From 2db780a60fe5dcdf5595a9473c53504acd8ab761 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Tue, 29 Apr 2025 13:19:33 +0100 Subject: [PATCH 01/41] Updated Boltz version to 1.0.0, this allows us to use Boltz-1x --- abcfold/boltz1/check_install.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/abcfold/boltz1/check_install.py b/abcfold/boltz1/check_install.py index 9d7ffc7..0c21386 100644 --- a/abcfold/boltz1/check_install.py +++ b/abcfold/boltz1/check_install.py @@ -4,7 +4,7 @@ logger = logging.getLogger("logger") -BOLTZ_VERSION = "0.4.1" +BOLTZ_VERSION = "1.0.0" def check_boltz1(): From 4ed30843f1cd1cc3dac5bd7507b21b60f6b1a54e Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 7 May 2025 12:05:40 +0100 Subject: [PATCH 02/41] Added initial support for af3 singularity image --- abcfold/abcfold.py | 1 + abcfold/alphafold3/run_alphafold3.py | 52 ++++++++++++++++++++-------- abcfold/argparse_utils.py | 6 ++++ 3 files changed, 45 insertions(+), 14 deletions(-) diff --git a/abcfold/abcfold.py b/abcfold/abcfold.py index 0b565ba..292cb7b 100644 --- a/abcfold/abcfold.py +++ b/abcfold/abcfold.py @@ -149,6 +149,7 @@ def run(args, config, defaults, config_file): database_dir=af3_database, number_of_models=args.number_of_models, num_recycles=args.num_recycles, + sif_path=args.sif_path, ) if af3_success: diff --git a/abcfold/alphafold3/run_alphafold3.py b/abcfold/alphafold3/run_alphafold3.py index 579622f..7a85856 100644 --- a/abcfold/alphafold3/run_alphafold3.py +++ b/abcfold/alphafold3/run_alphafold3.py @@ -12,6 +12,7 @@ def run_alphafold3( output_dir: Union[str, Path], model_params: Union[str, Path], database_dir: Union[str, Path], + sif_path: Union[str, Path, None], interactive: bool = False, number_of_models: int = 5, num_recycles: int = 10, @@ -24,6 +25,7 @@ def run_alphafold3( output_dir (Union[str, Path]): Path to the output directory model_params (Union[str, Path]): Path to the model parameters database_dir (Union[str, Path]): Path to the database directory + sif_path (Union[str, Path]): Path to a Singularity image file interactive (bool): If True, run the docker container in interactive mode number_of_models (int): Number of models to generate @@ -42,6 +44,7 @@ def run_alphafold3( output_dir=output_dir, model_params=model_params, database_dir=database_dir, + sif_path=sif_path, interactive=interactive, number_of_models=number_of_models, num_recycles=num_recycles, @@ -70,6 +73,7 @@ def generate_af3_cmd( output_dir: Union[str, Path], model_params: Union[str, Path], database_dir: Union[str, Path], + sif_path: Union[str, Path, None], number_of_models: int = 10, num_recycles: int = 5, interactive: bool = False, @@ -82,6 +86,7 @@ def generate_af3_cmd( output_dir (Union[str, Path]): Path to the output directory model_params (Union[str, Path]): Path to the model parameters database_dir (Union[str, Path]): Path to the database directory + sif_path (Union[str, Path]): Path to a Singularity image file number_of_models (int): Number of models to generate interactive (bool): If True, run the docker container in interactive mode @@ -90,18 +95,37 @@ def generate_af3_cmd( """ input_json = Path(input_json) output_dir = Path(output_dir) - return f""" - docker run {'-it' if interactive else ''} \ - --volume {input_json.parent.resolve()}:/root/af_input \ - --volume {output_dir.resolve()}:/root/af_output \ - --volume {model_params}:/root/models \ - --volume {database_dir}:/root/public_databases \ - --gpus all \ - alphafold3 \ - python run_alphafold.py \ - --json_path=/root/af_input/{input_json.name} \ - --model_dir=/root/models \ - --output_dir=/root/af_output \ - --num_diffusion_samples {number_of_models}\ - --num_recycles {num_recycles} + + if sif_path is not None: + return f""" + singularity exec \ + --nv \ + --bind {input_json.parent.resolve()}:/root/af_input \ + --bind {output_dir.resolve()}:/root/af_output \ + --bind {model_params}:/root/models \ + --bind {database_dir}:/root/public_databases \ + {sif_path} \ + python run_alphafold.py \ + --json_path=/root/af_input/{input_json.name} \ + --model_dir=/root/models \ + --output_dir=/root/af_output \ + --num_diffusion_samples {number_of_models}\ + --num_recycles {num_recycles} + """ + else: + return f""" + docker run {'-it' if interactive else ''} \ + --volume {input_json.parent.resolve()}:/root/af_input \ + --volume {output_dir.resolve()}:/root/af_output \ + --volume {model_params}:/root/models \ + --volume {database_dir}:/root/public_databases \ + --gpus all \ + alphafold3 \ + python run_alphafold.py \ + --json_path=/root/af_input/{input_json.name} \ + --model_dir=/root/models \ + --output_dir=/root/af_output \ + --num_diffusion_samples {number_of_models}\ + --num_recycles {num_recycles} + """ diff --git a/abcfold/argparse_utils.py b/abcfold/argparse_utils.py index ed4eb74..dc4f9e0 100644 --- a/abcfold/argparse_utils.py +++ b/abcfold/argparse_utils.py @@ -110,6 +110,12 @@ def alphafold_argparse_util(parser): default=None, ) + parser.add_argument( + "--sif_path", + help="The path to the Singularity image of AlphaFold3", + default=None, + ) + parser.add_argument( "-a", "--alphafold3", From 0191be3e61e69d1bda184924f707fc8dd57404c0 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 7 May 2025 12:23:23 +0100 Subject: [PATCH 03/41] Fixed issue with run_alphafold.py path --- abcfold/alphafold3/run_alphafold3.py | 6 +++--- 1 file changed, 3 insertions(+), 3 deletions(-) diff --git a/abcfold/alphafold3/run_alphafold3.py b/abcfold/alphafold3/run_alphafold3.py index 7a85856..9300e75 100644 --- a/abcfold/alphafold3/run_alphafold3.py +++ b/abcfold/alphafold3/run_alphafold3.py @@ -25,7 +25,7 @@ def run_alphafold3( output_dir (Union[str, Path]): Path to the output directory model_params (Union[str, Path]): Path to the model parameters database_dir (Union[str, Path]): Path to the database directory - sif_path (Union[str, Path]): Path to a Singularity image file + sif_path (Union[str, Path, None]): Path to a Singularity image file interactive (bool): If True, run the docker container in interactive mode number_of_models (int): Number of models to generate @@ -86,7 +86,7 @@ def generate_af3_cmd( output_dir (Union[str, Path]): Path to the output directory model_params (Union[str, Path]): Path to the model parameters database_dir (Union[str, Path]): Path to the database directory - sif_path (Union[str, Path]): Path to a Singularity image file + sif_path (Union[str, Path, None]): Path to a Singularity image file number_of_models (int): Number of models to generate interactive (bool): If True, run the docker container in interactive mode @@ -105,7 +105,7 @@ def generate_af3_cmd( --bind {model_params}:/root/models \ --bind {database_dir}:/root/public_databases \ {sif_path} \ - python run_alphafold.py \ + python /app/alphafold/run_alphafold.py \ --json_path=/root/af_input/{input_json.name} \ --model_dir=/root/models \ --output_dir=/root/af_output \ From 3029c376febe5a584ff946cbb467eddfac4b1889 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 7 May 2025 14:56:20 +0100 Subject: [PATCH 04/41] Modified check install to use .sif file and updated tests --- abcfold/abcfold.py | 2 +- abcfold/alphafold3/check_install.py | 36 ++++++++++++++++++++++------- tests/test_run_alphafold3.py | 29 +++++++++++++++++++++-- 3 files changed, 56 insertions(+), 11 deletions(-) diff --git a/abcfold/abcfold.py b/abcfold/abcfold.py index 292cb7b..3fbca3f 100644 --- a/abcfold/abcfold.py +++ b/abcfold/abcfold.py @@ -92,7 +92,7 @@ def run(args, config, defaults, config_file): if args.alphafold3: from abcfold.alphafold3.check_install import check_af3_install - check_af3_install(interactive=False) + check_af3_install(interactive=False, sif_path=args.sif_path) if args.boltz1: from abcfold.boltz1.check_install import check_boltz1 diff --git a/abcfold/alphafold3/check_install.py b/abcfold/alphafold3/check_install.py index e3114da..3b373b4 100644 --- a/abcfold/alphafold3/check_install.py +++ b/abcfold/alphafold3/check_install.py @@ -1,5 +1,7 @@ import logging import subprocess +from pathlib import Path +from typing import Union from packaging.version import Version @@ -9,7 +11,8 @@ AF3_VERSION = "3.0.0" -def check_af3_install(interactive: bool = True) -> None: +def check_af3_install(interactive: bool = True, + sif_path: Union[str, Path, None] = None) -> None: """ Check if Alphafold3 is installed by running the help command @@ -21,7 +24,7 @@ def check_af3_install(interactive: bool = True) -> None: """ logger.debug("Checking if Alphafold3 is installed") - cmd = generate_test_command(interactive) + cmd = generate_test_command(interactive, sif_path) with subprocess.Popen( cmd, shell=True, stdout=subprocess.PIPE, stderr=subprocess.PIPE ) as p: @@ -36,7 +39,7 @@ def check_af3_install(interactive: bool = True) -> None: raise subprocess.CalledProcessError(p.returncode, cmd, stderr) logger.info("Alphafold3 is installed") - cmd = generate_version_command() + cmd = generate_version_command(sif_path) with subprocess.Popen( cmd, shell=True, stdout=subprocess.PIPE, stderr=subprocess.PIPE ) as p: @@ -49,7 +52,8 @@ def check_af3_install(interactive: bool = True) -> None: ) -def generate_test_command(interactive: bool = True) -> str: +def generate_test_command(interactive: bool = True, + sif_path: Union[str, Path, None] = None) -> str: """ Generate the Alphafold3 help command @@ -59,7 +63,15 @@ def generate_test_command(interactive: bool = True) -> str: Returns: str: The Alphafold3 help command """ - return f""" + if sif_path: + return f""" + singularity exec \ + {sif_path} \ + python /app/alphafold/run_alphafold.py \ + --help +""" + else: + return f""" docker run {'-it' if interactive else ''} \ alphafold3 \ python run_alphafold.py \ @@ -67,12 +79,20 @@ def generate_test_command(interactive: bool = True) -> str: """ -def generate_version_command() -> str: +def generate_version_command(sif_path: Union[str, Path, None] = None) -> str: """ Generate the Alphafold3 version command """ - - return """docker run \ + if sif_path: + return f""" + singularity exec \ + {sif_path} \ + python -c \ + 'from alphafold3.version import __version__ ; print(__version__)' +""" + else: + return """ + docker run \ alphafold3 \ python -c \ 'from alphafold3.version import __version__ ; print(__version__)' diff --git a/tests/test_run_alphafold3.py b/tests/test_run_alphafold3.py index dd9a7d6..d0cba67 100644 --- a/tests/test_run_alphafold3.py +++ b/tests/test_run_alphafold3.py @@ -18,8 +18,10 @@ def test_generate_af3_command(test_data): output_dir=output_dir, model_params=model_params, database_dir=database_dir, + sif_path=None, interactive=True, ) + assert "docker run -it" in cmd assert f"--volume {input_json.parent.resolve()}:/root/af_input" in cmd assert f"--volume {output_dir.resolve()}:/root/af_output" in cmd @@ -31,14 +33,35 @@ def test_generate_af3_command(test_data): assert "--model_dir=/root/models" in cmd assert "--output_dir=/root/af_output" in cmd + +def test_generate_af3_singularity_command(test_data): + input_json = Path(test_data.test_inputA_json) + output_dir = Path("/road/to/nowhere") + model_params = Path("/road/to/nowhere") + database_dir = Path("/road/to/nowhere") + sif_path = Path("/road/to/nowhere.sif") + cmd = generate_af3_cmd( input_json=input_json, output_dir=output_dir, model_params=model_params, database_dir=database_dir, - interactive=False, + sif_path=sif_path, + interactive=True ) - assert "docker run" in cmd + + assert "singularity exec" in cmd + assert f"--bind {input_json.parent.resolve()}:/root/af_input" in cmd + assert f"--bind {output_dir.resolve()}:/root/af_output" in cmd + assert f"--bind {model_params}:/root/models" in cmd + assert f"--bind {database_dir}:/root/public_databases" in cmd + assert f"{sif_path}" in cmd + assert "python /app/alphafold/run_alphafold.py" in cmd + assert f"--json_path=/root/af_input/{input_json.name}" in cmd + assert "--model_dir=/root/models" in cmd + assert "--output_dir=/root/af_output" in cmd + assert "--num_diffusion_samples" in cmd + assert "--num_recycles" in cmd @pytest.mark.skipif(os.getenv("CI") == "true", reason="Skipping test in CI environment") @@ -54,6 +77,7 @@ def test_run_af3(test_data): output_dir, model_params, database_dir, + sif_path=None, interactive=False, ) @@ -62,6 +86,7 @@ def test_run_af3(test_data): output_dir=output_dir, model_params=model_params, database_dir=database_dir, + sif_path=None, interactive=False, ) From 5208b4e7d60c98b2fa87ca782240998039124bba Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 7 May 2025 15:51:49 +0100 Subject: [PATCH 05/41] Added ptm and iptm scores to the output page --- abcfold/abcfold.py | 12 ++++++--- abcfold/alphafold3/run_alphafold3.py | 2 +- abcfold/html/abcfold_vue.js | 10 ++++++-- abcfold/html/html_utils.py | 37 +++++++++++++++++++++++++++- 4 files changed, 54 insertions(+), 7 deletions(-) diff --git a/abcfold/abcfold.py b/abcfold/abcfold.py index 3fbca3f..78f7e00 100644 --- a/abcfold/abcfold.py +++ b/abcfold/abcfold.py @@ -235,6 +235,7 @@ def run(args, config, defaults, config_file): for idx in ao.output[seed].keys(): model = ao.output[seed][idx]["cif"] model.check_clashes() + score_file = ao.output[seed][idx]["summary"] plddt = model.residue_plddts if len(indicies) > 0: plddt = insert_none_by_minus_one( @@ -243,7 +244,8 @@ def run(args, config, defaults, config_file): ) index_counter += 1 model_data = get_model_data( - model, plot_dict, "AlphaFold3", plddt, args.output_dir + model, plot_dict, "AlphaFold3", + plddt, score_file, args.output_dir ) alphafold_models["models"].append(model_data) @@ -254,6 +256,7 @@ def run(args, config, defaults, config_file): for idx in bo.output.keys(): model = bo.output[idx]["cif"] model.check_clashes() + score_file = bo.output[idx]["json"] plddt = model.residue_plddts if len(indicies) > 0: plddt = insert_none_by_minus_one( @@ -262,7 +265,8 @@ def run(args, config, defaults, config_file): ) index_counter += 1 model_data = get_model_data( - model, plot_dict, "Boltz-1", plddt, args.output_dir + model, plot_dict, "Boltz-1", + plddt, score_file, args.output_dir ) boltz_models["models"].append(model_data) @@ -274,6 +278,7 @@ def run(args, config, defaults, config_file): if idx >= 0: model = co.output[idx]["cif"] model.check_clashes() + score_file = co.output[idx]["scores"] plddt = model.residue_plddts if len(indicies) > 0: plddt = insert_none_by_minus_one( @@ -282,7 +287,8 @@ def run(args, config, defaults, config_file): ) index_counter += 1 model_data = get_model_data( - model, plot_dict, "Chai-1", plddt, args.output_dir + model, plot_dict, "Chai-1", + plddt, score_file, args.output_dir ) chai_models["models"].append(model_data) diff --git a/abcfold/alphafold3/run_alphafold3.py b/abcfold/alphafold3/run_alphafold3.py index 9300e75..61f44a6 100644 --- a/abcfold/alphafold3/run_alphafold3.py +++ b/abcfold/alphafold3/run_alphafold3.py @@ -111,8 +111,8 @@ def generate_af3_cmd( --output_dir=/root/af_output \ --num_diffusion_samples {number_of_models}\ --num_recycles {num_recycles} - """ + else: return f""" docker run {'-it' if interactive else ''} \ diff --git a/abcfold/html/abcfold_vue.js