises + ------ + ModuleError + Raised when prodigy libraries could not be loaded. + """ + try: + self.import_prodigy_libs() + except ModuleNotFoundError: + raise ModuleError( + "Issue detected with the installation of Prodigy. " + "Consider installing it with: " + "pip install prodigy-prot prodigy-lig" + ) + + @staticmethod + def import_prodigy_libs() -> None: + """Run prodigy CLI with help.""" + import prodigy_prot.predict_IC # noqa : F401 + import prodigy_lig.prodigy_lig # noqa : F401 + return None + + +class ProdigyWorker(ABC): + """Prodigy Worker class.""" + + def __init__(self, model: FilePath, params: ParamDict) -> None: + # Use by both prodigy -prot and -lig + self.model = model + self.topKd = params["to_pkd"] + self.temperature = params["temperature"] + self.dist_cutoff = self.set_distance_cutoff(params["distance_cutoff"]) + self.chains = params["chains"] + # Only used by prodigy-prot + self.acc_cutoff = params["accessibility_cutoff"] + # Only used by prodigy-lig + self.lig_resname = params["ligand_resname"] + self.lig_chain = params["ligand_chain"] + # Output values + self.score: Optional[float] = None + self.error: Optional[Exception] = None + + def _run(self) -> None: + """Evaluate complex and compute score.""" + self.score = self.pkd_converter(self.evaluate_complex()) + + def run(self) -> None: + """Execute the _run method.""" + try: + self._run() + except ModuleError as error: + self.error = error + + def pkd_converter(self, deltaG: float) -> float: + """Decide if deltaG must be converted to pKd. + + Parameters + ---------- + deltaG : float + Input DeltaG value + + Returns + ------- + score : float + The converted DeltaG to pKd if self.topKd is true, + else the input DeltaG. + """ + if self.topKd: + score = self.deltaG_to_pKd( + deltaG, + kelvins=self.temperature + KELVIN_TO_CELCIUS, + ) + else: + score = deltaG + return round(score, 3) + + @staticmethod + def deltaG_to_pKd(deltaG: float, kelvins: float = 298.3) -> float: + """Convert a deltaG (in Kcal/mol) to pKd. + + Parameters + ---------- + deltaG : float + DeltaG value (in Kcal/mol) + kelvins : float, optional + Temperature at which to perform the conversion. + By default 298.3 (25 degrees Celcius) + + Returns + ------- + pKd : float + The corresponding pKd value at given temperature. + """ + # Convert Kcals to joules + deltaG_joules = deltaG * CALS_TO_JOULES * 1000 + # Use formula + Kd = np.exp(-deltaG_joules / (R_GAZ_CONST * kelvins)) + # Convert to pKd + _pKd = np.log10(Kd) + # Reduce number of decimals + pKd = round(_pKd, 2) + return -pKd + + @abstractmethod + def evaluate_complex(self) -> float: + """Logic to evaluate a complex using prodigy.""" + pass + + +class ModelScore: + """Simple class for holding score for a model.""" + + def __init__(self, model_index: int) -> None: + """Initiate models scores.""" + self.index = model_index + self.score = None + self.error = None + + +class ProdigyJob: + """Managing the computation of prodigy scores within haddock3.""" + + def __init__( + self, + model: PDBFile, + params: ParamDict, + index: int = 1, + ) -> None: + """Initiate a worker.""" + self.score = ModelScore(index) + worker = self.get_worker() + self.worker = worker(model.rel_path, params) + + def _run(self) -> ModelScore: + """Run the worker and retrieve output values.""" + try: + self.worker.run() + except Exception as e: + log.error(e) + else: + self.score.score = self.worker.score + self.score.error = self.worker.error + return self.score + + def run(self) -> ModelScore: + """Execute the _run method.""" + return self._run() + + @staticmethod + @abstractmethod + def get_worker() -> object: + """Return the appropriate worker.""" + pass diff --git a/src/haddock/modules/scoring/prodigy/prodigy.py b/src/haddock/modules/scoring/prodigy/prodigy.py deleted file mode 100644 index 373405a7d..000000000 --- a/src/haddock/modules/scoring/prodigy/prodigy.py +++ /dev/null @@ -1,317 +0,0 @@ -"""Set of functionalities to run prodigy.""" - -from abc import ABC, abstractmethod - -import numpy as np - -from haddock import log -from haddock.core.exceptions import ModuleError -from haddock.core.typing import FilePath, Optional, ParamDict, Union -from haddock.libs.libontology import PDBFile - - -# Define conversion constants -R_GAZ_CONST = 8.314 -CALS_TO_JOULES = 4.184 -KELVIN_TO_CELCIUS = 273.15 - - -class CheckInstall: - """Verify that installation of prodigy is ok.""" - - def __init__(self): - """Verify that installation of prodigy is ok. - - Raises - ------ - ModuleError - Raised when prodigy subprocess failed. - """ - try: - self.run_helps() - except ModuleNotFoundError: - raise ModuleError( - "Issue detected with the installation of Prodigy. " - "Consider installing it with: " - "pip install prodigy-prot prodigy-lig" - ) - - @staticmethod - def run_helps() -> None: - """Run prodigy CLI with help.""" - import prodigy_prot.predict_IC # noqa : F401 - #import prodigy_lig.prodigy_lig # noqa : F401 - return None - - -class ProdigyWorker(ABC): - """Superclass of Prodigy Worker.""" - - def __init__(self, model: FilePath, params: ParamDict) -> None: - # Use by both prodigy -prot and -lig - self.model = model - self.topKd = params["to_pkd"] - self.temperature = params["temperature"] - self.dist_cutoff = self.set_distance_cutoff(params["distance_cutoff"]) - self.chains = params["chains"] - # Only used by prodigy-prot - self.acc_cutoff = params["accessibility_cutoff"] - # Only used by prodigy-lig - self.lig_resname = params["ligand_resname"] - self.lig_chain = params["ligand_chain"] - # Output values - self.score: Optional[float] = None - self.error: Optional[Exception] = None - - def _run(self) -> None: - """Evaluate complex and compute score.""" - self.score = self.pkd_converter(self.evaluate_complex()) - - def run(self) -> None: - """Execute the _run method.""" - try: - self._run() - except ModuleError as error: - self.error = error - - def pkd_converter(self, deltaG: float) -> float: - """Decide if deltaG must be converted to pKd. - - Parameters - ---------- - deltaG : float - Input DeltaG value - - Returns - ------- - score : float - The converted DeltaG to pKd if self.topKd is true, - else the input DeltaG. - """ - if self.topKd: - score = self.deltaG_to_pKd( - deltaG, - kelvins=self.temperature + KELVIN_TO_CELCIUS, - ) - else: - score = deltaG - return round(score, 3) - - @staticmethod - def deltaG_to_pKd(deltaG: float, kelvins: float = 298.3) -> float: - """Convert a deltaG (in Kcal/mol) to pKd. - - Parameters - ---------- - deltaG : float - DeltaG value (in Kcal/mol) - kelvins : float, optional - Temperature at which to perform the conversion. - By default 298.3 (25 degrees Celcius) - - Returns - ------- - pKd : float - The corresponding pKd value at given temperature. - """ - # Convert Kcals to joules - deltaG_joules = deltaG * CALS_TO_JOULES * 1000 - # Use formula - Kd = np.exp(-deltaG_joules / (R_GAZ_CONST * kelvins)) - # Convert to pKd - _pKd = np.log10(Kd) - # Reduce number of decimals - pKd = round(_pKd, 2) - return -pKd - - @abstractmethod - def evaluate_complex(self) -> float: - """Logic to evaluate a complex using prodigy.""" - pass - - @staticmethod - @abstractmethod - def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: - """Logic to set the distance cutoff.""" - pass - - -class ProdigyProtein(ProdigyWorker): - """Class managing the computation of protein-protein with prodigy.""" - - def __init__(self, model: FilePath, params: ParamDict) -> None: - """Instanciate the class with superclass.""" - super().__init__(model, params) - - def evaluate_complex(self) -> float: - """Evaluate a complex with prodigy-prot. - - Returns - ------- - deltaG : float - The computed DeltaG of the input complex. - """ - from prodigy_prot.predict_IC import parse_structure, Prodigy - structure, _n_chains, _n_res = parse_structure(self.model) - prodigy = Prodigy(structure, self.chains, self.temperature) - prodigy.predict( - distance_cutoff=self.dist_cutoff, - acc_threshold=self.acc_cutoff, - ) - deltaG = prodigy.ba_val - return deltaG - - @staticmethod - def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: - """Set distance cutoff to use for analysis of contacts. - - Parameters - ---------- - _dist_cutoff : Optional[float] - Distance set by the user. Can be None if undefined. - - Returns - ------- - dist_cutoff : float - The distance cutoff to use for this run. - Set to default software value (5.5) if undefined. - """ - # User defined value - if not np.isnan(_dist_cutoff): - dist_cutoff = _dist_cutoff - # Not defined case - else: - dist_cutoff = 5.5 - return dist_cutoff - - -class ProdigyLigand(ProdigyWorker): - """Class managing the computation of protein-ligand with prodigy.""" - - def __init__(self, model: FilePath, params: ParamDict) -> None: - """Instanciate the class with superclass.""" - super().