b/abcfold/html/abcfold_vue.js index 74686a7..04f4e5c 100644 --- a/abcfold/html/abcfold_vue.js +++ b/abcfold/html/abcfold_vue.js @@ -76,10 +76,14 @@ Vue.component('abc-table', { onclick="sortTableAndFeatures('abc_table', sequence, ft1, ABC_rowFeatureMap, '#div1', 2)">Average pLDDT H-score + pTM score + ipTM score Residue Clashes + onclick="sortTableAndFeatures('abc_table', sequence, ft1, ABC_rowFeatureMap, '#div1', 6)">Residue Clashes Atom Clashes + onclick="sortTableAndFeatures('abc_table', sequence, ft1, ABC_rowFeatureMap, '#div1', 7)">Atom Clashes Model visualisations @@ -89,6 +93,8 @@ Vue.component('abc-table', { {{ abcmodel.model_source }} {{ abcmodel.avg_plddt | decimalPlaces }} {{ abcmodel.h_score }} + {{ abcmodel.ptm_score }} + {{ abcmodel.iptm_score }} {{ abcmodel.residue_clashes }} {{ abcmodel.atom_clashes }} diff --git a/abcfold/html/html_utils.py b/abcfold/html/html_utils.py index 6c766cd..48a6f5d 100644 --- a/abcfold/html/html_utils.py +++ b/abcfold/html/html_utils.py @@ -1,4 +1,5 @@ import http.server +import json import textwrap from itertools import groupby from operator import itemgetter @@ -98,7 +99,7 @@ def get_model_sequence_data(cif_objs) -> dict: return sequence_data -def get_model_data(model, plot_dict, method, plddt_scores, output_dir): +def get_model_data(model, plot_dict, method, plddt_scores, score_file, output_dir): """ Get the model data for the output page @@ -106,9 +107,11 @@ def get_model_data(model, plot_dict, method, plddt_scores, output_dir): model (CifFile): Model object plot_dict (dict): Dictionary of plots method (str): Method used to generate the model + score_file (str): Path to the file containing model scores output_dir (Path): Path to the output directory """ regions = get_plddt_regions(plddt_scores) + ptm_score, iptm_score = parse_scores(score_file) model_data = { "model_id": model.name, "model_source": method, @@ -116,6 +119,8 @@ def get_model_data(model, plot_dict, method, plddt_scores, output_dir): "plddt_regions": regions, "avg_plddt": model.average_plddt, "h_score": model.h_score, + "ptm_score": ptm_score, + "iptm_score": iptm_score, "residue_clashes": model.clashes_residues, "atom_clashes": model.clashes, "pae_path": Path(plot_dict[model.pathway.as_posix()]) @@ -232,3 +237,33 @@ def get_all_cif_files(outputs) -> Dict[str, list]: method_cif_objs["Chai-1"] = output.cif_files return method_cif_objs + + +def parse_scores(score_file: str) -> tuple: + """ + Parse the scores from the score file + + Args: + score_file (str): Path to the score file + + Returns: + tuple: ptm_score, iptm_score + """ + ptm_score = None + iptm_score = None + + if not Path(score_file).exists(): + raise FileNotFoundError(f"Score file {score_file} not found") + + if Path(score_file).suffix == ".json": + with open(score_file, "r") as f: + data = json.load(f) + ptm_score = float(data["ptm"]) + iptm_score = float(data["iptm"]) + elif Path(score_file).suffix == ".npz": + with open(score_file, "rb") as f: + data = np.load(f) + ptm_score = float(data["ptm"]) + iptm_score = float(data["iptm"]) + + return ptm_score, iptm_score From 3213363fe0fd9d6ebffb01c9dd4e616d84564c02 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 7 May 2025 17:25:15 +0100 Subject: [PATCH 06/41] Changed parse score function to use correct instances --- abcfold/html/html_utils.py | 29 ++++++++++++----------------- 1 file changed, 12 insertions(+), 17 deletions(-) diff --git a/abcfold/html/html_utils.py b/abcfold/html/html_utils.py index 48a6f5d..12fdbe9 100644 --- a/abcfold/html/html_utils.py +++ b/abcfold/html/html_utils.py @@ -1,5 +1,4 @@ import http.server -import json import textwrap from itertools import groupby from operator import itemgetter @@ -13,6 +12,7 @@ from abcfold.output.alphafold3 import AlphafoldOutput from abcfold.output.boltz import BoltzOutput from abcfold.output.chai import ChaiOutput +from abcfold.output.file_handlers import ConfidenceJsonFile, NpzFile from abcfold.plots.pae_plot import create_pae_plots from abcfold.plots.plddt_plot import plot_plddt @@ -239,31 +239,26 @@ def get_all_cif_files(outputs) -> Dict[str, list]: return method_cif_objs -def parse_scores(score_file: str) -> tuple: +def parse_scores(score_file: Union[ConfidenceJsonFile, NpzFile]) -> tuple: """ Parse the scores from the score file Args: - score_file (str): Path to the score file + score_file (Union[ConfidenceJsonFile, NpzFile]): The score file object. Returns: - tuple: ptm_score, iptm_score + tuple: A tuple containing ptm_score and iptm_score as floats. """ ptm_score = None iptm_score = None - if not Path(score_file).exists(): - raise FileNotFoundError(f"Score file {score_file} not found") - - if Path(score_file).suffix == ".json": - with open(score_file, "r") as f: - data = json.load(f) - ptm_score = float(data["ptm"]) - iptm_score = float(data["iptm"]) - elif Path(score_file).suffix == ".npz": - with open(score_file, "rb") as f: - data = np.load(f) - ptm_score = float(data["ptm"]) - iptm_score = float(data["iptm"]) + if isinstance(score_file, ConfidenceJsonFile): + data = score_file.load_json_file() + ptm_score = float(data["ptm"]) + iptm_score = float(data["iptm"]) + elif isinstance(score_file, NpzFile): + data = score_file.load_npz_file() + ptm_score = float(data["ptm"]) + iptm_score = float(data["iptm"]) return ptm_score, iptm_score From ac2f20460688a352813dcd03e7c0ada2a823e4ff Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 7 May 2025 17:45:42 +0100 Subject: [PATCH 07/41] Updated the readme with .sif info and some other fixes mentioned by reviewers --- README.md | 10 ++++++---- 1 file changed, 6 insertions(+), 4 deletions(-) diff --git a/README.md b/README.md index cd5f2cb..e90de02 100644 --- a/README.md +++ b/README.md @@ -18,7 +18,7 @@ We recommend installing this package in a virtual environment or conda / microma To set up a conda/micromamba environment, run: ```bash -conda env create -n abcfold python=3.11 +conda create -n abcfold python=3.11 conda activate abcfold ``` @@ -98,7 +98,7 @@ However, there you may wish to use the following flags to add run time options s - ``: Path to the input AlphaFold3 JSON file. - ``: Path to the output directory. - `-a`, `-b`, `-c` (`--alphafold3`, `--boltz1`,`--chai1`): Flags to run Alphafold3, Boltz-1 and Chai-1 respectively. If none of these flags are provided, Alphafold3 will be run by default. -- `--mmseqs2`: [optional] Flag to use MMseqs2 MSAs and templates. +- `--mmseqs2`: [optional] Flag to use MMseqs2 MSAs and templates (if specified). - `--override`: [optional] Flag to override the existing output directory. - `--save_input`: [optional] Flag to save the input JSON file in the output directory. @@ -107,10 +107,12 @@ However, there you may wish to use the following flags to add run time options s - `--model_params`: Path to the directory containing the AlphaFold3 model parameters. - `--database`: [optional] Path to the directory containing the AlphaFold3 databases #Note: This is not used if using the `--mmseqs2` flag. -- `--use_af3_template_search`[optional] If providing your own custom MSA or you've ran `--mmseqs`, allow Alphafold3 to search for templates +- `--sif_path`: [optional] Path to sif file if using an AlphaFold3 singularity instead of Docker +- `--use_af3_template_search`[optional] If providing your own custom MSA or you've ran `--mmseqs2`, allow Alphafold3 to search for templates -#### Template and MSA arguments +#### Template arguments +- `--templates`: Flag to enable a template search - `--num_templates`: [optional] The number of templates to use (default: 20) - `--custom_template`: [optional] Path to a custom template file in mmCIF format or a list of custom templates. A more detailed decription on how to use the custom template argument can be found below Visualisation arguments. From 5afe1f6cfe6aa46cfa107eedee108127833eefb9 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 7 May 2025 17:46:17 +0100 Subject: [PATCH 08/41] Rounded ptm/iptm scores to 2 decimal places --- abcfold/html/html_utils.py | 8 ++++---- 1 file changed, 4 insertions(+), 4 deletions(-) diff --git a/abcfold/html/html_utils.py b/abcfold/html/html_utils.py index 12fdbe9..15efd56 100644 --- a/abcfold/html/html_utils.py +++ b/abcfold/html/html_utils.py @@ -254,11 +254,11 @@ def parse_scores(score_file: Union[ConfidenceJsonFile, NpzFile]) -> tuple: if isinstance(score_file, ConfidenceJsonFile): data = score_file.load_json_file() - ptm_score = float(data["ptm"]) - iptm_score = float(data["iptm"]) + ptm_score = round(float(data["ptm"]), 2) + iptm_score = round(float(data["iptm"]), 2) elif isinstance(score_file, NpzFile): data = score_file.load_npz_file() - ptm_score = float(data["ptm"]) - iptm_score = float(data["iptm"]) + ptm_score = round(float(data["ptm"]), 2) + iptm_score = round(float(data["iptm"]), 2) return ptm_score, iptm_score From 3f1f4a21a5a4bec4132b540b2e6d2a9a058779a9 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 7 May 2025 18:13:07 +0100 Subject: [PATCH 09/41] Clarified how to run open_output.py in the readme and fixed pathing issue when trying to open the output file from the output page --- README.md | 6 ++---- abcfold/html/html_utils.py | 2 +- 2 files changed, 3 insertions(+), 5 deletions(-) diff --git a/README.md b/README.md index e90de02..5a4de16 100644 --- a/README.md +++ b/README.md @@ -145,11 +145,10 @@ ABCFold will output the AlphaFold, Boltz and/or Chai models in the ` Unless the `--no_visuals` flag is used, you can then open the output pages by running: ```bash -python /open_output.py +cd +python open_output.py ``` - - ## Main Page Example ![main_page_example](https://raw.githubusercontent.com/rigdenlab/ABCFold/refs/heads/main/abcfold/html/static/main_page_example.png) @@ -161,7 +160,6 @@ you will find `open_output.py` in your ``. This needs to be run from - ## Extra Features Below are scripts for adding MMseqs2 MSAs and custom templates to AlphaFold3 input JSON files. diff --git a/abcfold/html/html_utils.py b/abcfold/html/html_utils.py index 15efd56..e269401 100644 --- a/abcfold/html/html_utils.py +++ b/abcfold/html/html_utils.py @@ -115,7 +115,7 @@ def get_model_data(model, plot_dict, method, plddt_scores, score_file, output_di model_data = { "model_id": model.name, "model_source": method, - "model_path": model.pathway.as_posix(), + "model_path": "/".join(Path(model.pathway).parts[1:]), "plddt_regions": regions, "avg_plddt": model.average_plddt, "h_score": model.h_score, From 0ce15da77923563c7aefce79f6653d8ee6f5055e Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Fri, 9 May 2025 14:51:59 +0100 Subject: [PATCH 10/41] Updated readme and added command to make run dir for boltz/chai if saving the input --- README.md | 2 +- abcfold/boltz1/run_boltz.py | 1 + abcfold/chai1/run_chai1.py | 2 ++ 3 files changed, 4 insertions(+), 1 deletion(-) diff --git a/README.md b/README.md index 5a4de16..aad2722 100644 --- a/README.md +++ b/README.md @@ -50,7 +50,7 @@ If you wish to help develop this package, you can install the development depend ```bash python -m pip install -e . python -m pip install -r requirements-dev.txt -python -m pre-commit install +python -m pre_commit install ``` ## Usage diff --git a/abcfold/boltz1/run_boltz.py b/abcfold/boltz1/run_boltz.py index c432bdd..dad7de4 100644 --- a/abcfold/boltz1/run_boltz.py +++ b/abcfold/boltz1/run_boltz.py @@ -49,6 +49,7 @@ def run_boltz( if save_input: logger.info("Saving input yaml file and msa to the output directory") working_dir = output_dir + working_dir.mkdir(parents=True, exist_ok=True) boltz_yaml = BoltzYaml(working_dir) boltz_yaml.json_to_yaml(input_json) diff --git a/abcfold/chai1/run_chai1.py b/abcfold/chai1/run_chai1.py index 6cc3e25..26a49f1 100644 --- a/abcfold/chai1/run_chai1.py +++ b/abcfold/chai1/run_chai1.py @@ -42,6 +42,7 @@ def run_chai( """ input_json = Path(input_json) output_dir = Path(output_dir) + logger.debug("Checking if Chai-1 is installed") check_chai1() @@ -50,6 +51,7 @@ def run_chai( if save_input: logger.info("Saving input fasta file and msa to the output directory") working_dir = output_dir + working_dir.mkdir(parents=True, exist_ok=True) chai_fasta = ChaiFasta(working_dir) chai_fasta.json_to_fasta(input_json) From 74dd3abaa95efaf014e0619fc0becffc4ab50f68 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Fri, 9 May 2025 16:01:10 +0100 Subject: [PATCH 11/41] Fixes to chai output issues --- abcfold/abcfold.py | 2 +- abcfold/boltz1/run_boltz.py | 1 - abcfold/chai1/run_chai1.py | 10 ++++++---- abcfold/output/chai.py | 7 +++++++ 4 files changed, 14 insertions(+), 6 deletions(-) diff --git a/abcfold/abcfold.py b/abcfold/abcfold.py index 78f7e00..626b32d 100644 --- a/abcfold/abcfold.py +++ b/abcfold/abcfold.py @@ -202,7 +202,7 @@ def run(args, config, defaults, config_file): ) if chai_success: - co = ChaiOutput(chai_output_dir, input_params, name) + co = ChaiOutput(chai_output_dir, input_params, name, args.save_input) outputs.append(co) successful_runs.append(chai_success) diff --git a/abcfold/boltz1/run_boltz.py b/abcfold/boltz1/run_boltz.py index dad7de4..c432bdd 100644 --- a/abcfold/boltz1/run_boltz.py +++ b/abcfold/boltz1/run_boltz.py @@ -49,7 +49,6 @@ def run_boltz( if save_input: logger.info("Saving input yaml file and msa to the output directory") working_dir = output_dir - working_dir.mkdir(parents=True, exist_ok=True) boltz_yaml = BoltzYaml(working_dir) boltz_yaml.json_to_yaml(input_json) diff --git a/abcfold/chai1/run_chai1.py b/abcfold/chai1/run_chai1.py index 26a49f1..69bc20d 100644 --- a/abcfold/chai1/run_chai1.py +++ b/abcfold/chai1/run_chai1.py @@ -48,10 +48,12 @@ def run_chai( with tempfile.TemporaryDirectory() as temp_dir: working_dir = Path(temp_dir) + chai_output_dir = output_dir if save_input: logger.info("Saving input fasta file and msa to the output directory") working_dir = output_dir working_dir.mkdir(parents=True, exist_ok=True) + chai_output_dir = output_dir / "chai_output" chai_fasta = ChaiFasta(working_dir) chai_fasta.json_to_fasta(input_json) @@ -65,7 +67,7 @@ def run_chai( out_fasta, msa_dir, out_constraints, - output_dir, + chai_output_dir, number_of_models, num_recycles=num_recycles, use_templates_server=use_templates_server, @@ -84,10 +86,10 @@ def run_chai( _, stderr = proc.communicate() if proc.returncode != 0: if proc.stderr: - if output_dir.exists(): - output_err_file = output_dir / "chai_error.log" + if chai_output_dir.exists(): + output_err_file = chai_output_dir / "chai_error.log" else: - output_err_file = output_dir.parent / "chai_error.log" + output_err_file = chai_output_dir.parent / "chai_error.log" with open(output_err_file, "w") as f: f.write(stderr.decode()) logger.error( diff --git a/abcfold/output/chai.py b/abcfold/output/chai.py index 1b14ecc..e8b920d 100644 --- a/abcfold/output/chai.py +++ b/abcfold/output/chai.py @@ -16,6 +16,7 @@ def __init__( chai_output_dir: Union[str, Path], input_params: dict, name: str, + save_input: bool = False, ): """ Object to process the output of an Chai-1 run @@ -25,6 +26,7 @@ def __init__( input_params (dict): Dictionary containing the input parameters used for the Chai-1 run name (str): Name given to the Chai-1 run + save_input (bool): If True, Chai-1 was run with the save_input flag Attributes: input_params (dict): Dictionary containing the input parameters used for the @@ -56,11 +58,13 @@ def __init__( self.input_params = input_params self.output_dir = Path(chai_output_dir) self.name = name + self.save_input = save_input if not self.output_dir.name.startswith("chai1_" + self.name): self.output_dir = self.output_dir.rename( self.output_dir.parent / f"chai1_{self.name}" ) + self.input_fasta = self.get_input_fasta() self.output = self.process_chai_output() @@ -81,6 +85,9 @@ def __init__( def process_chai_output(self): file_groups = {} + if self.save_input: + self.output_dir = self.output_dir / "chai_output" + for pathway in self.output_dir.iterdir(): number = pathway.stem.split("model_idx_")[-1] if number.isdigit(): From 9fb421028d1c56c2860e4ca4e52f59587d83424f Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Mon, 12 May 2025 16:25:22 +0100 Subject: [PATCH 12/41] Updated the help descriptions of the input arguments --- abcfold/argparse_utils.py | 78 +++++++++++++++++++++++++-------------- 1 file changed, 51 insertions(+), 27 deletions(-) diff --git a/abcfold/argparse_utils.py b/abcfold/argparse_utils.py index dc4f9e0..17ec7a0 100644 --- a/abcfold/argparse_utils.py +++ b/abcfold/argparse_utils.py @@ -6,8 +6,24 @@ def main_argpase_util(parser): - parser.add_argument("input_json", help="Input sequence file") - parser.add_argument("output_dir", help="Output directory") + parser.add_argument( + "input_json", + help="Path to the input JSON in AlphaFold3 format" + ) + parser.add_argument( + "output_dir", + help="Path to the output directory" + ) + parser.add_argument( + "--override", + help="[optional] Override the existing output directory, if it exists", + action="store_true", + ) + parser.add_argument( + "--output_json", + help="[optional] Specify the path of the output ABCFold json file, this \ +can be used to run subsequent runs of ABCFold with the same input features (e.g. MSA)", + ) return parser @@ -16,16 +32,19 @@ def mmseqs2_argparse_util(parser): parser.add_argument( "--mmseqs2", action="store_true", - help="Use MMseqs2 for MSA", + help="[optional] Use MMseqs2 for MSA generation and template \ +searching (if used with --templates flag)", ) parser.add_argument( - "--templates", action="store_true", help="Include templates in the output json" + "--templates", + action="store_true", + help="[optional] Enable template search" ) parser.add_argument( "--num_templates", type=int, default=20, - help="Number of templates to include in the output json", + help="[optional] The number of templates to use (default: 20)", ) return parser @@ -33,17 +52,27 @@ def mmseqs2_argparse_util(parser): def custom_template_argpase_util(parser): parser.add_argument( - "--target_id", nargs="+", help="Target id relating to the custom template" + "--target_id", + nargs="+", + help="[conditionally required] The ID of the sequence that the \ +custom template relates to. This is only required if modelling a complex. \ +If providing a list of custom templates, the target_id must be a list of \ +the same length as the custom template list", ) parser.add_argument( "--custom_template", nargs="+", - help="Custom template to include in the output json", + help="[optional] Path to a custom template file in mmCif format or a list \ +of paths to custom template files in mmCif format. If providing a list of \ +custom templates, you must also provide a list of custom template chains.", ) parser.add_argument( "--custom_template_chain", nargs="+", - help="Custom template chain to include in the output json", + help="[conditionally required] The chain ID of the chain to use in your \ +custom template. This is only required if using a multi-chain template. If \ +providing a list of custom templates, you must also provide a list of custom \ +template chains of the same length as the custom template list", ) return parser @@ -54,13 +83,14 @@ def prediction_argparse_util(parser): "--number_of_models", type=int, default=5, - help="Number of models to generate", + help="[optional] The number of models to generate with each method \ +(default: 5)", ) parser.add_argument( "--num_recycles", type=int, default=10, - help="Number of recycles to use during the inference", + help="[optional] Number of recycles to use during inference (default: 10)", ) return parser @@ -94,25 +124,24 @@ def chai_argparse_util(parser): def alphafold_argparse_util(parser): - - parser.add_argument("--output_json", help="Output json file") - # make the vartible saved as database_dir parser.add_argument( "--database", - help="The Database directory for the generation of the MSA.", + help="[optional] The database directory for the generation of the MSA. This \ +is only required if using the built in AlphaFold3 MSA generation", dest="database_dir", default=None, ) parser.add_argument( "--model_params", - help="The directory containing the model parameters", + help="[required] The directory containing the AlphaFold3 model parameters", default=None, ) parser.add_argument( "--sif_path", - help="The path to the Singularity image of AlphaFold3", + help="[conditionally required] The path to the sif image of AlphaFold3 if \ +using Singularity", default=None, ) @@ -123,16 +152,10 @@ def alphafold_argparse_util(parser): help="Run Alphafold3", ) - parser.add_argument( - "--override", - help="Override the existing output directory, if it exists", - action="store_true", - ) - parser.add_argument( "--use_af3_template_search", action="store_true", - help="If providing your own custom MSA or you've ran `--mmseqs`, allow \ + help="If providing your own custom MSA or if you've run `--mmseqs2`, allow \ Alphafold3 to search for templates", ) @@ -143,14 +166,15 @@ def visuals_argparse_util(parser): parser.add_argument( "--no_visuals", action="store_true", - help="Do not generate the output pages, best for running on a cluster\ - without a display", + help="[optional] Do not generate the output pages, best for running on a \ +cluster without a display", ) + parser.add_argument( "--no_server", action="store_true", - help="Do not start a local server to view the results, the output page is \ -stil generated and is accessible in the output directory", + help="[optional] Do not start a local server to view the results, the output \ +page is still generated and is accessible in the output directory", ) return parser From ad7dc794d66ce25b5105200555a8a324f8dd947b Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Mon, 12 May 2025 16:31:18 +0100 Subject: [PATCH 13/41] Added warning about pairedMSA with mmseqs2 --- README.md | 3 +++ 1 file changed, 3 insertions(+) diff --git a/README.md b/README.md index aad2722..02584ec 100644 --- a/README.md +++ b/README.md @@ -89,6 +89,9 @@ abcfold -abc --mmseqs2 --model_params If you wish to run ABCFold with the AlphaFold3 JACKHMMER MSA search, you need to remove the `--mmseqs2` flag and provide the `--database` flag with the path to the directory containing the AlphaFold3 databases. > The `--database` path will also be stored after the first run and won't be required in subsequent ABCFold jobs. +>[!WARNING] +> When using the `--mmseqs2` flag, AlphaFold3 will be run without pairedMSA information. If this is important for your target (e.g. modelling a complex), we recommend running the AlphaFold3 JACKHMMER MSA search as the pairedMSA is automatically generated. + >[!WARNING] >`--model_params` and `--database` will need to be provided again if you do a fresh install. From 57e6e328f4c316eb6e7c68df8aab20eddeaaa7e5 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 14 May 2025 11:39:46 +0100 Subject: [PATCH 14/41] Added in something about boltz limitations --- README.md | 48 +++++++++++++++++++++++++++++++++++++++++++++++- 1 file changed, 47 insertions(+), 1 deletion(-) diff --git a/README.md b/README.md index 02584ec..ec902fd 100644 --- a/README.md +++ b/README.md @@ -234,7 +234,7 @@ mmseqs2msa --input_json --output_json --templates --n - ``: [conditionally required] The ID of the sequence the custom template relates to, only required if modelling a complex. If providing a list of custom templates, you can provide a single target ID if they all relate to the same target. Otherwise, you should provide a list of target IDs corresponding to the list of custom templates. -### Common Issues +### Possible Issues #### Using `--target_id` with homo-oligomer @@ -265,6 +265,52 @@ Below is an example of a hetero-3-mer. When modelling a homo-oligomer, id is giv If you want to add a custom template to the first sequence, you can use `--target_id A`. If you wish to add a custom template to the second sequence, use `--target_id B` or `--target_id C`. +#### Boltz-1 limitations + +If modelling multiple copies of the same sequence in Boltz-1, the input JSON must be set up as follows: + +```json +{ + "name": "7ZYH", + "sequences": [ + { + "protein": { + "id": ["A", "B"], + "sequence": "SNAESKIKDCPWYDRGFCKHGPLCRHRHTRRVICVNYLVGFCPEGPSCKFMHPRFELPMGTTEQ" + } + }, + ], + "modelSeeds": [1], + "dialect": "alphafold3", + "version": 1 +} + +If the sequences are given as seperate entities (as shown below) you will encounter an error. + +```json +{ + "name": "7ZYH", + "sequences": [ + { + "protein": { + "id": "A", + "sequence": "SNAESKIKDCPWYDRGFCKHGPLCRHRHTRRVICVNYLVGFCPEGPSCKFMHPRFELPMGTTEQ" + } + }, + { + "protein": { + "id": "B", + "sequence": "SNAESKIKDCPWYDRGFCKHGPLCRHRHTRRVICVNYLVGFCPEGPSCKFMHPRFELPMGTTEQ" + } + } + ], + "modelSeeds": [1], + "dialect": "alphafold3", + "version": 1 +} +``` + +Additionally, Boltz-1 currently lacks the ability to create linked-ligands and therefore covalent bonds between the chain/ligand will be missing. ## Contributing From 580fc819ef7ff8b8601322a81e42875022af2e35 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 14 May 2025 12:11:32 +0100 Subject: [PATCH 15/41] Added type checker to input_json argument --- abcfold/argparse_utils.py | 30 ++++++++++++++++++++++++++++-- 1 file changed, 28 insertions(+), 2 deletions(-) diff --git a/abcfold/argparse_utils.py b/abcfold/argparse_utils.py index 17ec7a0..7d2a7d2 100644 --- a/abcfold/argparse_utils.py +++ b/abcfold/argparse_utils.py @@ -1,3 +1,4 @@ +import argparse import logging import sys from pathlib import Path @@ -5,9 +6,23 @@ logger = logging.getLogger("logger") +def validate_json_file(value): + """ + Validate that the input is a JSON file with a .json suffix. + """ + if not value.endswith(".json"): + raise argparse.ArgumentTypeError( + f"Input file must have a .json suffix: {value}" + ) + if not Path(value).exists(): + raise argparse.ArgumentTypeError(f"Input file does not exist: {value}") + return value + + def main_argpase_util(parser): parser.add_argument( "input_json", + type=validate_json_file, help="Path to the input JSON in AlphaFold3 format" ) parser.add_argument( @@ -195,10 +210,21 @@ def raise_argument_errors(args): logger.error(f"Model parameters directory not found: {args.model_params}") sys.exit(1) - if args.templates and not args.mmseqs2: - logger.error("Cannot include templates without using MMseqs2") + if args.templates and not args.mmseqs2 and not args.alphafold3: + logger.error( + "Cannot use --templates flag without using MMseqs2 or Alphafold3" + ) sys.exit(1) + if ( + args.templates + and args.alphafold3 + and not args.mmseqs2 + and not args.use_af3_template_search + ): + # Ensure templates are used with Alphafold3 if --templates is set + args.use_af3_template_search = True + if args.custom_template_chain and not args.custom_template: logger.error("Custom template chain provided without a custom template") sys.exit(1) From cd3431bb9a141bf182e96a3ec0aaf010402ea9ad Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 14 May 2025 15:22:12 +0100 Subject: [PATCH 16/41] Added a legend to make it clear you can show/hide the methods --- abcfold/plots/plddt_plot.py | 9 +++++++++ 1 file changed, 9 insertions(+) diff --git a/abcfold/plots/plddt_plot.py b/abcfold/plots/plddt_plot.py index 6081153..01d0506 100644 --- a/abcfold/plots/plddt_plot.py +++ b/abcfold/plots/plddt_plot.py @@ -99,6 +99,15 @@ def plot_plddt( ) fig.add_trace(trace) + fig.update_layout( + legend=dict( + title=dict( + text="Click to Show/Hide Methods", + font=dict(size=12, color="black"), + ) + ) + ) + counter = 0 colour_index = 0 for chain, chain_range in line_ranges.items(): From b50478ffc392c92e35dc30d8066d038114b34156 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Fri, 16 May 2025 16:44:19 +0100 Subject: [PATCH 17/41] preliminary commit to add local mmseqs support --- abcfold/abcfold.py | 1 + abcfold/argparse_utils.py | 5 + abcfold/scripts/add_mmseqs_msa.py | 401 ++++++++++++++++++++++++++++-- 3 files changed, 393 insertions(+), 14 deletions(-) diff --git a/abcfold/abcfold.py b/abcfold/abcfold.py index 626b32d..bc05641 100644 --- a/abcfold/abcfold.py +++ b/abcfold/abcfold.py @@ -117,6 +117,7 @@ def run(args, config, defaults, config_file): input_params = add_msa_to_json( input_json=input_json, + mmseqs_db=args.mmseqs_database, templates=args.templates, num_templates=args.num_templates, chai_template_output=temp_dir.joinpath("all_chains.m8"), diff --git a/abcfold/argparse_utils.py b/abcfold/argparse_utils.py index 7d2a7d2..6393357 100644 --- a/abcfold/argparse_utils.py +++ b/abcfold/argparse_utils.py @@ -49,6 +49,11 @@ def mmseqs2_argparse_util(parser): action="store_true", help="[optional] Use MMseqs2 for MSA generation and template \ searching (if used with --templates flag)", + ) + parser.add_argument( + "--mmseqs_database", + help="[optional] The database directory for the generation of the MSA. This \ +is only required if using a local installation of MMseqs2" ) parser.add_argument( "--templates", diff --git a/abcfold/scripts/add_mmseqs_msa.py b/abcfold/scripts/add_mmseqs_msa.py index d018477..53b09cd 100644 --- a/abcfold/scripts/add_mmseqs_msa.py +++ b/abcfold/scripts/add_mmseqs_msa.py @@ -2,13 +2,17 @@ import json import logging +import math import os import random +import shutil +import subprocess import tarfile import tempfile import time from io import StringIO -from typing import Sequence +from pathlib import Path +from typing import List, Sequence, Union import pandas as pd import requests # type: ignore @@ -26,6 +30,19 @@ "{l_bar}{bar}| {n_fmt}/{total_fmt} [elapsed: {elapsed} remaining: {remaining}]" ) +MODULE_OUTPUT_POS = { + "align": 4, + "convertalis": 4, + "expandaln": 5, + "filterresult": 4, + "lndb": 2, + "mergedbs": 2, + "mvdb": 2, + "pairaln": 4, + "result2msa": 4, + "search": 3, +} + class MMseqs2Exception(Exception): def __init__(self): @@ -38,6 +55,7 @@ def __init__(self): def add_msa_to_json( input_json, + mmseqs_db, templates, num_templates, chai_template_output, @@ -57,15 +75,26 @@ def add_msa_to_json( input_id = sequence["protein"]["id"] input_sequence = sequence["protein"]["sequence"] with tempfile.TemporaryDirectory() as tmpdir: - logger.info(f"Running MMseqs2 on sequence: {input_sequence}") - # Run MMseqs2 to get unpaired MSA - if templates: - a3m_lines, templates = run_mmseqs( - input_sequence, - tmpdir, - use_templates=True, - num_templates=num_templates, - ) + if mmseqs_db: + logger.info(f"Running Local MMseqs2 on sequence: {input_sequence}") + if templates: + a3m_lines, templates = run_local_mmseqs( + input_sequence, + Path(tmpdir), + use_templates=True, + num_templates=num_templates, + mmseqs_db=mmseqs_db, + ) + else: + logger.info(f"Running MMseqs2 on sequence: {input_sequence}") + # Run MMseqs2 to get unpaired MSA + if templates: + a3m_lines, templates = run_mmseqs( + input_sequence, + tmpdir, + use_templates=True, + num_templates=num_templates, + ) for i in input_id: table = pd.read_csv( @@ -108,9 +137,12 @@ def add_msa_to_json( header=False, ) - else: - a3m_lines = run_mmseqs(input_sequence, tmpdir, use_templates=False) - templates = [] + else: + a3m_lines = run_mmseqs( + input_sequence, + tmpdir, + use_templates=False) + templates = [] if custom_template: for template in custom_template: @@ -197,7 +229,7 @@ def run_mmseqs( filter=None, use_pairing=False, host_url="https://a3m.mmseqs.com", - num_templates=20, + num_templates=20 ) -> Sequence[object]: submission_endpoint = "ticket/pair" if use_pairing else "ticket/msa" @@ -384,6 +416,346 @@ def download(ID, path): return (a3m_lines_list, templates) if use_templates else a3m_lines_list +def run_mmseqs_command(mmseqs: Path, params: List[Union[str, Path]]): + module = str(params[0]) + if module in MODULE_OUTPUT_POS: + output_pos = MODULE_OUTPUT_POS[module] + output_path = Path(params[output_pos]).with_suffix('.dbtype') + if output_path.exists(): + logger.info(f"Skipping {module} because {output_path} already exists") + return + + params_log = " ".join(str(i) for i in params) + logger.info(f"Running {mmseqs} {params_log}") + # hide MMseqs2 verbose paramters list that clogs up the log + os.environ["MMSEQS_CALL_DEPTH"] = "1" + subprocess.check_call([str(mmseqs)] + [str(i) for i in params]) + + +def run_local_mmseqs( + x, + base, + use_env=True, + use_templates=False, + filter=None, + num_templates=20, + mmseqs_db=None, + expand_eval: float = math.inf, + align_eval: int = 10, + diff: int = 3000, + qsc: float = -20.0, + max_accept: int = 1000000, + prefilter_mode: int = 0, + s: float = 8, + db_load_mode: int = 2, + threads: int = 32, + gpu: int = 0, + gpu_server: int = 0, + unpack: bool = True, +) -> Sequence[object]: + + if filter: + # 0.1 was not used in benchmarks due to POSIX shell bug in line above + # EXPAND_EVAL=0.1 + align_eval = 10 + qsc = 0.8 + max_accept = 100000 + + mmseqs = Path("mmseqs") + uniref_db = Path("uniref30_2021_03") + metagenomic_db = Path("colabfold_envdb_202108_db") + template_db = Path("pdb") + + base.mkdir(exist_ok=True, parents=True) + query_file = base.joinpath("query.fas") + with query_file.open("w") as f: + query_seq_headername = 101 + f.write(f">{query_seq_headername}\n{x}\n") + + run_mmseqs_command( + mmseqs, + ["createdb", query_file, base.joinpath("qdb"), "--shuffle", "0"], + ) + + used_dbs = [uniref_db] + if use_templates: + used_dbs.append(template_db) + if use_env: + used_dbs.append(metagenomic_db) + + for db in used_dbs: + if not mmseqs_db.joinpath(f"{db}.dbtype").is_file(): + raise FileNotFoundError(f"Database {db} does not exist") + if ( + ( + not mmseqs_db.joinpath(f"{db}.idx").is_file() + and not mmseqs_db.joinpath(f"{db}.idx.index").is_file() + ) + or os.environ.get("MMSEQS_IGNORE_INDEX", False) + ): + logger.info("Search does not use index") + db_load_mode = 0 + dbSuffix1 = "_seq" + dbSuffix2 = "_aln" + dbSuffix3 = "" + else: + dbSuffix1 = ".idx" + dbSuffix2 = ".idx" + dbSuffix3 = ".idx" + + search_param = ["--num-iterations", "3", + "--db-load-mode", str(db_load_mode), + "-a", "-e", "0.1", "--max-seqs", "10000"] + if gpu: + # gpu version only supports ungapped prefilter currently + search_param += ["--gpu", str(gpu), "--prefilter-mode", "1"] + else: + search_param += ["--prefilter-mode", str(prefilter_mode)] + # sensitivy can only be set for non-gpu version, + # gpu version runs at max sensitivity + if s is not None: + search_param += ["-s", "{:.1f}".format(s)] + else: + search_param += ["--k-score", "'seq:96,prof:80'"] + if gpu_server: + search_param += ["--gpu-server", str(gpu_server)] + + filter_param = ["--filter-msa", str(filter), + "--filter-min-enable", "1000", + "--diff", str(diff), + "--qid", "0.0,0.2,0.4,0.6,0.8,1.0", + "--qsc", "0", "--max-seq-id", "0.95"] + expand_param = ["--expansion-mode", "0", + "-e", str(expand_eval), + "--expand-filter-clusters", str(filter), + "--max-seq-id", "0.95"] + + if not base.joinpath("uniref.a3m").with_suffix('.a3m.dbtype').exists(): + run_mmseqs_command(mmseqs, + ["search", base.joinpath("qdb"), + mmseqs_db.joinpath(uniref_db), + base.joinpath("res"), + base.joinpath("tmp"), + "--threads", str(threads)] + search_param) + run_mmseqs_command(mmseqs, + ["mvdb", + base.joinpath("tmp/latest/profile_1"), + base.joinpath("prof_res")]) + run_mmseqs_command(mmseqs, + ["lndb", + base.joinpath("qdb_h"), + base.joinpath("prof_res_h")]) + run_mmseqs_command(mmseqs, + ["expandaln", + base.joinpath("qdb"), + mmseqs_db.joinpath(f"{uniref_db}{dbSuffix1}"), + base.joinpath("res"), + mmseqs_db.joinpath(f"{uniref_db}{dbSuffix2}"), + base.joinpath("res_exp"), + "--db-load-mode", str(db_load_mode), + "--threads", str(threads)] + expand_param) + run_mmseqs_command(mmseqs, + ["align", + base.joinpath("prof_res"), + mmseqs_db.joinpath(f"{uniref_db}{dbSuffix1}"), + base.joinpath("res_exp"), + base.joinpath("res_exp_realign"), + "--db-load-mode", str(db_load_mode), + "-e", str(align_eval), + "--max-accept", str(max_accept), + "--threads", str(threads), + "--alt-ali", "10", "-a"]) + run_mmseqs_command(mmseqs, + ["filterresult", + base.joinpath("qdb"), + mmseqs_db.joinpath(f"{uniref_db}{dbSuffix1}"), + base.joinpath("res_exp_realign"), + base.joinpath("res_exp_realign_filter"), + "--db-load-mode", + str(db_load_mode), + "--qid", "0", + "--qsc", str(qsc), + "--diff", "0", + "--threads", str(threads), + "--max-seq-id", "1.0", + "--filter-min-enable", "100"]) + run_mmseqs_command(mmseqs, + ["result2msa", + base.joinpath("qdb"), + mmseqs_db.joinpath(f"{uniref_db}{dbSuffix1}"), + base.joinpath("res_exp_realign_filter"), + base.joinpath("uniref.a3m"), + "--msa-format-mode", "6", + "--db-load-mode", str(db_load_mode), + "--threads", str(threads)] + filter_param) + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("res_exp_realign_filter")]) + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("res_exp_realign")]) + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("res_exp")]) + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("res")]) + else: + logger.info(f"Skipping {uniref_db} search because uniref.a3m already exists") + + bfd_exists = base.joinpath( + "bfd.mgnify30.metaeuk30.smag30.a3m" + ).with_suffix('.a3m.dbtype').exists() + if use_env and not bfd_exists: + run_mmseqs_command(mmseqs, + ["search", + base.joinpath("prof_res"), + mmseqs_db.joinpath(metagenomic_db), + base.joinpath("res_env"), + base.joinpath("tmp3"), + "--threads", str(threads)] + search_param) + run_mmseqs_command(mmseqs, + ["expandaln", + base.joinpath("prof_res"), + mmseqs_db.joinpath(f"{metagenomic_db}{dbSuffix1}"), + base.joinpath("res_env"), + mmseqs_db.joinpath(f"{metagenomic_db}{dbSuffix2}"), + base.joinpath("res_env_exp"), "-e", str(expand_eval), + "--expansion-mode", "0", + "--db-load-mode", str(db_load_mode), + "--threads", str(threads)]) + run_mmseqs_command(mmseqs, + ["align", + base.joinpath("tmp3/latest/profile_1"), + mmseqs_db.joinpath(f"{metagenomic_db}{dbSuffix1}"), + base.joinpath("res_env_exp"), + base.joinpath("res_env_exp_realign"), + "--db-load-mode", str(db_load_mode), + "-e", str(align_eval), + "--max-accept", str(max_accept), + "--threads", str(threads), + "--alt-ali", "10", "-a"]) + run_mmseqs_command(mmseqs, + ["filterresult", + base.joinpath("qdb"), + mmseqs_db.joinpath(f"{metagenomic_db}{dbSuffix1}"), + base.joinpath("res_env_exp_realign"), + base.joinpath("res_env_exp_realign_filter"), + "--db-load-mode", + str(db_load_mode), + "--qid", "0", + "--qsc", str(qsc), + "--diff", "0", + "--max-seq-id", "1.0", + "--threads", str(threads), + "--filter-min-enable", "100"]) + run_mmseqs_command(mmseqs, + ["result2msa", + base.joinpath("qdb"), + mmseqs_db.joinpath(f"{metagenomic_db}{dbSuffix1}"), + base.joinpath("res_env_exp_realign_filter"), + base.joinpath("bfd.mgnify30.metaeuk30.smag30.a3m"), + "--msa-format-mode", "6", + "--db-load-mode", str(db_load_mode), + "--threads", str(threads)] + filter_param) + run_mmseqs_command(mmseqs, + ["rmdb", base.joinpath("res_env_exp_realign_filter")]) + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("res_env_exp_realign")]) + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("res_env_exp")]) + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("res_env")]) + elif use_env: + logger.info( + f"Skipping {metagenomic_db} search because \ +bfd.mgnify30.metaeuk30.smag30.a3m already exists") + + tmpl_db_exists = base.joinpath( + f"{template_db}.m8" + ).with_suffix('.m8.dbtype').exists() + if use_templates and not tmpl_db_exists: + run_mmseqs_command(mmseqs, + ["search", + base.joinpath("prof_res"), + mmseqs_db.joinpath(template_db), + base.joinpath("res_pdb"), + base.joinpath("tmp2"), + "--db-load-mode", str(db_load_mode), + "--threads", str(threads), + "-s", "7.5", + "-a", "-e", "0.1", + "--prefilter-mode", str(prefilter_mode)]) + run_mmseqs_command(mmseqs, + ["convertalis", + base.joinpath("prof_res"), + mmseqs_db.joinpath(f"{template_db}{dbSuffix3}"), + base.joinpath("res_pdb"), + base.joinpath(f"{template_db}"), + "--format-output", + "query,target,fident,alnlen,mismatch,\ +gapopen,qstart,qend,tstart,tend,evalue,bits,cigar", + "--db-output", "1", + "--db-load-mode", str(db_load_mode), + "--threads", str(threads)]) + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("res_pdb")]) + elif use_templates: + logger.info( + f"Skipping {template_db} search because {template_db}.m8 already exists" + ) + + if use_env: + run_mmseqs_command(mmseqs, + ["mergedbs", base.joinpath("qdb"), + base.joinpath("final.a3m"), + base.joinpath("uniref.a3m"), + base.joinpath("bfd.mgnify30.metaeuk30.smag30.a3m")]) + run_mmseqs_command(mmseqs, + ["rmdb", + base.joinpath("bfd.mgnify30.metaeuk30.smag30.a3m")]) + run_mmseqs_command(mmseqs, + ["rmdb", + base.joinpath("uniref.a3m")]) + else: + run_mmseqs_command(mmseqs, + ["mvdb", + base.joinpath("uniref.a3m"), + base.joinpath("final.a3m")]) + run_mmseqs_command(mmseqs, + ["rmdb", + base.joinpath("uniref.a3m")]) + + if unpack: + run_mmseqs_command(mmseqs, + ["unpackdb", + base.joinpath("final.a3m"), + base.joinpath("."), + "--unpack-name-mode", "0", + "--unpack-suffix", ".a3m"]) + run_mmseqs_command(mmseqs, + ["rmdb", + base.joinpath("final.a3m")]) + + if use_templates: + run_mmseqs_command(mmseqs, + ["unpackdb", + base.joinpath(f"{template_db}"), + base.joinpath("."), + "--unpack-name-mode", "0", + "--unpack-suffix", ".m8"]) + if base.joinpath(f"{template_db}").exists(): + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath(f"{template_db}")]) + + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("prof_res")]) + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("prof_res_h")]) + shutil.rmtree(base.joinpath("tmp")) + if use_templates: + shutil.rmtree(base.joinpath("tmp2")) + if use_env: + shutil.rmtree(base.joinpath("tmp3")) + + if unpack: + run_mmseqs(mmseqs, ["rmdb", base.joinpath("qdb")]) + run_mmseqs(mmseqs, ["rmdb", base.joinpath("qdb_h")]) + + query_file.unlink() + + # TODO: add code to get af3 lines and templates + a3m_lines_list: List[str] = [] + templates: List[str] = [] + + return (a3m_lines_list, templates) if use_templates else a3m_lines_list + + def fetch_mmcif( pdb_id, chain_id, @@ -424,6 +796,7 @@ def main(): add_msa_to_json( # pragma: no cover args.input_json, + args.mmseqs_database, args.templates, args.num_templates, args.custom_template, From 9237f2abcd83941ece730a1208ad1c70a8acdc12 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Mon, 19 May 2025 17:09:00 +0100 Subject: [PATCH 18/41] Added code to add in the a3m lines --- abcfold/scripts/add_mmseqs_msa.py | 43 ++++++++++++++++++++++++++----- 1 file changed, 36 insertions(+), 7 deletions(-) diff --git a/abcfold/scripts/add_mmseqs_msa.py b/abcfold/scripts/add_mmseqs_msa.py index 53b09cd..a329448 100644 --- a/abcfold/scripts/add_mmseqs_msa.py +++ b/abcfold/scripts/add_mmseqs_msa.py @@ -83,7 +83,14 @@ def add_msa_to_json( Path(tmpdir), use_templates=True, num_templates=num_templates, - mmseqs_db=mmseqs_db, + mmseqs_db=Path(mmseqs_db), + ) + else: + a3m_lines = run_local_mmseqs( + input_sequence, + Path(tmpdir), + use_templates=False, + mmseqs_db=Path(mmseqs_db), ) else: logger.info(f"Running MMseqs2 on sequence: {input_sequence}") @@ -437,7 +444,7 @@ def run_local_mmseqs( base, use_env=True, use_templates=False, - filter=None, + filter=0, num_templates=20, mmseqs_db=None, expand_eval: float = math.inf, @@ -462,7 +469,7 @@ def run_local_mmseqs( max_accept = 100000 mmseqs = Path("mmseqs") - uniref_db = Path("uniref30_2021_03") + uniref_db = Path("uniref30_2302_db") metagenomic_db = Path("colabfold_envdb_202108_db") template_db = Path("pdb") @@ -744,13 +751,34 @@ def run_local_mmseqs( shutil.rmtree(base.joinpath("tmp3")) if unpack: - run_mmseqs(mmseqs, ["rmdb", base.joinpath("qdb")]) - run_mmseqs(mmseqs, ["rmdb", base.joinpath("qdb_h")]) + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("qdb")]) + run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("qdb_h")]) query_file.unlink() - # TODO: add code to get af3 lines and templates - a3m_lines_list: List[str] = [] + # Gather a3m lines in the same way as the API + seqs = [x] if isinstance(x, str) else x + N = 101 + seqs_unique = list(set(seqs)) + Ms = [N + seqs_unique.index(seq) for seq in seqs] + + a3m_lines: dict = {} + update_M, M = True, None + for line in open(base.joinpath("final.a3m"), "r"): + if len(line) > 0: + if "\x00" in line: + line = line.replace("\x00", "") + update_M = True + if line.startswith(">") and update_M: + M = int(line[1:].rstrip()) + update_M = False + if M not in a3m_lines: + a3m_lines[M] = [] + a3m_lines[M].append(line) + + a3m_lines_list = ["".join(a3m_lines[n]) for n in Ms] + + # TODO: add templates gathering step - should use templates in db templates: List[str] = [] return (a3m_lines_list, templates) if use_templates else a3m_lines_list @@ -799,6 +827,7 @@ def main(): args.mmseqs_database, args.templates, args.num_templates, + False, args.custom_template, args.custom_template_chain, args.target_id, From 99cdd6a59852c77a4642c25c7b0035d5781a72d6 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Tue, 20 May 2025 13:11:32 +0100 Subject: [PATCH 19/41] Fixed a3m path --- abcfold/scripts/add_mmseqs_msa.py | 5 ++++- 1 file changed, 4 insertions(+), 1 deletion(-) diff --git a/abcfold/scripts/add_mmseqs_msa.py b/abcfold/scripts/add_mmseqs_msa.py index a329448..96e136e 100644 --- a/abcfold/scripts/add_mmseqs_msa.py +++ b/abcfold/scripts/add_mmseqs_msa.py @@ -753,6 +753,9 @@ def run_local_mmseqs( if unpack: run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("qdb")]) run_mmseqs_command(mmseqs, ["rmdb", base.joinpath("qdb_h")]) + output_a3m = base.joinpath("0.a3m") + else: + output_a3m = base.joinpath("final.a3m") query_file.unlink() @@ -764,7 +767,7 @@ def run_local_mmseqs( a3m_lines: dict = {} update_M, M = True, None - for line in open(base.joinpath("final.a3m"), "r"): + for line in open(output_a3m, "r"): if len(line) > 0: if "\x00" in line: line = line.replace("\x00", "") From 4424aa949b2d890d8557f7f00e44b8ff7003810d Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 21 May 2025 12:43:15 +0100 Subject: [PATCH 20/41] Added template support and fixed broken test --- abcfold/scripts/add_mmseqs_msa.py | 166 +++++++++++++++++++----------- tests/test_add_mmseqs2.py | 3 + 2 files changed, 110 insertions(+), 59 deletions(-) diff --git a/abcfold/scripts/add_mmseqs_msa.py b/abcfold/scripts/add_mmseqs_msa.py index 96e136e..fea6e03 100644 --- a/abcfold/scripts/add_mmseqs_msa.py +++ b/abcfold/scripts/add_mmseqs_msa.py @@ -1,5 +1,6 @@ #!