__init__(model, params) - - def evaluate_complex(self) -> float: - """Evaluate a complex with prodigy-lig. - - Returns - ------- - deltaG : float - The computed DeltaG of the input complex. - """ - from prodigy_lig.prodigy_lig import ( - basename, - extract_electrostatics, - FastMMCIFParser, - PDBParser, - ProdigyLig, - splitext, - ) - fname, s_ext = splitext(basename(self.model)) - if s_ext in (".pdb", ".ent", ): - parser = PDBParser(QUIET=1) - elif s_ext == ".cif": - parser = FastMMCIFParser(QUIET=1) - - with open(self.model) as in_file: - # try to set electrostatics from input file if not provided by user - electrostatics = False - try: - electrostatics = extract_electrostatics(in_file) - except Exception: - pass - prodigy_lig = ProdigyLig( - parser.get_structure(fname, in_file), - chains=[ - ":".join(self.chains), - f"{self.lig_chain}:{self.lig_resname}", - ], - electrostatics=electrostatics, - cutoff=self.dist_cutoff, - ) - prodigy_lig.predict() - deltaG = prodigy_lig.dg_elec if prodigy_lig.dg_elec else prodigy_lig.dg - return deltaG - - @staticmethod - def set_distance_cutoff(_dist_cutoff: Optional[float]) -> float: - """Set distance cutoff to use for analysis of contacts. - - Parameters - ---------- - _dist_cutoff : Optional[float] - Distance set by the user. Can be None if undefined. - - Returns - ------- - dist_cutoff : float - The distance cutoff to use for this run. - Set to default software value (10.5) if undefined. - """ - # User defined value - if not np.isnan(_dist_cutoff): - dist_cutoff = _dist_cutoff - # Not defined case - else: - dist_cutoff = 10.5 - return dist_cutoff - - -class ModelScore: - """Simple class for holding score for a model.""" - - def __init__(self, model_index: int) -> None: - """Initiate models scores.""" - self.index = model_index - self.score = None - self.error = None - - -class ProdigyJob: - """Managing the computation of prodigy scores within haddock3.""" - - def __init__( - self, - model: PDBFile, - params: ParamDict, - index: int = 1, - ) -> None: - """Initiate a worker.""" - worker = self.get_worker(params["scoring_mode"]) - self.worker = worker(model.rel_path, params) - self.score = ModelScore(index) - - def _run(self) -> ModelScore: - """Run the worker and retrieve output values.""" - try: - self.worker.run() - except Exception as e: - log.error(e) - else: - self.score.score = self.worker.score - self.score.error = self.worker.error - return self.score - - def run(self) -> ModelScore: - """Execute the _run method.""" - return self._run() - - @staticmethod - def get_worker(mode: str) -> Union[ProdigyProtein, ProdigyLigand]: - """Find appropriated class that will handle the computation. - - Parameters - ---------- - mode : str - Prodigy scoring mode, either protein or ligand - - Returns - ------- - Union[ProdigyProt, ProdigyLig] - The prodigy class that will handle the computation - """ - if mode == "protein": - return ProdigyProtein - else: - return ProdigyLigand diff --git a/src/haddock/modules/scoring/prodigy/__init__.py b/src/haddock/modules/scoring/prodigyligand/__init__.py similarity index 100% rename from src/haddock/modules/scoring/prodigy/__init__.py rename to src/haddock/modules/scoring/prodigyligand/__init__.py diff --git a/src/haddock/modules/scoring/prodigy/defaults.yaml b/src/haddock/modules/scoring/prodigyligand/defaults.yaml similarity index 100% rename from src/haddock/modules/scoring/prodigy/defaults.yaml rename to src/haddock/modules/scoring/prodigyligand/defaults.yaml diff --git a/src/haddock/modules/scoring/prodigyligand/prodigy.py b/src/haddock/modules/scoring/prodigyligand/prodigy.py new file mode 100644 index 000000000..0e0b31bb1 --- /dev/null +++ b/src/haddock/modules/scoring/prodigyligand/prodigy.py @@ -0,0 +1,76 @@ +"""Set of functionalities to run prodigy.""" + +from haddock.core.typing import FilePath, ParamDict +from haddock.libs.libontology import PDBFile +from haddock.libs.libprodigy import ProdigyBaseJob, ProdigyWorker + + +class ProdigyLigand(ProdigyWorker): + """Class managing the computation of protein-ligand with prodigy.""" + + def __init__(self, model: FilePath, params: ParamDict) -> None: + """Instantiate the class with superclass.""" + super().__init__(model, params) + + def evaluate_complex(self) -> float: + """Evaluate a complex with prodigy-lig. + + Returns + ------- + deltaG : float + The computed DeltaG of the input complex. + """ + from prodigy_lig.prodigy_lig import ( + basename, + extract_electrostatics, + FastMMCIFParser, + PDBParser, + ProdigyLig, + splitext, + ) + # Mimic prodigy-ligand main + fname, s_ext = splitext(basename(self.model)) + if s_ext in (".pdb", ".ent", ): + parser = PDBParser(QUIET=1) + elif s_ext == ".cif": + parser = FastMMCIFParser(QUIET=1) + + with open(self.model) as in_file: + # try to set electrostatics from input file if not provided by user + electrostatics = False + try: + electrostatics = extract_electrostatics(in_file) + except Exception: + pass + prodigy_lig = ProdigyLig( + parser.get_structure(fname, in_file), + chains=[ + ":".join(self.chains), + f"{self.lig_chain}:{self.lig_resname}", + ], + electrostatics=electrostatics, + cutoff=self.dist_cutoff, + ) + # Run predictions + prodigy_lig.predict() + # Retrieve DeltaG + deltaG = prodigy_lig.dg_elec if prodigy_lig.dg_elec else prodigy_lig.dg + return deltaG + + +class ProdigyJob(ProdigyBaseJob): + """Managing the computation of prodigy scores within haddock3.""" + + def __init__( + self, + model: PDBFile, + params: ParamDict, + index: int = 1, + ) -> None: + """Instantiate the class with superclass.""" + super().__init__(model, params, index) + + @staticmethod + def get_worker() -> object: + """Return the appropriate worker.""" + return ProdigyLigand diff --git a/src/haddock/modules/scoring/prodigyprotein/__init__.py b/src/haddock/modules/scoring/prodigyprotein/__init__.py new file mode 100644 index 000000000..577290c7c --- /dev/null +++ b/src/haddock/modules/scoring/prodigyprotein/__init__.py @@ -0,0 +1,83 @@ +"""EM scoring module. + +This module performs energy minimization and scoring of the models generated in +the previous step of the workflow. No restraints are applied during this step. +""" + +from pathlib import Path + +from haddock.core.defaults import MODULE_DEFAULT_YAML +from haddock.core.typing import FilePath +from haddock.libs.libontology import PDBFile +from haddock.modules import get_engine +from haddock.modules.scoring import ScoringModule +from haddock.modules.scoring.prodigyprotein.prodigy import ( + ProdigyJob, + CheckInstall, + ) + + +RECIPE_PATH = Path(__file__).resolve().parent +DEFAULT_CONFIG = Path(RECIPE_PATH, MODULE_DEFAULT_YAML) + + +class HaddockModule(ScoringModule): + """HADDOCK3 module to perform energy minimization scoring.""" + + name = RECIPE_PATH.name + + def __init__( + self, + order: int, + path: Path, + initial_params: FilePath = DEFAULT_CONFIG, + ) -> None: + super().__init__(order, path, initial_params) + + @classmethod + def confirm_installation(cls) -> None: + """Confirm module is installed.""" + CheckInstall() + return + + def _run(self) -> None: + """Execute module.""" + # Retrieve previous models + try: + models_to_score = self.previous_io.retrieve_models(individualize=True) + except Exception as e: + self.finish_with_error(e) + + # Pool of Prodigy jobs to be executed + jobs: list[ProdigyJob] = [] + self.output_models: list[PDBFile] = [] + + for mi, model in enumerate(models_to_score): + self.output_models.append(model) + prodigy_job = ProdigyJob( + model, + self.params, + index=mi, + ) + jobs.append(prodigy_job) + + # Run CNS Jobs + self.log(f"Running {len(jobs)} Prodigy Jobs") + Engine = get_engine(self.params["mode"], self.params) + engine = Engine(jobs) + engine.run() + self.log("Prodigy jobs have finished") + + # Check for generated output, fail it not all expected files are found + for model_score in engine.results: + # point score stored in engine + prodigy_score = model_score.score + model_index = model_score.index + # Point corresponding model + self.output_models[model_index].score = prodigy_score + + output_fname = "prodigy.tsv" + self.log(f"Saving output to {output_fname}") + self.output(output_fname) + + self.export_io_models() diff --git a/src/haddock/modules/scoring/prodigyprotein/defaults.yaml b/src/haddock/modules/scoring/prodigyprotein/defaults.yaml new file mode 100644 index 000000000..0b530ad1e --- /dev/null +++ b/src/haddock/modules/scoring/prodigyprotein/defaults.yaml @@ -0,0 +1,51 @@ +chains: + default: ["A", "B"] + type: list + minitems: 2 + maxitems: 20 + title: Chains to be scored. + short: Chains to be scored. + long: Chains to be scored. + group: scoring + explevel: easy +distance_cutoff: + default: 5.5 + type: float + min: 1.00 + max: 100.00 + precision: 2 + title: Add text + short: Add text + long: Add text. + group: scoring + explevel: expert +accessibility_cutoff: + default: 0.05 + type: float + min: 0.00 + max: 1.00 + precision: 2 + title: Add text + short: Add text + long: Add text + group: scoring + explevel: expert +temperature: + default: 25.00 + type: float + min: -273.15 + max: 95.00 + precision: 2 + title: Add text + short: Add text + long: Add text + group: conversion + explevel: expert +to_pkd: + default: true + type: boolean + title: Add text + short: Add text + long: Add text + group: conversion + explevel: easy \ No newline at end of file diff --git a/src/haddock/modules/scoring/prodigyprotein/prodigy.py b/src/haddock/modules/scoring/prodigyprotein/prodigy.py new file mode 100644 index 000000000..8ad9f7001 --- /dev/null +++ b/src/haddock/modules/scoring/prodigyprotein/prodigy.py @@ -0,0 +1,53 @@ +"""Set of functionalities to run prodigy. + +DevNotes: +The magic happens in haddock.libs.libprodigy +""" + +from haddock.core.typing import FilePath, ParamDict +from haddock.libs.libontology import PDBFile +from haddock.libs.libprodigy import ProdigyBaseJob, ProdigyWorker + + +class ProdigyProtein(ProdigyWorker): + """Class managing the computation of protein-protein with prodigy.""" + + def __init__(self, model: FilePath, params: ParamDict) -> None: + """Instantiate the class with superclass.""" + super().__init__(model, params) + + def evaluate_complex(self) -> float: + """Evaluate a complex with prodigy-prot. + + Returns + ------- + deltaG : float + The computed DeltaG of the input complex. + """ + from prodigy_prot.predict_IC import parse_structure, Prodigy + structure, _n_chains, _n_res = parse_structure(self.model) + prodigy = Prodigy(structure, self.chains, self.temperature) + prodigy.predict( + distance_cutoff=self.dist_cutoff, + acc_threshold=self.acc_cutoff, + ) + deltaG = prodigy.ba_val + return deltaG + + +class ProdigyJob(ProdigyBaseJob): + """Managing the computation of prodigy scores within haddock3.""" + + def __init__( + self, + model: PDBFile, + params: ParamDict, + index: int = 1, + ) -> None: + """Instantiate the class with superclass.""" + super().__init__(model, params, index) + + @staticmethod + def get_worker() -> object: + """Return the appropriate worker.""" + return ProdigyProtein From cd3616adfdac5f35bef54276294326579419374f Mon Sep 17 00:00:00 2001 From: VGPReys Date: Fri, 4 Oct 2024 16:43:05 +0200 Subject: [PATCH 10/16] refinings --- src/haddock/libs/libprodigy.py | 7 +--- .../scoring/prodigyligand/defaults.yaml | 36 +++---------------- .../modules/scoring/prodigyligand/prodigy.py | 5 ++- .../modules/scoring/prodigyprotein/prodigy.py | 2 ++ 4 files changed, 12 insertions(+), 38 deletions(-) diff --git a/src/haddock/libs/libprodigy.py b/src/haddock/libs/libprodigy.py index 41345a0fc..8628c1a61 100644 --- a/src/haddock/libs/libprodigy.py +++ b/src/haddock/libs/libprodigy.py @@ -50,15 +50,10 @@ class ProdigyWorker(ABC): def __init__(self, model: FilePath, params: ParamDict) -> None: # Use by both prodigy -prot and -lig self.model = model + self.params = params self.topKd = params["to_pkd"] self.temperature = params["temperature"] self.dist_cutoff = self.set_distance_cutoff(params["distance_cutoff"]) - self.chains = params["chains"] - # Only used by prodigy-prot - self.acc_cutoff = params["accessibility_cutoff"] - # Only used by prodigy-lig - self.lig_resname = params["ligand_resname"] - self.lig_chain = params["ligand_chain"] # Output values self.score: Optional[float] = None self.error: Optional[Exception] = None diff --git a/src/haddock/modules/scoring/prodigyligand/defaults.yaml b/src/haddock/modules/scoring/prodigyligand/defaults.yaml index 2ea14e2f5..d537fa679 100644 --- a/src/haddock/modules/scoring/prodigyligand/defaults.yaml +++ b/src/haddock/modules/scoring/prodigyligand/defaults.yaml @@ -1,22 +1,8 @@ -scoring_mode: - default: protein +receptor_chain: + default: "A" type: string - minchars: 6 - maxchars: 7 - choices: - - protein - - ligand - title: Scoring mode of PRODIGY - short: Scoring mode of PRODIGY - long: Choose protein when scoring protein complexes, and ligands when a small - molecule is involved. - group: scoring - explevel: easy -chains: - default: ["A", "B"] - type: list - minitems: 2 - maxitems: 2 + minchars: 1 + maxchars: 1 title: Chains to be scored. short: Chains to be scored. long: Chains to be scored. @@ -43,7 +29,7 @@ ligand_chain: group: scoring explevel: easy distance_cutoff: - default: .nan + default: 10.5 type: float min: 1.00 max: 100.00 @@ -55,18 +41,6 @@ distance_cutoff: prodigy-prot or prodigy-lig, depending on the selected `scoring_mode`. group: scoring explevel: expert -accessibility_cutoff: - default: 0.05 - type: float - min: 0.00 - max: 1.00 - precision: 2 - title: Add text - short: Add text - long: Add text - Not used in prodigy-lig. - group: scoring - explevel: expert temperature: default: 25.00 type: float diff --git a/src/haddock/modules/scoring/prodigyligand/prodigy.py b/src/haddock/modules/scoring/prodigyligand/prodigy.py index 0e0b31bb1..feb236c57 100644 --- a/src/haddock/modules/scoring/prodigyligand/prodigy.py +++ b/src/haddock/modules/scoring/prodigyligand/prodigy.py @@ -11,6 +11,9 @@ class ProdigyLigand(ProdigyWorker): def __init__(self, model: FilePath, params: ParamDict) -> None: """Instantiate the class with superclass.""" super().__init__(model, params) + self.receptor_chain = self.params["receptor_chain"] + self.lig_resname = self.params["ligand_resname"] + self.lig_chain = self.params["ligand_chain"] def evaluate_complex(self) -> float: """Evaluate a complex with prodigy-lig. @@ -45,7 +48,7 @@ def evaluate_complex(self) -> float: prodigy_lig = ProdigyLig( parser.get_structure(fname, in_file), chains=[ - ":".join(self.chains), + f"{self.receptor_chain}:{self.lig_chain}", f"{self.lig_chain}:{self.lig_resname}", ], electrostatics=electrostatics, diff --git a/src/haddock/modules/scoring/prodigyprotein/prodigy.py b/src/haddock/modules/scoring/prodigyprotein/prodigy.py index 8ad9f7001..4ca56adbd 100644 --- a/src/haddock/modules/scoring/prodigyprotein/prodigy.py +++ b/src/haddock/modules/scoring/prodigyprotein/prodigy.py @@ -15,6 +15,8 @@ class ProdigyProtein(ProdigyWorker): def __init__(self, model: FilePath, params: ParamDict) -> None: """Instantiate the class with superclass.""" super().__init__(model, params) + self.acc_cutoff = self.params["accessibility_cutoff"] + self.chains = self.params["chains"] def evaluate_complex(self) -> float: """Evaluate a complex with prodigy-prot. From 1bd9d9bc5795d36917ee60b4ca7b60367abfeff9 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Fri, 4 Oct 2024 16:44:48 +0200 Subject: [PATCH 11/16] fix distcutoff in lib --- src/haddock/libs/libprodigy.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/haddock/libs/libprodigy.py b/src/haddock/libs/libprodigy.py index 8628c1a61..d59c8bbe5 100644 --- a/src/haddock/libs/libprodigy.py +++ b/src/haddock/libs/libprodigy.py @@ -53,7 +53,7 @@ def __init__(self, model: FilePath, params: ParamDict) -> None: self.params = params self.topKd = params["to_pkd"] self.temperature = params["temperature"] - self.dist_cutoff = self.set_distance_cutoff(params["distance_cutoff"]) + self.dist_cutoff = params["distance_cutoff"] # Output values self.score: Optional[float] = None self.error: Optional[Exception] = None From 37c1fe65928b5df4ad89a013b82eb06bd413b7d5 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Tue, 8 Oct 2024 10:22:44 +0200 Subject: [PATCH 12/16] class name fix --- src/haddock/libs/libprodigy.py | 4 ++-- src/haddock/modules/scoring/prodigyligand/prodigy.py | 6 +++++- src/haddock/modules/scoring/prodigyprotein/prodigy.py | 2 +- 3 files changed, 8 insertions(+), 4 deletions(-) diff --git a/src/haddock/libs/libprodigy.py b/src/haddock/libs/libprodigy.py index d59c8bbe5..7daf1673a 100644 --- a/src/haddock/libs/libprodigy.py +++ b/src/haddock/libs/libprodigy.py @@ -11,7 +11,7 @@ # Define conversion constants -R_GAZ_CONST = 8.314 +R_GAZ_CONST = 8.31446261815324 # (J x mol−1 x K−1) CALS_TO_JOULES = 4.184 KELVIN_TO_CELCIUS = 273.15 @@ -135,7 +135,7 @@ def __init__(self, model_index: int) -> None: self.error = None -class ProdigyJob: +class ProdigyBaseJob: """Managing the computation of prodigy scores within haddock3.""" def __init__( diff --git a/src/haddock/modules/scoring/prodigyligand/prodigy.py b/src/haddock/modules/scoring/prodigyligand/prodigy.py index feb236c57..80d9c8e09 100644 --- a/src/haddock/modules/scoring/prodigyligand/prodigy.py +++ b/src/haddock/modules/scoring/prodigyligand/prodigy.py @@ -1,4 +1,8 @@ -"""Set of functionalities to run prodigy.""" +"""Set of functionalities to run prodigy-ligand. + +DevNotes: +The magic happens in haddock.libs.libprodigy +""" from haddock.core.typing import FilePath, ParamDict from haddock.libs.libontology import PDBFile diff --git