/usr/bin/env python +import gzip import json import logging import math @@ -226,7 +227,7 @@ def add_msa_to_json( return input_params -# Code from https://github.com/sokrypton/ColabFold +# Lightly modified code from https://github.com/sokrypton/ColabFold def run_mmseqs( x, prefix, @@ -363,62 +364,15 @@ def download(ID, path): # gather a3m lines a3m_lines: dict = {} for a3m_file in a3m_files: - update_M, M = True, None - for line in open(a3m_file, "r"): - if len(line) > 0: - if "\x00" in line: - line = line.replace("\x00", "") - update_M = True - if line.startswith(">") and update_M: - M = int(line[1:].rstrip()) - update_M = False - if M not in a3m_lines: - a3m_lines[M] = [] - a3m_lines[M].append(line) - + a3m_lines = get_a3m_lines(a3m_file) a3m_lines_list = ["".join(a3m_lines[n]) for n in Ms] - tested_pdbs = [] - templates = [] if use_templates: - logger.info("Finding and preparing templates") - count = 0 - for line in open(f"{path}/pdb70.m8", "r"): - template = {} - if count < num_templates: - p = line.rstrip().split() - pdb, qid, alilen, tstart, tend = ( - p[1], - float(p[2]), - float(p[3]), - int(p[8]), - int(p[9]), - ) - coverage = alilen / len(x) - pdb_id = pdb.split("_")[0] - - # Use the same template filters as AF3 and only use 1 template per PDB - if ( - qid == 1.0 - and coverage >= 0.95 - or coverage < 0.1 - or pdb_id in tested_pdbs - ): - continue - - pdb_id = pdb.split("_")[0] - cif_str = fetch_mmcif(pdb_id, pdb.split("_")[1], tstart, tend, prefix) - template["mmcif"] = cif_str - - template_seq = extract_sequence_from_mmcif(StringIO(cif_str)) - query_indices, template_indices = align_and_map(x, template_seq) - - template["queryIndices"] = query_indices - template["templateIndices"] = template_indices - templates.append(template) - tested_pdbs.append(pdb_id) - count += 1 - logger.info(f"Found the following templates: {tested_pdbs}") + templates = get_templates( + x, + prefix, + num_templates, + ) return (a3m_lines_list, templates) if use_templates else a3m_lines_list @@ -439,6 +393,7 @@ def run_mmseqs_command(mmseqs: Path, params: List[Union[str, Path]]): subprocess.check_call([str(mmseqs)] + [str(i) for i in params]) +# Lightly modified code from https://github.com/sokrypton/ColabFold def run_local_mmseqs( x, base, @@ -471,7 +426,7 @@ def run_local_mmseqs( mmseqs = Path("mmseqs") uniref_db = Path("uniref30_2302_db") metagenomic_db = Path("colabfold_envdb_202108_db") - template_db = Path("pdb") + template_db = Path("pdb100_230517") base.mkdir(exist_ok=True, parents=True) query_file = base.joinpath("query.fas") @@ -764,7 +719,21 @@ def run_local_mmseqs( N = 101 seqs_unique = list(set(seqs)) Ms = [N + seqs_unique.index(seq) for seq in seqs] + a3m_lines = get_a3m_lines(output_a3m) + a3m_lines_list = ["".join(a3m_lines[n]) for n in Ms] + + if use_templates: + templates = get_templates( + x, + base, + num_templates, + mmseqs_db=mmseqs_db, + ) + return (a3m_lines_list, templates) if use_templates else a3m_lines_list + + +def get_a3m_lines(output_a3m): a3m_lines: dict = {} update_M, M = True, None for line in open(output_a3m, "r"): @@ -779,12 +748,63 @@ def run_local_mmseqs( a3m_lines[M] = [] a3m_lines[M].append(line) - a3m_lines_list = ["".join(a3m_lines[n]) for n in Ms] + return a3m_lines - # TODO: add templates gathering step - should use templates in db - templates: List[str] = [] - return (a3m_lines_list, templates) if use_templates else a3m_lines_list +def get_templates(x, base, num_templates, mmseqs_db=None): + tested_pdbs = [] + templates = [] + logger.info("Finding and preparing templates") + count = 0 + for line in open(base.joinpath("0.m8"), "r"): + template = {} + if count < num_templates: + p = line.rstrip().split() + pdb, qid, alilen, tstart, tend = ( + p[1], + float(p[2]), + float(p[3]), + int(p[8]), + int(p[9]), + ) + coverage = alilen / len(x) + pdb_id = pdb.split("_")[0] + + # Use the same template filters as AF3 and only use 1 template per PDB + if ( + qid == 1.0 + and coverage >= 0.95 + or coverage < 0.1 + or pdb_id in tested_pdbs + ): + continue + + pdb_id = pdb.split("_")[0] + if mmseqs_db: + cif_str = fetch_local_mmcif(pdb_id, + pdb.split("_")[1], + tstart, + tend, + base, + mmseqs_db) + else: + cif_str = fetch_mmcif(pdb_id, + pdb.split("_")[1], + tstart, + tend, + base) + template["mmcif"] = cif_str + + template_seq = extract_sequence_from_mmcif(StringIO(cif_str)) + query_indices, template_indices = align_and_map(x, template_seq) + + template["queryIndices"] = query_indices + template["templateIndices"] = template_indices + templates.append(template) + tested_pdbs.append(pdb_id) + count += 1 + logger.info(f"Found the following templates: {tested_pdbs}") + return templates def fetch_mmcif( @@ -811,6 +831,34 @@ def fetch_mmcif( return get_mmcif(output, pdb_id, chain_id, start, end, tmpdir) +def fetch_local_mmcif( + pdb_id, + chain_id, + start, + end, + tmpdir, + mmseqs_db, +): + """ + Fetch the mmcif file for a given PDB ID + and chain ID and prepare it for use in AlphaFold3 + """ + pdb_id = pdb_id.lower() + assert len(pdb_id) == 4, f"Invalid PDB ID: {pdb_id}" + inner_code = pdb_id[1:3] + mmcif_location = mmseqs_db.joinpath(f"pdb/divided/{inner_code}/{pdb_id}.cif.gz") + if not mmcif_location.exists(): + raise FileNotFoundError(f"MMseqs2 database {mmcif_location} does not exist") + with gzip.open(mmcif_location, "rb") as f: + cif_str = f.read().decode("utf-8") + + output = os.path.join(tmpdir, pdb_id + ".cif") + with open(output, "w") as f: + f.write(cif_str) + + return get_mmcif(output, pdb_id, chain_id, start, end, tmpdir) + + def main(): import argparse diff --git a/tests/test_add_mmseqs2.py b/tests/test_add_mmseqs2.py index e238e42..340a78f 100644 --- a/tests/test_add_mmseqs2.py +++ b/tests/test_add_mmseqs2.py @@ -32,6 +32,7 @@ def test_add_msa_to_json(test_data): tmpdir = Path(tmpdir) add_msa_to_json( input_json=test_data.test_inputA_json, + mmseqs_db=None, templates=None, num_templates=20, chai_template_output=None, @@ -52,6 +53,7 @@ def test_add_msa_to_json(test_data): with pytest.raises(ValueError): add_msa_to_json( input_json=test_data.test_inputAB_json, + mmseqs_db=None, templates=None, num_templates=20, chai_template_output=None, @@ -64,6 +66,7 @@ def test_add_msa_to_json(test_data): with pytest.raises(FileNotFoundError): add_msa_to_json( input_json=test_data.test_inputAB_json, + mmseqs_db=None, templates=None, num_templates=20, chai_template_output=None, From 7ed8e69a25e528b6dd883847df0f4ab6bbe34cbf Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 21 May 2025 14:40:11 +0100 Subject: [PATCH 21/41] Fixed get_templates bug --- abcfold/scripts/add_mmseqs_msa.py | 6 ++++-- 1 file changed, 4 insertions(+), 2 deletions(-) diff --git a/abcfold/scripts/add_mmseqs_msa.py b/abcfold/scripts/add_mmseqs_msa.py index fea6e03..b243957 100644 --- a/abcfold/scripts/add_mmseqs_msa.py +++ b/abcfold/scripts/add_mmseqs_msa.py @@ -371,6 +371,7 @@ def download(ID, path): templates = get_templates( x, prefix, + "pdb70.m8", num_templates, ) @@ -726,6 +727,7 @@ def run_local_mmseqs( templates = get_templates( x, base, + "0.m8", num_templates, mmseqs_db=mmseqs_db, ) @@ -751,12 +753,12 @@ def get_a3m_lines(output_a3m): return a3m_lines -def get_templates(x, base, num_templates, mmseqs_db=None): +def get_templates(x, base, m8, num_templates, mmseqs_db=None): tested_pdbs = [] templates = [] logger.info("Finding and preparing templates") count = 0 - for line in open(base.joinpath("0.m8"), "r"): + for line in open(base.joinpath(m8), "r"): template = {} if count < num_templates: p = line.rstrip().split() From af442695c0e9035789f5100caa016eba4a0ff88b Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 21 May 2025 14:45:43 +0100 Subject: [PATCH 22/41] Fixed another get_templates issue --- abcfold/scripts/add_mmseqs_msa.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/abcfold/scripts/add_mmseqs_msa.py b/abcfold/scripts/add_mmseqs_msa.py index b243957..ff24b06 100644 --- a/abcfold/scripts/add_mmseqs_msa.py +++ b/abcfold/scripts/add_mmseqs_msa.py @@ -370,7 +370,7 @@ def download(ID, path): if use_templates: templates = get_templates( x, - prefix, + Path(prefix), "pdb70.m8", num_templates, ) From ea118e6b68fcf661650680418bec3c18a8984d4c Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 21 May 2025 15:21:06 +0100 Subject: [PATCH 23/41] Add check to iptm score parse to avoid monomer error --- abcfold/html/html_utils.py | 10 ++++++---- 1 file changed, 6 insertions(+), 4 deletions(-) diff --git a/abcfold/html/html_utils.py b/abcfold/html/html_utils.py index e269401..4bba6e4 100644 --- a/abcfold/html/html_utils.py +++ b/abcfold/html/html_utils.py @@ -254,11 +254,13 @@ def parse_scores(score_file: Union[ConfidenceJsonFile, NpzFile]) -> tuple: if isinstance(score_file, ConfidenceJsonFile): data = score_file.load_json_file() - ptm_score = round(float(data["ptm"]), 2) - iptm_score = round(float(data["iptm"]), 2) + if "ptm" in data and "iptm" not in data: + ptm_score = round(float(data["ptm"]), 2) + iptm_score = round(float(data["iptm"]), 2) elif isinstance(score_file, NpzFile): data = score_file.load_npz_file() - ptm_score = round(float(data["ptm"]), 2) - iptm_score = round(float(data["iptm"]), 2) + if "ptm" in data and "iptm" not in data: + ptm_score = round(float(data["ptm"]), 2) + iptm_score = round(float(data["iptm"]), 2) return ptm_score, iptm_score From 610af703893cba7e1aae0f06fe3d4a8d9a336575 Mon Sep 17 00:00:00 2001 From: hllelli2 Date: Wed, 21 May 2025 15:41:38 +0000 Subject: [PATCH 24/41] Fix issue with square brackets causing problems in the input yaml --- abcfold/boltz1/af3_to_boltz1.py | 1 + 1 file changed, 1 insertion(+) diff --git a/abcfold/boltz1/af3_to_boltz1.py b/abcfold/boltz1/af3_to_boltz1.py index c3e3d2e..f807270 100644 --- a/abcfold/boltz1/af3_to_boltz1.py +++ b/abcfold/boltz1/af3_to_boltz1.py @@ -234,6 +234,7 @@ def add_key_and_value(self, key: str, value: str): Returns: str: yaml string """ + value = f'"{value}"' return f"{DELIM}{DELIM}{key}: {value}\n" def add_ligand_information(self, ligand_dict: dict, linked_id=None): From 0c68f03f476a5f02474802c17690c2dcaaaf599a Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 21 May 2025 17:28:27 +0100 Subject: [PATCH 25/41] Update the readme and add the script to download MMseqs2 databases --- README.md | 12 +++- setup_mmseqs_databases.sh | 144 ++++++++++++++++++++++++++++++++++++++ 2 files changed, 155 insertions(+), 1 deletion(-) create mode 100644 setup_mmseqs_databases.sh diff --git a/README.md b/README.md index ec902fd..e25aaab 100644 --- a/README.md +++ b/README.md @@ -102,6 +102,7 @@ However, there you may wish to use the following flags to add run time options s - ``: Path to the output directory. - `-a`, `-b`, `-c` (`--alphafold3`, `--boltz1`,`--chai1`): Flags to run Alphafold3, Boltz-1 and Chai-1 respectively. If none of these flags are provided, Alphafold3 will be run by default. - `--mmseqs2`: [optional] Flag to use MMseqs2 MSAs and templates (if specified). +- `--mmseqs_database`: [optional] The path to the database used by a local copy of MMSeqs2, provided mmseqs is installed, the inclusion of this flag allows MMseqs2 to be run locally. - `--override`: [optional] Flag to override the existing output directory. - `--save_input`: [optional] Flag to save the input JSON file in the output directory. @@ -162,7 +163,6 @@ The output page will be available on `http://localhost:8000/index.html`. If you you will find `open_output.py` in your ``. This needs to be run from your ``. - ## Extra Features Below are scripts for adding MMseqs2 MSAs and custom templates to AlphaFold3 input JSON files. @@ -185,6 +185,16 @@ mmseqs2msa --input_json --output_json --templates --n - ``: Path to the input AlphaFold3 JSON file. - ``: [optional] Path to the output JSON file (default: ``_mmseqs.json). - ``: [optional] The number of templates to use (default: 20) +- ``: [optional] The path to the database used by a local copy of MMSeqs2, provided mmseqs is installed, the inclusion of this flag allows MMseqs2 to be run locally. + +> [!NOTE] +> If you need to install the mmseqs databases you can use setup_mmseqs_databases.sh +> This replicates the MMSeqs2 database setup from ColabFold + +``` +bash +MMSEQS_NO_INDEX=1 ./setup_mmseqs_databases.sh /path/to/db_folder +``` #### Without Templates diff --git a/setup_mmseqs_databases.sh b/setup_mmseqs_databases.sh new file mode 100644 index 0000000..5882c1c --- /dev/null +++ b/setup_mmseqs_databases.sh @@ -0,0 +1,144 @@ +#!/bin/bash -ex +# Setup everything for using mmseqs locally +# Set MMSEQS_NO_INDEX to skip the index creation step (not useful for colabfold_search in most cases) +ARIA_NUM_CONN=8 +WORKDIR="${1:-$(pwd)}" + +PDB_SERVER="${2:-"rsync.wwpdb.org::ftp"}" +PDB_PORT="${3:-"33444"}" +# do initial download of the PDB through aws? +# still syncs latest structures through rsync +PDB_AWS_DOWNLOAD="${4:-}" +PDB_AWS_SNAPSHOT="20240101" + +UNIREF30DB="uniref30_2302" +MMSEQS_NO_INDEX=${MMSEQS_NO_INDEX:-} +DOWNLOADS_ONLY=${DOWNLOADS_ONLY:-} +GPU=${GPU:-} +mkdir -p -- "${WORKDIR}" +cd "${WORKDIR}" + +hasCommand () { + command -v "$1" >/dev/null 2>&1 +} + +STRATEGY="" +if hasCommand aria2c; then STRATEGY="$STRATEGY ARIA"; fi +if hasCommand curl; then STRATEGY="$STRATEGY CURL"; fi +if hasCommand wget; then STRATEGY="$STRATEGY WGET"; fi +if [ "$STRATEGY" = "" ]; then + fail "No download tool found in PATH. Please install aria2c, curl or wget." +fi + +if [ -n "${PDB_AWS_DOWNLOAD}" ]; then + if ! hasCommand aws; then + fail "aws command not found in PATH. Please install the aws command line tool." + fi +fi + +downloadFile() { + URL="$1" + OUTPUT="$2" + set +e + for i in $STRATEGY; do + case "$i" in + ARIA) + FILENAME=$(basename "${OUTPUT}") + DIR=$(dirname "${OUTPUT}") + aria2c --max-connection-per-server="$ARIA_NUM_CONN" --allow-overwrite=true -o "$FILENAME" -d "$DIR" "$URL" && set -e && return 0 + ;; + CURL) + curl -L -o "$OUTPUT" "$URL" && set -e && return 0 + ;; + WGET) + wget -O "$OUTPUT" "$URL" && set -e && return 0 + ;; + esac + done + set -e + fail "Could not download $URL to $OUTPUT" +} + +if [ ! -f DOWNLOADS_READY ]; then + downloadFile "https://wwwuser.gwdg.de/~compbiol/colabfold/${UNIREF30DB}.tar.gz" "${UNIREF30DB}.tar.gz" + downloadFile "https://wwwuser.gwdg.de/~compbiol/colabfold/colabfold_envdb_202108.tar.gz" "colabfold_envdb_202108.tar.gz" + downloadFile "https://wwwuser.gwdg.de/~compbiol/colabfold/pdb100_230517.fasta.gz" "pdb100_230517.fasta.gz" + downloadFile "https://wwwuser.gwdg.de/~compbiol/data/hhsuite/databases/hhsuite_dbs/pdb100_foldseek_230517.tar.gz" "pdb100_foldseek_230517.tar.gz" + touch DOWNLOADS_READY +fi + +if [ ! -f PDB_MMCIF_READY ]; then + mkdir -p pdb/divided + mkdir -p pdb/obsolete + if [ -n "${PDB_AWS_DOWNLOAD}" ]; then + aws s3 cp --no-sign-request --recursive s3://pdbsnapshots/${PDB_AWS_SNAPSHOT}/pub/pdb/data/structures/divided/mmCIF/ pdb/divided/ + aws s3 cp --no-sign-request --recursive s3://pdbsnapshots/${PDB_AWS_SNAPSHOT}/pub/pdb/data/structures/obsolete/mmCIF/ pdb/obsolete/ + fi + rsync -rlpt -v -z --delete --port=${PDB_PORT} ${PDB_SERVER}/data/structures/divided/mmCIF/ pdb/divided + rsync -rlpt -v -z --delete --port=${PDB_PORT} ${PDB_SERVER}/data/structures/obsolete/mmCIF/ pdb/obsolete + touch PDB_MMCIF_READY +fi + +if [ -n "$DOWNLOADS_ONLY" ]; then + exit 0 +fi + + +# Make MMseqs2 merge the databases to avoid spamming the folder with files +export MMSEQS_FORCE_MERGE=1 + +GPU_PAR="" +GPU_INDEX_PAR="" +if [ -n "${GPU}" ]; then + GPU_PAR="--gpu 1" + GPU_INDEX_PAR=" --split 1 --index-subset 2" + + if ! mmseqs --help | grep -q 'gpuserver'; then + echo "The installed MMseqs2 has no GPU support, update to at least release 16" + exit 1 + fi +fi + +if [ ! -f UNIREF30_READY ]; then + tar xzvf "${UNIREF30DB}.tar.gz" + mmseqs tsv2exprofiledb "${UNIREF30DB}" "${UNIREF30DB}_db" ${GPU_PAR} + if [ -z "$MMSEQS_NO_INDEX" ]; then + mmseqs createindex "${UNIREF30DB}_db" tmp1 --remove-tmp-files 1 ${GPU_INDEX_PAR} + fi + if [ -e ${UNIREF30DB}_db_mapping ]; then + ln -sf ${UNIREF30DB}_db_mapping ${UNIREF30DB}_db.idx_mapping + fi + if [ -e ${UNIREF30DB}_db_taxonomy ]; then + ln -sf ${UNIREF30DB}_db_taxonomy ${UNIREF30DB}_db.idx_taxonomy + fi + touch UNIREF30_READY +fi + +if [ ! -f COLABDB_READY ]; then + tar xzvf "colabfold_envdb_202108.tar.gz" + mmseqs tsv2exprofiledb "colabfold_envdb_202108" "colabfold_envdb_202108_db" ${GPU_PAR} + # TODO: split memory value for createindex? + if [ -z "$MMSEQS_NO_INDEX" ]; then + mmseqs createindex "colabfold_envdb_202108_db" tmp2 --remove-tmp-files 1 ${GPU_INDEX_PAR} + fi + touch COLABDB_READY +fi + +if [ ! -f PDB_READY ]; then + if [ -n "${GPU}" ]; then + mmseqs createdb pdb100_230517.fasta.gz pdb100_230517_tmp + mmseqs makepaddedseqdb pdb100_230517_tmp pdb100_230517 + mmseqs rmdb pdb100_230517_tmp + else + mmseqs createdb pdb100_230517.fasta.gz pdb100_230517 + fi + if [ -z "$MMSEQS_NO_INDEX" ]; then + mmseqs createindex pdb100_230517 tmp3 --remove-tmp-files 1 ${GPU_INDEX_PAR} + fi + touch PDB_READY +fi + +if [ ! -f PDB100_READY ]; then + tar xzvf pdb100_foldseek_230517.tar.gz pdb100_a3m.ffdata pdb100_a3m.ffindex + touch PDB100_READY +fi From ecc80fbfafbf8c24fb24e88444793ef631e71952 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Wed, 21 May 2025 17:58:24 +0100 Subject: [PATCH 26/41] Fixed test --- tests/test_add_mmseqs2.py | 1 + 1 file changed, 1 insertion(+) diff --git a/tests/test_add_mmseqs2.py b/tests/test_add_mmseqs2.py index 340a78f..ea0bafe 100644 --- a/tests/test_add_mmseqs2.py +++ b/tests/test_add_mmseqs2.py @@ -13,6 +13,7 @@ def test_add_msa_to_json(test_data): input_dict = json.load(f) add_msa_to_json( input_json=test_data.test_inputA_json, + mmseqs_db=None, templates=test_data.test_6BJ9_cif, num_templates=20, chai_template_output=None, From b8e3ae5ab8e29fc189b1010ca49392723b4dce93 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Thu, 22 May 2025 13:06:17 +0100 Subject: [PATCH 27/41] Fixed bug in iptm/ptm scores --- abcfold/html/html_utils.py | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/abcfold/html/html_utils.py b/abcfold/html/html_utils.py index 4bba6e4..478c346 100644 --- a/abcfold/html/html_utils.py +++ b/abcfold/html/html_utils.py @@ -254,12 +254,12 @@ def parse_scores(score_file: Union[ConfidenceJsonFile, NpzFile]) -> tuple: if isinstance(score_file, ConfidenceJsonFile): data = score_file.load_json_file() - if "ptm" in data and "iptm" not in data: + if "ptm" in data and "iptm" in data: ptm_score = round(float(data["ptm"]), 2) iptm_score = round(float(data["iptm"]), 2) elif isinstance(score_file, NpzFile): data = score_file.load_npz_file() - if "ptm" in data and "iptm" not in data: + if "ptm" in data and "iptm" in data: ptm_score = round(float(data["ptm"]), 2) iptm_score = round(float(data["iptm"]), 2) From 8488acf87daa4da9d61a45f9a99390a51d5e9888 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Thu, 22 May 2025 13:57:40 +0100 Subject: [PATCH 28/41] Fix for nucleotide plddt score issue - this needs refining --- abcfold/output/file_handlers.py | 10 +++++++++- 1 file changed, 9 insertions(+), 1 deletion(-) diff --git a/abcfold/output/file_handlers.py b/abcfold/output/file_handlers.py index ebf12e7..86733a2 100644 --- a/abcfold/output/file_handlers.py +++ b/abcfold/output/file_handlers.py @@ -57,6 +57,7 @@ class ResidueCountType(Enum): AVERAGE = "average" CARBONALPHA = "carbonalpha" + PHOSPHATE = "phosphate" @classmethod def values(cls): @@ -187,6 +188,7 @@ def residue_plddts(self): """ The pLDDT scores for each residue in the model """ + self.__residue_plddts = [ plddts for plddts in self.get_plddt_per_residue().values() @@ -388,7 +390,7 @@ def get_plddt_per_atom(self) -> dict: return plddt - def get_plddt_per_residue(self, method=ResidueCountType.CARBONALPHA.value) -> dict: + def get_plddt_per_residue(self, method=ResidueCountType.AVERAGE.value) -> dict: """ Get the pLDDT scores for each residue in the model @@ -433,6 +435,12 @@ def get_plddt_per_residue(self, method=ResidueCountType.CARBONALPHA.value) -> di score = atom.bfactor break + elif method == ResidueCountType.PHOSPHATE.value: + for atom in residue: + if atom.id == "P": + score = atom.bfactor + break + if chain.id in plddts: plddts[chain.id].append(score) From 8d3160b3a91d5deddb5f91b3d515d4a2d71a151e Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Thu, 22 May 2025 14:23:02 +0100 Subject: [PATCH 29/41] Fixed test changes by luc's boltz fix --- tests/test_af3_to_boltz.py | 36 +++++++++++++++++++----------------- 1 file changed, 19 insertions(+), 17 deletions(-) diff --git a/tests/test_af3_to_boltz.py b/tests/test_af3_to_boltz.py index 7b029a1..3b4b8b8 100644 --- a/tests/test_af3_to_boltz.py +++ b/tests/test_af3_to_boltz.py @@ -23,10 +23,11 @@ def test_af3_to_boltz(test_data): assert yaml_string_multi[7] == f"{DELIM}{DELIM}sequence: YANEN" assert yaml_string_multi[8] == f"{DELIM}- ligand:" assert yaml_string_multi[9] == f"{DELIM}{DELIM}id: [D, E]" - assert yaml_string_multi[10] == f"{DELIM}{DELIM}ccd: ATP" + assert yaml_string_multi[10] == f'{DELIM}{DELIM}ccd: "ATP"' assert yaml_string_multi[11] == f"{DELIM}- ligand:" assert yaml_string_multi[12] == f"{DELIM}{DELIM}id: F" - assert yaml_string_multi[13] == f"{DELIM}{DELIM}smiles: CC(=O)OC1C[NH+]2CCC1CC2" + assert yaml_string_multi[13] == f'{DELIM}{DELIM}smiles: \ +"CC(=O)OC1C[NH+]2CCC1CC2"' yaml_string_bonds = boltz_yaml.json_to_yaml(test_data.test_inputA_json) yaml_string_bonds = yaml_string_bonds.split("\n") @@ -60,10 +61,11 @@ def test_af3_to_boltz(test_data): assert yaml_string_multi[7] == f"{DELIM}{DELIM}sequence: YANEN" assert yaml_string_multi[8] == f"{DELIM}- ligand:" assert yaml_string_multi[9] == f"{DELIM}{DELIM}id: [D, E]" - assert yaml_string_multi[10] == f"{DELIM}{DELIM}ccd: ATP" + assert yaml_string_multi[10] == f'{DELIM}{DELIM}ccd: "ATP"' assert yaml_string_multi[11] == f"{DELIM}- ligand:" assert yaml_string_multi[12] == f"{DELIM}{DELIM}id: F" - assert yaml_string_multi[13] == f"{DELIM}{DELIM}smiles: CC(=O)OC1C[NH+]2CCC1CC2" + assert yaml_string_multi[13] == f'{DELIM}{DELIM}smiles: \ +"CC(=O)OC1C[NH+]2CCC1CC2"' def test_boltz_output_yaml(test_data): @@ -161,16 +163,16 @@ def test_extra_ligand_ids(): assert yaml_string[15] == f"{DELIM}{DELIM}sequence: DVLMIQTPLSLPVS" assert yaml_string[16] == f"{DELIM}- ligand:" assert yaml_string[17] == f"{DELIM}{DELIM}id: [F]" - assert yaml_string[18] == f"{DELIM}{DELIM}ccd: ATP" + assert yaml_string[18] == f'{DELIM}{DELIM}ccd: "ATP"' assert yaml_string[19] == f"{DELIM}- ligand:" assert yaml_string[20] == f"{DELIM}{DELIM}id: I" - assert yaml_string[21] == f"{DELIM}{DELIM}ccd: NAG" + assert yaml_string[21] == f'{DELIM}{DELIM}ccd: "NAG"' assert yaml_string[22] == f"{DELIM}- ligand:" assert yaml_string[23] == f"{DELIM}{DELIM}id: E" - assert yaml_string[24] == f"{DELIM}{DELIM}ccd: FUC" + assert yaml_string[24] == f'{DELIM}{DELIM}ccd: "FUC"' assert yaml_string[25] == f"{DELIM}- ligand:" assert yaml_string[26] == f"{DELIM}{DELIM}id: G" - assert yaml_string[27] == f"{DELIM}{DELIM}ccd: FUC" + assert yaml_string[27] == f'{DELIM}{DELIM}ccd: "FUC"' assert yaml_string[28] == f"{DELIM}- dna:" assert yaml_string[29] == f"{DELIM}{DELIM}id: [D, K]" assert yaml_string[30] == f"{DELIM}{DELIM}sequence: AGCT" @@ -179,17 +181,17 @@ def test_extra_ligand_ids(): assert yaml_string[33] == f"{DELIM}{DELIM}sequence: AGCU" assert yaml_string[34] == f"{DELIM}- ligand:" assert yaml_string[35] == f"{DELIM}{DELIM}id: Z" - assert yaml_string[36] == f"{DELIM}{DELIM}smiles: CC(=O)OC1C[NH+]2CCC1CC2" + assert yaml_string[36] == f'{DELIM}{DELIM}smiles: "CC(=O)OC1C[NH+]2CCC1CC2"' assert yaml_string[37] == "constraints:" assert yaml_string[38] == f"{DELIM}- bond:" - assert yaml_string[39] == f"{DELIM}{DELIM}atom1: ['A', 1, 'CA']" - assert yaml_string[40] == f"{DELIM}{DELIM}atom2: ['B', 1, 'CA']" + assert yaml_string[39] == f'{DELIM}{DELIM}atom1: "[\'A\', 1, \'CA\']"' + assert yaml_string[40] == f'{DELIM}{DELIM}atom2: "[\'B\', 1, \'CA\']"' assert yaml_string[41] == f"{DELIM}- bond:" - assert yaml_string[42] == f"{DELIM}{DELIM}atom1: ['C', 7, 'CA']" - assert yaml_string[43] == f"{DELIM}{DELIM}atom2: ['A', 10, 'CA']" + assert yaml_string[42] == f'{DELIM}{DELIM}atom1: "[\'C\', 7, \'CA\']"' + assert yaml_string[43] == f'{DELIM}{DELIM}atom2: "[\'A\', 10, \'CA\']"' assert yaml_string[44] == f"{DELIM}- bond:" - assert yaml_string[45] == f"{DELIM}{DELIM}atom1: ['I', 1, 'O3']" - assert yaml_string[46] == f"{DELIM}{DELIM}atom2: ['E', 1, 'C1']" + assert yaml_string[45] == f'{DELIM}{DELIM}atom1: "[\'I\', 1, \'O3\']"' + assert yaml_string[46] == f'{DELIM}{DELIM}atom2: "[\'E\', 1, \'C1\']"' assert yaml_string[47] == f"{DELIM}- bond:" - assert yaml_string[48] == f"{DELIM}{DELIM}atom1: ['E', 1, 'C1']" - assert yaml_string[49] == f"{DELIM}{DELIM}atom2: ['G', 1, 'C1']" + assert yaml_string[48] == f'{DELIM}{DELIM}atom1: "[\'E\', 1, \'C1\']"' + assert yaml_string[49] == f'{DELIM}{DELIM}atom2: "[\'G\', 1, \'C1\']"' From bbdfe64252100fa97bee1ed969a5e985055c764d Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Fri, 23 May 2025 18:20:21 +0100 Subject: [PATCH 30/41] Added in code to make an output folder and superpose all models to the first in the list. Also fixed an indexing error in add_mmseqs_msa and a seperate broken test --- abcfold/abcfold.py | 23 +++++++++ abcfold/output/file_handlers.py | 49 +++++++++++++++++++ abcfold/scripts/add_mmseqs_msa.py | 78 +++++++++++++++---------------- tests/test_file_handlers.py | 34 +++++++------- 4 files changed, 127 insertions(+), 57 deletions(-) diff --git a/abcfold/abcfold.py b/abcfold/abcfold.py index bc05641..2993df7 100644 --- a/abcfold/abcfold.py +++ b/abcfold/abcfold.py @@ -24,6 +24,7 @@ from abcfold.output.alphafold3 import AlphafoldOutput from abcfold.output.boltz import BoltzOutput from abcfold.output.chai import ChaiOutput +from abcfold.output.file_handlers import superpose_models from abcfold.output.utils import (get_gap_indicies, insert_none_by_minus_one, make_dummy_m8_file) from abcfold.scripts.abc_script_utils import (check_input_json, make_dir, @@ -297,6 +298,28 @@ def run(args, config, defaults, config_file): alphafold_models["models"] + boltz_models["models"] + chai_models["models"] ) + # Make the output directory for the models + os.makedirs(args.output_dir.joinpath("output_models"), exist_ok=True) + output_models = [] + for model in combined_models: + cif_file = args.output_dir.joinpath(model["model_path"]) + if model["model_source"] == "AlphaFold3": + output_name = "af3_model_" + model["model_id"][-1] + ".cif" + elif model["model_source"] == "Boltz-1": + output_name = "boltz_model_" + model["model_id"][-1] + ".cif" + elif model["model_source"] == "Chai-1": + output_name = "chai_model_" + model["model_id"][-1] + ".cif" + shutil.copy( + cif_file, + args.output_dir.joinpath("output_models").joinpath(output_name), + ) + output_models.append( + args.output_dir.joinpath("output_models").joinpath(output_name) + ) + # Superpose the models + if len(output_models) > 1: + superpose_models(output_models) + sequence_data = get_model_sequence_data(cif_models) sequence = "" for key in sequence_data.keys(): diff --git a/abcfold/output/file_handlers.py b/abcfold/output/file_handlers.py index 86733a2..453364d 100644 --- a/abcfold/output/file_handlers.py +++ b/abcfold/output/file_handlers.py @@ -13,6 +13,7 @@ from Bio.PDB.kdtrees import KDTree from Bio.PDB.Polypeptide import is_aa from Bio.PDB.Residue import Residue +from Bio.PDB.Superimposer import Superimposer from Bio.SeqUtils import seq1 from abcfold.output.atoms import VANDERWALLS @@ -761,3 +762,51 @@ def load_json_file(self): data = json.load(f) return data + + +def superpose_models(models_list: List[Union[str, Path]]) -> None: + """ + Superpose the models in the list and save them to a new file + + Args: + models_list (List[Union[str, Path]]): List of models to superpose + + Returns: + None + """ + + parser = MMCIFParser(QUIET=True) + structure = parser.get_structure(Path(models_list[0]).stem, Path(models_list[0])) + ref_model = structure[0] + + for model in models_list[1:]: + alt_structure = parser.get_structure(Path(model).stem, Path(model)) + alt_model = alt_structure[0] + + ref_atoms = [] + alt_atoms = [] + for (ref_chain, alt_chain) in zip(ref_model, alt_model): + for ref_res, alt_res in zip(ref_chain, alt_chain): + assert ref_res.resname == alt_res.resname + assert ref_res.id == alt_res.id + + # Handle nucleotides and proteins differently + if ref_res.resname in ["DA", "DT", "DG", "DC"]: + ref_atoms.append(ref_res["C1'"]) + alt_atoms.append(alt_res["C1'"]) + elif ref_res.resname in ["A", "U", "G", "C", "T"]: + ref_atoms.append(ref_res["C1'"]) + alt_atoms.append(alt_res["C1'"]) + elif 'CA' in ref_res: + ref_atoms.append(ref_res['CA']) + alt_atoms.append(alt_res['CA']) + else: # Ignore anything else + pass + + super_imposer = Superimposer() + super_imposer.set_atoms(ref_atoms, alt_atoms) + super_imposer.apply(alt_model.get_atoms()) + + io = MMCIFIO() + io.set_structure(alt_structure) + io.save(str(model)) # overwrite the original file \ No newline at end of file diff --git a/abcfold/scripts/add_mmseqs_msa.py b/abcfold/scripts/add_mmseqs_msa.py index ff24b06..11e17d2 