a/src/haddock/modules/scoring/prodigyprotein/prodigy.py b/src/haddock/modules/scoring/prodigyprotein/prodigy.py index 4ca56adbd..ec2f18875 100644 --- a/src/haddock/modules/scoring/prodigyprotein/prodigy.py +++ b/src/haddock/modules/scoring/prodigyprotein/prodigy.py @@ -1,4 +1,4 @@ -"""Set of functionalities to run prodigy. +"""Set of functionalities to run prodigy-protein. DevNotes: The magic happens in haddock.libs.libprodigy From de59a8b306395cfaf43887b464dcc65d80a1d869 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Tue, 8 Oct 2024 14:21:22 +0200 Subject: [PATCH 13/16] add tests --- tests/test_module_prodigyprotein.py | 70 +++++++++++++++++++++++++++++ 1 file changed, 70 insertions(+) create mode 100644 tests/test_module_prodigyprotein.py diff --git a/tests/test_module_prodigyprotein.py b/tests/test_module_prodigyprotein.py new file mode 100644 index 000000000..246656461 --- /dev/null +++ b/tests/test_module_prodigyprotein.py @@ -0,0 +1,70 @@ +"""Test module prodigy-protein.""" + +import pytest + +from pathlib import Path + +from haddock.core.typing import Generator +from haddock.libs.libontology import PDBFile +from haddock.modules.scoring.prodigyprotein import ProdigyJob + +from . import golden_data + + +@pytest.fixture(name="prodigyprot") +def fixture_prodigyprot() -> Generator[ProdigyJob, None, None]: + yield ProdigyJob( + model=PDBFile( + Path(golden_data, "protprot_1bkd_1.pdb"), + path=golden_data, + ), + params={ + "chains": ["R", "S"], + "distance_cutoff": 5.5, + "accessibility_cutoff": 0.05, + "temperature": 25.0, + "to_pkd": True, + }, + index=1, + ) + + +def test_prodigyprot_output_pKd(prodigyprot): + output = prodigyprot.run() + assert not prodigyprot.score.error + assert prodigyprot.score.index == 1 + assert prodigyprot.score.score == pytest.approx(-10.39, 0.01) + assert not output.error + assert output.index == 1 + assert output.score == pytest.approx(-10.39, 0.01) + + +def test_prodigyprot_output_temperature(prodigyprot): + prodigyprot.worker.temperature = 36 + output = prodigyprot.run() + assert not prodigyprot.score.error + assert prodigyprot.score.index == 1 + assert prodigyprot.score.score == pytest.approx(-10.02, 0.01) + assert not output.error + assert output.index == 1 + assert output.score == pytest.approx(-10.02, 0.01) + + +def test_prodigyprot_output_DeltaG(prodigyprot): + prodigyprot.worker.topKd = False + output = prodigyprot.run() + assert not prodigyprot.score.error + assert prodigyprot.score.index == 1 + assert prodigyprot.score.score == pytest.approx(-14.169, 0.01) + assert not output.error + assert output.index == 1 + assert output.score == pytest.approx(-14.169, 0.01) + + +def test_prodigyprot_output_wrong_chains(prodigyprot): + prodigyprot.worker.chains = ["A", "B"] + output = prodigyprot.run() + assert prodigyprot.score.index == 1 + assert not prodigyprot.score.score + assert output.index == 1 + assert not output.score \ No newline at end of file From ad283094ad7693775efd2030407218621ee41c29 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Tue, 8 Oct 2024 14:21:41 +0200 Subject: [PATCH 14/16] fixes in impots --- src/haddock/modules/scoring/prodigyligand/__init__.py | 3 ++- src/haddock/modules/scoring/prodigyligand/prodigy.py | 9 +++++---- src/haddock/modules/scoring/prodigyprotein/__init__.py | 6 ++---- src/haddock/modules/scoring/prodigyprotein/prodigy.py | 7 ++++--- 4 files changed, 13 insertions(+), 12 deletions(-) diff --git a/src/haddock/modules/scoring/prodigyligand/__init__.py b/src/haddock/modules/scoring/prodigyligand/__init__.py index 8d096647b..966d0dcf2 100644 --- a/src/haddock/modules/scoring/prodigyligand/__init__.py +++ b/src/haddock/modules/scoring/prodigyligand/__init__.py @@ -9,9 +9,10 @@ from haddock.core.defaults import MODULE_DEFAULT_YAML from haddock.core.typing import FilePath from haddock.libs.libontology import PDBFile +from haddock.libs.libprodigy import CheckInstall from haddock.modules import get_engine from haddock.modules.scoring import ScoringModule -from haddock.modules.scoring.prodigy.prodigy import ProdigyJob, CheckInstall +from haddock.modules.scoring.prodigyligand.prodigy import ProdigyJob RECIPE_PATH = Path(__file__).resolve().parent diff --git a/src/haddock/modules/scoring/prodigyligand/prodigy.py b/src/haddock/modules/scoring/prodigyligand/prodigy.py index 80d9c8e09..850fac3db 100644 --- a/src/haddock/modules/scoring/prodigyligand/prodigy.py +++ b/src/haddock/modules/scoring/prodigyligand/prodigy.py @@ -1,7 +1,7 @@ """Set of functionalities to run prodigy-ligand. DevNotes: -The magic happens in haddock.libs.libprodigy +The magic happens in haddock/libs/libprodigy.py """ from haddock.core.typing import FilePath, ParamDict @@ -15,9 +15,10 @@ class ProdigyLigand(ProdigyWorker): def __init__(self, model: FilePath, params: ParamDict) -> None: """Instantiate the class with superclass.""" super().__init__(model, params) - self.receptor_chain = self.params["receptor_chain"] - self.lig_resname = self.params["ligand_resname"] - self.lig_chain = self.params["ligand_chain"] + # Hold specific parameters + self.receptor_chain = params["receptor_chain"] + self.lig_resname = params["ligand_resname"] + self.lig_chain = params["ligand_chain"] def evaluate_complex(self) -> float: """Evaluate a complex with prodigy-lig. diff --git a/src/haddock/modules/scoring/prodigyprotein/__init__.py b/src/haddock/modules/scoring/prodigyprotein/__init__.py index 577290c7c..dbf8f81fb 100644 --- a/src/haddock/modules/scoring/prodigyprotein/__init__.py +++ b/src/haddock/modules/scoring/prodigyprotein/__init__.py @@ -9,12 +9,10 @@ from haddock.core.defaults import MODULE_DEFAULT_YAML from haddock.core.typing import FilePath from haddock.libs.libontology import PDBFile +from haddock.libs.libprodigy import CheckInstall from haddock.modules import get_engine from haddock.modules.scoring import ScoringModule -from haddock.modules.scoring.prodigyprotein.prodigy import ( - ProdigyJob, - CheckInstall, - ) +from haddock.modules.scoring.prodigyprotein.prodigy import ProdigyJob RECIPE_PATH = Path(__file__).resolve().parent diff --git a/src/haddock/modules/scoring/prodigyprotein/prodigy.py b/src/haddock/modules/scoring/prodigyprotein/prodigy.py index ec2f18875..cb964f100 100644 --- a/src/haddock/modules/scoring/prodigyprotein/prodigy.py +++ b/src/haddock/modules/scoring/prodigyprotein/prodigy.py @@ -1,7 +1,7 @@ """Set of functionalities to run prodigy-protein. DevNotes: -The magic happens in haddock.libs.libprodigy +The magic happens in haddock/libs/libprodigy.py """ from haddock.core.typing import FilePath, ParamDict @@ -15,8 +15,9 @@ class ProdigyProtein(ProdigyWorker): def __init__(self, model: FilePath, params: ParamDict) -> None: """Instantiate the class with superclass.""" super().__init__(model, params) - self.acc_cutoff = self.params["accessibility_cutoff"] - self.chains = self.params["chains"] + # Hold specific parameters + self.acc_cutoff = params["accessibility_cutoff"] + self.chains = params["chains"] def evaluate_complex(self) -> float: """Evaluate a complex with prodigy-prot. From bce908b1273e0a3e6da5ebf48a032094451afb27 Mon Sep 17 00:00:00 2001 From: VGPReys Date: Tue, 8 Oct 2024 14:25:05 +0200 Subject: [PATCH 15/16] gaz constant --- src/haddock/libs/libprodigy.py | 5 ++--- 1 file changed, 2 insertions(+), 3 deletions(-) diff --git a/src/haddock/libs/libprodigy.py b/src/haddock/libs/libprodigy.py index 7daf1673a..e3663ebf4 100644 --- a/src/haddock/libs/libprodigy.py +++ b/src/haddock/libs/libprodigy.py @@ -6,7 +6,7 @@ from haddock import log from haddock.core.exceptions import ModuleError -from haddock.core.typing import FilePath, Optional, ParamDict, Union +from haddock.core.typing import FilePath, Optional, ParamDict from haddock.libs.libontology import PDBFile @@ -50,7 +50,6 @@ class ProdigyWorker(ABC): def __init__(self, model: FilePath, params: ParamDict) -> None: # Use by both prodigy -prot and -lig self.model = model - self.params = params self.topKd = params["to_pkd"] self.temperature = params["temperature"] self.dist_cutoff = params["distance_cutoff"] @@ -135,7 +134,7 @@ def __init__(self, model_index: int) -> None: self.error = None -class ProdigyBaseJob: +class ProdigyBaseJob(ABC): """Managing the computation of prodigy scores within haddock3.""" def __init__( From f2f65339b755da9d5c9b7b901ea1af7336860de7 Mon Sep 17 00:00:00 2001 From: Victor Reys <132575181+VGPReys@users.noreply.github.com> Date: Fri, 11 Oct 2024 16:05:21 +0200 Subject: [PATCH 16/16] Update pyproject.toml --- pyproject.toml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/pyproject.toml b/pyproject.toml index ee1af62ad..7ec5e189d 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -43,7 +43,7 @@ dependencies = [ 'toml>=0.10.2', 'pandas==2.*', 'plotly==5.24.1', - 'prodigy-prot==2.2.3', + 'prodigy-prot>=2', 'prodigy-lig==1.1.2', 'freesasa>=2.2.1', ]