100644 --- a/abcfold/scripts/add_mmseqs_msa.py +++ b/abcfold/scripts/add_mmseqs_msa.py @@ -104,46 +104,46 @@ def add_msa_to_json( num_templates=num_templates, ) - for i in input_id: - table = pd.read_csv( - f"{tmpdir}/pdb70.m8", - delimiter="\t", - header=None, - names=[ - "query_id", - "subject_id", - "pident", - "length", - "mismatch", - "gapopen", - "query_start", - "query_end", - "subject_start", - "subject_end", - "evalue", - "bitscore", - "comment", - ], - ) + for i in input_id: + table = pd.read_csv( + f"{tmpdir}/pdb70.m8", + delimiter="\t", + header=None, + names=[ + "query_id", + "subject_id", + "pident", + "length", + "mismatch", + "gapopen", + "query_start", + "query_end", + "subject_start", + "subject_end", + "evalue", + "bitscore", + "comment", + ], + ) - table["query_id"] = i - - if chai_template_output: - if os.path.exists(chai_template_output): - table.to_csv( - chai_template_output, - sep="\t", - index=False, - header=False, - mode="a", - ) - else: - table.to_csv( - chai_template_output, - sep="\t", - index=False, - header=False, - ) + table["query_id"] = i + + if chai_template_output: + if os.path.exists(chai_template_output): + table.to_csv( + chai_template_output, + sep="\t", + index=False, + header=False, + mode="a", + ) + else: + table.to_csv( + chai_template_output, + sep="\t", + index=False, + header=False, + ) else: a3m_lines = run_mmseqs( diff --git a/tests/test_file_handlers.py b/tests/test_file_handlers.py index bbbbd8a..28969a4 100644 --- a/tests/test_file_handlers.py +++ b/tests/test_file_handlers.py @@ -35,24 +35,22 @@ def test_cif_file(test_data): assert cif_file.h_score == 89 plddt_regions_check = { - "v_low": [(0, 1), (393, 394)], - "low": [(2, 2), (395, 395)], - "confident": [ - (3, 3), - (134, 139), - (209, 211), - (396, 396), - (527, 532), - (601, 604), - ], - "v_high": [ - (4, 133), - (140, 208), - (212, 392), - (397, 526), - (533, 600), - (605, 787), - ], + 'v_low': [(0, 1), (393, 394)], + 'low': [(2, 2), (395, 395)], + 'confident': [ + (3, 4), (23, 23), (28, 28), (44, 44), (49, 49), (134, 141), (176, 176), + (180, 180), (200, 200), (206, 206), (208, 214), (217, 217), (228, 228), + (234, 234), (240, 240), (267, 267), (272, 272), (330, 330), (396, 397), + (416, 416), (421, 421), (437, 437), (442, 442), (527, 534), (569, 569), + (573, 573), (593, 593), (599, 599), (601, 607), (621, 621), (627, 627), + (633, 633), (660, 660), (665, 665), (723, 723)], + 'v_high': [ + (5, 22), (24, 27), (29, 43), (45, 48), (50, 133), (142, 175), (177, 179), + (181, 199), (201, 205), (207, 207), (215, 216), (218, 227), (229, 233), + (235, 239), (241, 266), (268, 271), (273, 329), (331, 392), (398, 415), + (417, 420), (422, 436), (438, 441), (443, 526), (535, 568), (570, 572), + (574, 592), (594, 598), (600, 600), (608, 620), (622, 626), (628, 632), + (634, 659), (661, 664), (666, 722), (724, 787)] } plddts = cif_file.residue_plddts plddt_regions = get_plddt_regions(plddts) From 50f5031b01ceb94d8529f035dd3d424014f3e4cd Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Fri, 23 May 2025 19:58:07 +0100 Subject: [PATCH 31/41] Updated version number --- pyproject.toml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/pyproject.toml b/pyproject.toml index b18340d..5aa9b2e 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -4,7 +4,7 @@ build-backend = "setuptools.build_meta" [project] name = "ABCFold" -version = "1.0.4" +version = "1.0.5" description = "Input processing tools for AlphaFold3, Boltz-1 and Chai-1" readme = "README.md" license = { text = "BSD License" } From 5b1a8c4878aa9734b7d25df301f76936630d43bc Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Fri, 23 May 2025 20:00:45 +0100 Subject: [PATCH 32/41] fixed flake8 error --- abcfold/output/file_handlers.py | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/abcfold/output/file_handlers.py b/abcfold/output/file_handlers.py index 453364d..394b0e8 100644 --- a/abcfold/output/file_handlers.py +++ b/abcfold/output/file_handlers.py @@ -800,7 +800,7 @@ def superpose_models(models_list: List[Union[str, Path]]) -> None: elif 'CA' in ref_res: ref_atoms.append(ref_res['CA']) alt_atoms.append(alt_res['CA']) - else: # Ignore anything else + else: # Ignore anything else pass super_imposer = Superimposer() @@ -809,4 +809,4 @@ def superpose_models(models_list: List[Union[str, Path]]) -> None: io = MMCIFIO() io.set_structure(alt_structure) - io.save(str(model)) # overwrite the original file \ No newline at end of file + io.save(str(model)) # overwrite the original file From b3d0b2446a72c3c9fd01522a11da78ea68d1fe63 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Fri, 23 May 2025 20:04:21 +0100 Subject: [PATCH 33/41] other precommit change --- tests/test_file_handlers.py | 26 +++++++++++++------------- 1 file changed, 13 insertions(+), 13 deletions(-) diff --git a/tests/test_file_handlers.py b/tests/test_file_handlers.py index 28969a4..7d3c675 100644 --- a/tests/test_file_handlers.py +++ b/tests/test_file_handlers.py @@ -35,21 +35,21 @@ def test_cif_file(test_data): assert cif_file.h_score == 89 plddt_regions_check = { - 'v_low': [(0, 1), (393, 394)], - 'low': [(2, 2), (395, 395)], + 'v_low': [(0, 1), (393, 394)], + 'low': [(2, 2), (395, 395)], 'confident': [ - (3, 4), (23, 23), (28, 28), (44, 44), (49, 49), (134, 141), (176, 176), - (180, 180), (200, 200), (206, 206), (208, 214), (217, 217), (228, 228), - (234, 234), (240, 240), (267, 267), (272, 272), (330, 330), (396, 397), - (416, 416), (421, 421), (437, 437), (442, 442), (527, 534), (569, 569), - (573, 573), (593, 593), (599, 599), (601, 607), (621, 621), (627, 627), - (633, 633), (660, 660), (665, 665), (723, 723)], + (3, 4), (23, 23), (28, 28), (44, 44), (49, 49), (134, 141), (176, 176), + (180, 180), (200, 200), (206, 206), (208, 214), (217, 217), (228, 228), + (234, 234), (240, 240), (267, 267), (272, 272), (330, 330), (396, 397), + (416, 416), (421, 421), (437, 437), (442, 442), (527, 534), (569, 569), + (573, 573), (593, 593), (599, 599), (601, 607), (621, 621), (627, 627), + (633, 633), (660, 660), (665, 665), (723, 723)], 'v_high': [ - (5, 22), (24, 27), (29, 43), (45, 48), (50, 133), (142, 175), (177, 179), - (181, 199), (201, 205), (207, 207), (215, 216), (218, 227), (229, 233), - (235, 239), (241, 266), (268, 271), (273, 329), (331, 392), (398, 415), - (417, 420), (422, 436), (438, 441), (443, 526), (535, 568), (570, 572), - (574, 592), (594, 598), (600, 600), (608, 620), (622, 626), (628, 632), + (5, 22), (24, 27), (29, 43), (45, 48), (50, 133), (142, 175), (177, 179), + (181, 199), (201, 205), (207, 207), (215, 216), (218, 227), (229, 233), + (235, 239), (241, 266), (268, 271), (273, 329), (331, 392), (398, 415), + (417, 420), (422, 436), (438, 441), (443, 526), (535, 568), (570, 572), + (574, 592), (594, 598), (600, 600), (608, 620), (622, 626), (628, 632), (634, 659), (661, 664), (666, 722), (724, 787)] } plddts = cif_file.residue_plddts From 920a8332634e96e247f81521b5f8e45ad7cd718b Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Fri, 23 May 2025 20:39:34 +0100 Subject: [PATCH 34/41] Fixing tests --- tests/test_file_handlers.py | 32 ++++++++++++++++---------------- 1 file changed, 16 insertions(+), 16 deletions(-) diff --git a/tests/test_file_handlers.py b/tests/test_file_handlers.py index 7d3c675..978ef61 100644 --- a/tests/test_file_handlers.py +++ b/tests/test_file_handlers.py @@ -35,22 +35,22 @@ def test_cif_file(test_data): assert cif_file.h_score == 89 plddt_regions_check = { - 'v_low': [(0, 1), (393, 394)], - 'low': [(2, 2), (395, 395)], - 'confident': [ - (3, 4), (23, 23), (28, 28), (44, 44), (49, 49), (134, 141), (176, 176), - (180, 180), (200, 200), (206, 206), (208, 214), (217, 217), (228, 228), - (234, 234), (240, 240), (267, 267), (272, 272), (330, 330), (396, 397), - (416, 416), (421, 421), (437, 437), (442, 442), (527, 534), (569, 569), - (573, 573), (593, 593), (599, 599), (601, 607), (621, 621), (627, 627), - (633, 633), (660, 660), (665, 665), (723, 723)], - 'v_high': [ - (5, 22), (24, 27), (29, 43), (45, 48), (50, 133), (142, 175), (177, 179), - (181, 199), (201, 205), (207, 207), (215, 216), (218, 227), (229, 233), - (235, 239), (241, 266), (268, 271), (273, 329), (331, 392), (398, 415), - (417, 420), (422, 436), (438, 441), (443, 526), (535, 568), (570, 572), - (574, 592), (594, 598), (600, 600), (608, 620), (622, 626), (628, 632), - (634, 659), (661, 664), (666, 722), (724, 787)] + 'v_low': [(0, 1), (393, 394)], + 'low': [(2, 2), (395, 395)], + 'confident': [(3, 4), (23, 23), (28, 28), (44, 44), (49, 49), (134, 141), + (176, 176), (180, 180), (200, 200), (206, 206), (208, 214), + (228, 228), (234, 234), (240, 240), (267, 267), (272, 272), + (330, 330), (396, 397), (416, 416), (421, 421), (437, 437), + (442, 442), (527, 534), (569, 569), (573, 573), (593, 593), + (599, 599), (601, 607), (610, 610), (621, 621), (627, 627), + (633, 633), (660, 660), (665, 665), (723, 723)], + 'v_high': [(5, 22), (24, 27), (29, 43), (45, 48), (50, 133), (142, 175), + (177, 179), (181, 199), (201, 205), (207, 207), (215, 227), + (229, 233), (235, 239), (241, 266), (268, 271), (273, 329), + (331, 392), (398, 415), (417, 420), (422, 436), (438, 441), + (443, 526), (535, 568), (570, 572), (574, 592), (594, 598), + (600, 600), (608, 609), (611, 620), (622, 626), (628, 632), + (634, 659), (661, 664), (666, 722), (724, 787)] } plddts = cif_file.residue_plddts plddt_regions = get_plddt_regions(plddts) From 4dbb5e6be7c83e9a6b28bf92bc35ac3ec024975b Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Fri, 23 May 2025 20:48:22 +0100 Subject: [PATCH 35/41] fix? --- tests/test_file_handlers.py | 30 +++++++++++++++--------------- 1 file changed, 15 insertions(+), 15 deletions(-) diff --git a/tests/test_file_handlers.py b/tests/test_file_handlers.py index 978ef61..2b91a40 100644 --- a/tests/test_file_handlers.py +++ b/tests/test_file_handlers.py @@ -35,21 +35,21 @@ def test_cif_file(test_data): assert cif_file.h_score == 89 plddt_regions_check = { - 'v_low': [(0, 1), (393, 394)], - 'low': [(2, 2), (395, 395)], - 'confident': [(3, 4), (23, 23), (28, 28), (44, 44), (49, 49), (134, 141), - (176, 176), (180, 180), (200, 200), (206, 206), (208, 214), - (228, 228), (234, 234), (240, 240), (267, 267), (272, 272), - (330, 330), (396, 397), (416, 416), (421, 421), (437, 437), - (442, 442), (527, 534), (569, 569), (573, 573), (593, 593), - (599, 599), (601, 607), (610, 610), (621, 621), (627, 627), - (633, 633), (660, 660), (665, 665), (723, 723)], - 'v_high': [(5, 22), (24, 27), (29, 43), (45, 48), (50, 133), (142, 175), - (177, 179), (181, 199), (201, 205), (207, 207), (215, 227), - (229, 233), (235, 239), (241, 266), (268, 271), (273, 329), - (331, 392), (398, 415), (417, 420), (422, 436), (438, 441), - (443, 526), (535, 568), (570, 572), (574, 592), (594, 598), - (600, 600), (608, 609), (611, 620), (622, 626), (628, 632), + 'v_low': [(0, 1), (393, 394)], + 'low': [(2, 2), (395, 395)], + 'confident': [(3, 4), (23, 23), (28, 28), (44, 44), (49, 49), (134, 141), + (176, 176), (180, 180), (200, 200), (206, 206), (208, 214), + (228, 228), (234, 234), (240, 240), (267, 267), (272, 272), + (330, 330), (396, 397), (416, 416), (421, 421), (437, 437), + (442, 442), (527, 534), (569, 569), (573, 573), (593, 593), + (599, 599), (601, 607), (610, 610), (621, 621), (627, 627), + (633, 633), (660, 660), (665, 665), (723, 723)], + 'v_high': [(5, 22), (24, 27), (29, 43), (45, 48), (50, 133), (142, 175), + (177, 179), (181, 199), (201, 205), (207, 207), (215, 227), + (229, 233), (235, 239), (241, 266), (268, 271), (273, 329), + (331, 392), (398, 415), (417, 420), (422, 436), (438, 441), + (443, 526), (535, 568), (570, 572), (574, 592), (594, 598), + (600, 600), (608, 609), (611, 620), (622, 626), (628, 632), (634, 659), (661, 664), (666, 722), (724, 787)] } plddts = cif_file.residue_plddts From f5be8a7c21fac1600a283d4633445dd5b2e522f4 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Sun, 25 May 2025 10:24:17 +0100 Subject: [PATCH 36/41] fixed issue in superposition --- abcfold/output/file_handlers.py | 23 ++++++++++++++--------- 1 file changed, 14 insertions(+), 9 deletions(-) diff --git a/abcfold/output/file_handlers.py b/abcfold/output/file_handlers.py index 394b0e8..c1c3534 100644 --- a/abcfold/output/file_handlers.py +++ b/abcfold/output/file_handlers.py @@ -787,8 +787,8 @@ def superpose_models(models_list: List[Union[str, Path]]) -> None: alt_atoms = [] for (ref_chain, alt_chain) in zip(ref_model, alt_model): for ref_res, alt_res in zip(ref_chain, alt_chain): - assert ref_res.resname == alt_res.resname - assert ref_res.id == alt_res.id + if ref_res.resname != alt_res.resname or ref_res.id != alt_res.id: + pass # Handle nucleotides and proteins differently if ref_res.resname in ["DA", "DT", "DG", "DC"]: @@ -802,11 +802,16 @@ def superpose_models(models_list: List[Union[str, Path]]) -> None: alt_atoms.append(alt_res['CA']) else: # Ignore anything else pass + + if len(ref_atoms) == 0 or len(alt_atoms) == 0: + logger.warning( + f"No matching atoms found for superposition in {model}. Skipping." + ) + else: + super_imposer = Superimposer() + super_imposer.set_atoms(ref_atoms, alt_atoms) + super_imposer.apply(alt_model.get_atoms()) - super_imposer = Superimposer() - super_imposer.set_atoms(ref_atoms, alt_atoms) - super_imposer.apply(alt_model.get_atoms()) - - io = MMCIFIO() - io.set_structure(alt_structure) - io.save(str(model)) # overwrite the original file + io = MMCIFIO() + io.set_structure(alt_structure) + io.save(str(model)) # overwrite the original file From 578468856b2b07502d544c2b57685e050e1f911d Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Sun, 25 May 2025 10:30:04 +0100 Subject: [PATCH 37/41] ... --- abcfold/output/file_handlers.py | 4 ++++ 1 file changed, 4 insertions(+) diff --git a/abcfold/output/file_handlers.py b/abcfold/output/file_handlers.py index c1c3534..d2a086a 100644 --- a/abcfold/output/file_handlers.py +++ b/abcfold/output/file_handlers.py @@ -815,3 +815,7 @@ def superpose_models(models_list: List[Union[str, Path]]) -> None: io = MMCIFIO() io.set_structure(alt_structure) io.save(str(model)) # overwrite the original file + + + + From d6708cd69261dc17bacc801b39438b5fa1d2f597 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Sun, 25 May 2025 10:31:13 +0100 Subject: [PATCH 38/41] ... --- abcfold/output/file_handlers.py | 6 +----- 1 file changed, 1 insertion(+), 5 deletions(-) diff --git a/abcfold/output/file_handlers.py b/abcfold/output/file_handlers.py index d2a086a..61fffaa 100644 --- a/abcfold/output/file_handlers.py +++ b/abcfold/output/file_handlers.py @@ -802,7 +802,7 @@ def superpose_models(models_list: List[Union[str, Path]]) -> None: alt_atoms.append(alt_res['CA']) else: # Ignore anything else pass - + if len(ref_atoms) == 0 or len(alt_atoms) == 0: logger.warning( f"No matching atoms found for superposition in {model}. Skipping." @@ -815,7 +815,3 @@ def superpose_models(models_list: List[Union[str, Path]]) -> None: io = MMCIFIO() io.set_structure(alt_structure) io.save(str(model)) # overwrite the original file - - - - From 1d98c368800124e20fda7ca4db4d7173cdc559b3 Mon Sep 17 00:00:00 2001 From: hlasimpk Date: Tue, 27 May 2025 17:29:52 +0100 Subject: [PATCH 39/41] Added some changes suggested by Luc --- README.md | 2 +- abcfold/html/html_utils.py | 3 ++- tests/test_file_handlers.py | 51 +++++++++++++++++++++++++++++++++++++ 3 files changed, 54 insertions(+), 2 deletions(-) diff --git a/README.md b/README.md index e25aaab..f7ced0d 100644 --- a/README.md +++ b/README.md @@ -295,7 +295,7 @@ If modelling multiple copies of the same sequence in Boltz-1, the input JSON mus "version": 1 } -If the sequences are given as seperate entities (as shown below) you will encounter an error. +If the identical sequences are given as seperate entities (as shown below) you will encounter an error. ```json { diff --git a/abcfold/html/html_utils.py b/abcfold/html/html_utils.py index 478c346..ce43796 100644 --- a/abcfold/html/html_utils.py +++ b/abcfold/html/html_utils.py @@ -112,10 +112,11 @@ def get_model_data(model, plot_dict, method, plddt_scores, score_file, output_di """ regions = get_plddt_regions(plddt_scores) ptm_score, iptm_score = parse_scores(score_file) + model_path = Path(model.pathway).relative_to(output_dir) model_data = { "model_id": model.name, "model_source": method, - "model_path": "/".join(Path(model.pathway).parts[1:]), + "model_path": model_path.as_posix(), "plddt_regions": regions, "avg_plddt": model.average_plddt, "h_score": model.h_score, diff --git a/tests/test_file_handlers.py b/tests/test_file_handlers.py index 2b91a40..7b89361 100644 --- a/tests/test_file_handlers.py +++ b/tests/test_file_handlers.py @@ -1,3 +1,5 @@ +import shutil +import tempfile from pathlib import Path import pytest @@ -77,3 +79,52 @@ def test_confidence_json_file(test_data): assert "atom_plddts" in confidence_file.data assert "contact_probs" in confidence_file.data assert "pae" in confidence_file.data + + +def test_superpose_models(test_data): + """ + Test the superpose_models function to ensure it correctly superposes two CifFiles. + """ + + with tempfile.TemporaryDirectory() as temp_dir: + model_1 = Path(test_data.test_alphafold3_6BJ9_).joinpath( + "seed-1_sample-0/model.cif" + ) + model_2 = Path(test_data.test_boltz_1_6BJ9_).joinpath( + "predictions/test_mmseqs/test_mmseqs_model_0.cif" + ) + + shutil.copyfile(model_1, f"{temp_dir}/model_1.cif") + shutil.copyfile(model_2, f"{temp_dir}/model_2.cif") + + models = [ + Path(f"{temp_dir}/model_1.cif"), + Path(f"{temp_dir}/model_2.cif") + ] + file_handlers.superpose_models(models) + + superposed_atoms = [] + count = 0 + with open(f"{temp_dir}/model_2.cif", "r") as f: + for line in f: + if line.startswith("ATOM"): + fields = line.split() + if count <= 10: + superposed_atoms.append([fields[10], fields[11], fields[12]]) + count += 1 + + ref_superposed_atoms = [ + ['10.299', '-14.127', '6.666'], + ['10.620', '-15.139', '7.638'], + ['10.542', '-14.683', '9.078'], + ['11.084', '-13.621', '9.438'], + ['9.916', '-15.513', '9.869'], + ['9.715', '-15.192', '11.280'], + ['10.118', '-16.294', '12.262'], + ['10.804', '-16.028', '13.251'], + ['8.250', '-14.827', '11.552'], + ['7.400', '-15.896', '11.121'], + ['7.871', '-13.566', '10.742'] + ] + + assert ref_superposed_atoms == superposed_atoms From 9378d069ae476eaa88957b91ee2138bc23d227b2 Mon Sep 17 00:00:00 2001 From: hllelli2 Date: Wed, 28 May 2025 13:54:32 +0000 Subject: [PATCH 40/41] Local AF3 test was waiting for sub process call error but with addtion of af3_error.log, this wasn't happening. Instead new test read the log file and passes if it's the right error message. --- tests/test_run_alphafold3.py | 40 ++++++++++++------------------------ 1 file changed, 13 insertions(+), 27 deletions(-) diff --git a/tests/test_run_alphafold3.py b/tests/test_run_alphafold3.py index d0cba67..f557935 100644 --- a/tests/test_run_alphafold3.py +++ b/tests/test_run_alphafold3.py @@ -1,10 +1,11 @@ import os -import subprocess +import tempfile from pathlib import Path import pytest from abcfold.alphafold3.run_alphafold3 import generate_af3_cmd, run_alphafold3 +from abcfold.scripts.abc_script_utils import make_dummy_af3_db def test_generate_af3_command(test_data): @@ -47,7 +48,7 @@ def test_generate_af3_singularity_command(test_data): model_params=model_params, database_dir=database_dir, sif_path=sif_path, - interactive=True + interactive=True, ) assert "singularity exec" in cmd @@ -67,11 +68,12 @@ def test_generate_af3_singularity_command(test_data): @pytest.mark.skipif(os.getenv("CI") == "true", reason="Skipping test in CI environment") def test_run_af3(test_data): input_json = Path(test_data.test_inputA_json) - output_dir = Path("/road/to/nowhere") - model_params = Path("/road/to/nowhere") - database_dir = Path("/road/to/nowhere") + with tempfile.TemporaryDirectory() as temp_dir_str: + temp_dir = Path(temp_dir_str) + output_dir = temp_dir / "af3_output" + model_params = temp_dir / "af3_output" + database_dir = make_dummy_af3_db(temp_dir) - with pytest.raises(subprocess.CalledProcessError): run_alphafold3( input_json, output_dir, @@ -80,24 +82,8 @@ def test_run_af3(test_data): sif_path=None, interactive=False, ) - - cmd = generate_af3_cmd( - input_json=input_json, - output_dir=output_dir, - model_params=model_params, - database_dir=database_dir, - sif_path=None, - interactive=False, - ) - - with subprocess.Popen( - cmd, shell=True, stdout=subprocess.PIPE, stderr=subprocess.PIPE - ) as p: - _, stderr = p.communicate() - assert p.returncode == 126 - print(stderr.decode()) - assert ( - "Error response from daemon: error while creating mount source path \ -'/road/to/nowhere': mkdir /road: permission denied" - in stderr.decode() - ) + assert output_dir.exists() + assert (output_dir / "af3_error.log").exists() + with open(output_dir / "af3_error.log", "r") as f: + error_log = f.read() + assert "No models matched in /root/models" in error_log From cb2b2052d827307c39d4fc4acf7b4242316dd0f4 Mon Sep 17 00:00:00 2001 From: hllelli2 Date: Wed, 28 May 2025 15:56:16 +0000 Subject: [PATCH 41/41] Fixed superpose test --- .../alphafold3_6BJ9/seed-1_sample-0/model.cif | 11724 ++++++++-------- tests/test_file_handlers.py | 123 +- tests/test_utilities.py | 2 + 3 files changed, 5956 insertions(+), 5893 deletions(-) diff --git a/tests/test_data/alphafold3_6BJ9/seed-1_sample-0/model.cif b/tests/test_data/alphafold3_6BJ9/seed-1_sample-0/model.cif index d4cc9f6..31e8b09 100644 --- a/tests/test_data/alphafold3_6BJ9/seed-1_sample-0/model.cif +++ b/tests/test_data/alphafold3_6BJ9/seed-1_sample-0/model.cif @@ -19,5866 +19,5866 @@ _atom_site.B_iso_or_equiv _atom_site.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num -ATOM 1 N N . GLY B ? 1 ? 14.919 -12.086 19.001 1.0 34.02 1 B 1 -ATOM 2 C CA . GLY B ? 1 ? 14.481 -13.169 19.914 1.0 34.32 1 B 1 -ATOM 3 C C . GLY B ? 1 ? 13.514 -14.081 19.196 1.0 36.5 1 B 1 -ATOM 4 O O . GLY B ? 1 ? 12.933 -13.670 18.203 1.0 34.3 1 B 1 -ATOM 5 N N . THR B ? 2 ? 13.353 -15.317 19.684 1.0 41.5 2 B 1 -ATOM 6 C CA . THR B ? 2 ? 12.496 -16.327 19.030 1.0 41.3 2 B 1 -ATOM 7 C C . THR B ? 2 ? 10.995 -16.153 19.288 1.0 43.27 2 B 1 -ATOM 8 O O . THR B ? 2 ? 10.188 -16.829 18.658 1.0 40.29 2 B 1 -ATOM 9 C CB . THR B ? 2 ? 12.911 -17.738 19.488 1.0 37.13 2 B 1 -ATOM 10 O OG1 . THR B ? 2 ? 13.072 -17.748 20.898 1.0 34.67 2 B 1 -ATOM 11 C CG2 . THR B ? 2 ? 14.251 -18.171 18.890 1.0 33.69 2 B 1 -ATOM 12 N N . GLY B ? 3 ? 10.610 -15.294 20.225 1.0 55.52 3 B 1 -ATOM 13 C CA . GLY B ? 3 ? 9.215 -14.994 20.553 1.0 57.4 3 B 1 -ATOM 14 C C . GLY B ? 3 ? 8.780 -13.638 20.008 1.0 62.58 3 B 1 -ATOM 15 O O . GLY B ? 3 ? 9.611 -12.752 19.799 1.0 58.39 3 B 1 -ATOM 16 N N . SER B ? 4 ? 7.474 -13.460 19.840 1.0 75.71 4 B 1 -ATOM 17 C CA . SER B ? 4 ? 6.919 -12.135 19.560 1.0 81.58 4 B 1 -ATOM 18 C C . SER B ? 4 ? 7.028 -11.241 20.777 1.0 87.01 4 B 1 -ATOM 19 O O . SER B ? 4 ? 6.842 -11.679 21.915 1.0 82.92 4 B 1 -ATOM 20 C CB . SER B ? 4 ? 5.447 -12.176 19.159 1.0 71.8 4 B 1 -ATOM 21 O OG . SER B ? 4 ? 4.689 -12.889 20.122 1.0 63.39 4 B 1 -ATOM 22 N N . ARG B ? 5 ? 7.214 -9.966 20.520 1.0 89.37 5 B 1 -ATOM 23 C CA . ARG B ? 5 ? 7.079 -8.938 21.549 1.0 92.12 5 B 1 -ATOM 24 C C . ARG B ? 5 ? 5.608 -8.762 21.929 1.0 94.17 5 B 1 -ATOM 25 O O . ARG B ? 5 ? 4.729 -8.861 21.064 1.0 92.87 5 B 1 -ATOM 26 C CB . ARG B ? 5 ? 7.685 -7.633 21.038 1.0 90.43 5 B 1 -ATOM 27 C CG . ARG B ? 5 ? 9.199 -7.770 20.844 1.0 87.84 5 B 1 -ATOM 28 C CD . ARG B ? 5 ? 9.771 -6.489 20.262 1.0 84.71 5 B 1 -ATOM 29 N NE . ARG B ? 5 ? 11.219 -6.614 20.076 1.0 85.37 5 B 1 -ATOM 30 C CZ . ARG B ? 5 ? 12.165 -6.258 20.926 1.0 86.52 5 B 1 -ATOM 31 N NH1 . ARG B ? 5 ? 11.909 -5.649 22.046 1.0 78.94 5 B 1 -ATOM 32 N NH2 . ARG B ? 5 ? 13.399 -6.519 20.640 1.0 81.92 5 B 1 -ATOM 33 N N . PRO B ? 6 ? 5.316 -8.471 23.213 1.0 93.6 6 B 1 -ATOM 34 C CA . PRO B ? 6 ? 3.979 -8.028 23.579 1.0 94.71 6 B 1 -ATOM 35 C C . PRO B ? 6 ? 3.650 -6.723 22.843 1.0 96.13 6 B 1 -ATOM 36 O O . PRO B ? 6 ? 4.535 -5.919 22.543 1.0 95.47 6 B 1 -ATOM 37 C CB . PRO B ? 6 ? 4.010 -7.855 25.099 1.0 92.83 6 B 1 -ATOM 38 C CG . PRO B ? 6 ? 5.478 -7.528 25.390 1.0 91.39 6 B 1 -ATOM 39 C CD . PRO B ? 6 ? 6.232 -8.341 24.338 1.0 93.58 6 B 1 -ATOM 40 N N . ILE B ? 7 ? 2.371 -6.471 22.600 1.0 95.83 7 B 1 -ATOM 41 C CA . ILE B ? 7 ? 1.912 -5.246 21.921 1.0 96.93 7 B 1 -ATOM 42 C C . ILE B ? 7 ? 2.434 -3.966 22.598 1.0 97.61 7 B 1 -ATOM 43 O O . ILE B ? 7 ? 2.727 -2.980 21.929 1.0 96.96 7 B 1 -ATOM 44 C CB . ILE B ? 7 ? 0.373 -5.268 21.825 1.0 96.08 7 B 1 -ATOM 45 C CG1 . ILE B ? 7 ? -0.206 -4.121 20.966 1.0 90.71 7 B 1 -ATOM 46 C CG2 . ILE B ? 7 ? -0.315 -5.224 23.210 1.0 90.06 7 B 1 -ATOM 47 C CD1 . ILE B ? 7 ? 0.219 -4.156 19.515 1.0 84.25 7 B 1 -ATOM 48 N N . THR B ? 8 ? 2.628 -4.010 23.923 1.0 95.31 8 B 1 -ATOM 49 C CA . THR B ? 8 ? 3.122 -2.889 24.739 1.0 95.83 8 B 1 -ATOM 50 C C . THR B ? 8 ? 4.595 -2.540 24.504 1.0 97.06 8 B 1 -ATOM 51 O O . THR B ? 8 ? 5.037 -1.483 24.953 1.0 96.22 8 B 1 -ATOM 52 C CB . THR B ? 8 ? 2.911 -3.183 26.228 1.0 94.37 8 B 1 -ATOM 53 O OG1 . THR B ? 8 ? 3.440 -4.450 26.563 1.0 91.4 8 B 1 -ATOM 54 C CG2 . THR B ? 8 ? 1.424 -3.203 26.588 1.0 90.31 8 B 1 -ATOM 55 N N . ASP B ? 9 ? 5.354 -3.378 23.795 1.0 96.68 9 B 1 -ATOM 56 C CA . ASP B ? 9 ? 6.716 -3.057 23.353 1.0 97.4 9 B 1 -ATOM 57 C C . ASP B ? 9 ? 6.736 -2.148 22.116 1.0 98.13 9 B 1 -ATOM 58 O O . ASP B ? 9 ? 7.767 -1.549 21.812 1.0 97.68 9 B 1 -ATOM 59 C CB . ASP B ? 9 ? 7.506 -4.339 23.061 1.0 96.21 9 B 1 -ATOM 60 C CG . ASP B ? 9 ? 8.168 -4.975 24.282 1.0 91.64 9 B 1 -ATOM 61 O OD1 . ASP B ? 9 ? 7.871 -4.568 25.427 1.0 87.59 9 B 1 -ATOM 62 O OD2 . ASP B ? 9 ? 9.013 -5.873 24.045 1.0 87.27 9 B 1 -ATOM 63 N N . VAL B ? 10 ? 5.610 -2.022 21.413 1.0 98.33 10 B 1 -ATOM 64 C CA . VAL B ? 10 ? 5.464 -1.102 20.281 1.0 98.6 10 B 1 -ATOM 65 C C . VAL B ? 10 ? 5.210 0.308 20.808 1.0 98.74 10 B 1 -ATOM 66 O O . VAL B ? 10 ? 4.217 0.563 21.490 1.0 98.66 10 B 1 -ATOM 67 C CB . VAL B ? 10 ? 4.342 -1.543 19.325 1.0 98.45 10 B 1 -ATOM 68 C CG1 . VAL B ? 10 ? 4.190 -0.565 18.154 1.0 97.87 10 B 1 -ATOM 69 C CG2 . VAL B ? 10 ? 4.622 -2.935 18.742 1.0 97.89 10 B 1 -ATOM 70 N N . VAL B ? 11 ? 6.090 1.236 20.457 1.0 98.77 11 B 1 -ATOM 71 C CA . VAL B ? 11 ? 6.019 2.633 20.897 1.0 98.84 11 B 1 -ATOM 72 C C . VAL B ? 11 ? 6.024 3.609 19.722 1.0 98.9 11 B 1 -ATOM 73 O O . VAL B ? 11 ? 6.695 3.401 18.712 1.0 98.86 11 B 1 -ATOM 74 C CB . VAL B ? 11 ? 7.125 2.981 21.915 1.0 98.67 11 B 1 -ATOM 75 C CG1 . VAL B ? 11 ? 6.955 2.184 23.212 1.0 97.89 11 B 1 -ATOM 76 C CG2 . VAL B ? 11 ? 8.550 2.754 21.390 1.0 97.44 11 B 1 -ATOM 77 N N . PHE B ? 12 ? 5.298 4.707 19.886 1.0 98.91 12 B 1 -ATOM 78 C CA . PHE B ? 12 ? 5.383 5.886 19.034 1.0 98.93 12 B 1 -ATOM 79 C C . PHE B ? 12 ? 6.471 6.808 19.580 1.0 98.91 12 B 1 -ATOM 80 O O . PHE B ? 12 ? 6.466 7.140 20.765 1.0 98.75 12 B 1 -ATOM 81 C CB . PHE B ? 12 ? 4.032 6.603 18.990 1.0 98.91 12 B 1 -ATOM 82 C CG . PHE B ? 12 ? 2.900 5.753 18.453 1.0 98.91 12 B 1 -ATOM 83 C CD1 . PHE B ? 12 ? 2.626 5.736 17.077 1.0 98.7 12 B 1 -ATOM 84 C CD2 . PHE B ? 12 ? 2.125 4.961 19.324 1.0 98.67 12 B 1 -ATOM 85 C CE1 . PHE B ? 12 ? 1.582 4.945 16.571 1.0 98.56 12 B 1 -ATOM 86 C CE2 . PHE B ? 12 ? 1.083 4.162 18.821 1.0 98.53 12 B 1 -ATOM 87 C CZ . PHE B ? 12 ? 0.813 4.157 17.444 1.0 98.73 12 B 1 -ATOM 88 N N . VAL B ? 13 ? 7.386 7.232 18.722 1.0 98.91 13 B 1 -ATOM 89 C CA . VAL B ? 13 ? 8.470 8.166 19.071 1.0 98.88 13 B 1 -ATOM 90 C C . VAL B ? 13 ? 8.336 9.520 18.374 1.0 98.84 13 B 1 -ATOM 91 O O . VAL B ? 13 ? 8.986 10.481 18.768 1.0 98.46 13 B 1 -ATOM 92 C CB . VAL B ? 13 ? 9.859 7.548 18.829 1.0 98.74 13 B 1 -ATOM 93 C CG1 . VAL B ? 13 ? 10.112 6.376 19.780 1.0 98.01 13 B 1 -ATOM 94 C CG2 . VAL B ? 13 ? 10.056 7.058 17.384 1.0 97.7 13 B 1 -ATOM 95 N N . GLY B ? 14 ? 7.466 9.618 17.372 1.0 98.81 14 B 1 -ATOM 96 C CA . GLY B ? 14 ? 7.154 10.868 16.685 1.0 98.83 14 B 1 -ATOM 97 C C . GLY B ? 14 ? 5.850 10.787 15.906 1.0 98.91 14 B 1 -ATOM 98 O O . GLY B ? 14 ? 5.439 9.716 15.464 1.0 98.82 14 B 1 -ATOM 99 N N . ALA B ? 15 ? 5.209 11.938 15.733 1.0 98.87 15 B 1 -ATOM 100 C CA . ALA B ? 15 ? 4.035 12.094 14.889 1.0 98.89 15 B 1 -ATOM 101 C C . ALA B ? 15 ? 3.979 13.525 14.344 1.0 98.88 15 B 1 -ATOM 102 O O . ALA B ? 15 ? 4.271 14.478 15.067 1.0 98.66 15 B 1 -ATOM 103 C CB . ALA B ? 15 ? 2.773 11.751 15.693 1.0 98.76 15 B 1 -ATOM 104 N N . ALA B ? 16 ? 3.597 13.674 13.082 1.0 98.9 16 B 1 -ATOM 105 C CA . ALA B ? 16 ? 3.365 14.974 12.464 1.0 98.93 16 B 1 -ATOM 106 C C . ALA B ? 16 ? 2.369 14.855 11.308 1.0 98.95 16 B 1 -ATOM 107 O O . ALA B ? 16 ? 2.187 13.782 10.728 1.0 98.88 16 B 1 -ATOM 108 C CB . ALA B ? 16 ? 4.698 15.568 11.987 1.0 98.79 16 B 1 -ATOM 109 N N . ARG B ? 17 ? 1.767 15.970 10.933 1.0 98.93 17 B 1 -ATOM 110 C CA . ARG B ? 17 ? 0.875 16.077 9.780 1.0 98.92 17 B 1 -ATOM 111 C C . ARG B ? 17 ? 1.060 17.397 9.042 1.0 98.91 17 B 1 -ATOM 112 O O . ARG B ? 17 ? 1.514 18.382 9.621 1.0 98.74 17 B 1 -ATOM 113 C CB . ARG B ? 17 ? -0.578 15.860 10.215 1.0 98.72 17 B 1 -ATOM 114 C CG . ARG B ? 17 ? -1.148 16.995 11.088 1.0 98.37 17 B 1 -ATOM 115 C CD . ARG B ? 17 ? -2.617 16.707 11.385 1.0 98.27 17 B 1 -ATOM 116 N NE . ARG B ? 17 ? -3.279 17.761 12.154 1.0 98.06 17 B 1 -ATOM 117 C CZ . ARG B ? 17 ? -3.906 18.829 11.677 1.0 98.45 17 B 1 -ATOM 118 N NH1 . ARG B ? 17 ? -3.856 19.170 10.429 1.0 96.06 17 B 1 -ATOM 119 N NH2 . ARG B ? 17 ? -4.619 19.571 12.464 1.0 96.46 17 B 1 -ATOM 120 N N . THR B ? 18 ? 0.644 17.429 7.797 1.0 98.92 18 B 1 -ATOM 121 C CA . THR B ? 18 ? 0.427 18.698 7.093 1.0 98.91 18 B 1 -ATOM 122 C C . THR B ? 18 ? -0.822 19.395 7.652 1.0 98.91 18 B 1 -ATOM 123 O O . THR B ? 18 ? -1.658 18.736 8.287 1.0 98.82 18 B 1 -ATOM 124 C CB . THR B ? 18 ? 0.258 18.482 5.584 1.0 98.84 18 B 1 -ATOM 125 O OG1 . THR B ? 18 ? -0.940 17.805 5.289 1.0 98.39 18 B 1 -ATOM 126 C CG2 . THR B ? 18 ? 1.408 17.676 4.981 1.0 98.03 18 B 1 -ATOM 127 N N . PRO B ? 19 ? -1.018 20.693 7.389 1.0 98.89 19 B 1 -ATOM 128 C CA . PRO B ? 19 ? -2.356 21.264 7.393 1.0 98.86 19 B 1 -ATOM 129 C C . PRO B ? 19 ? -3.282 20.466 6.465 1.0 98.89 19 B 1 -ATOM 130 O O . PRO B ? 19 ? -2.821 19.784 5.539 1.0 98.79 19 B 1 -ATOM 131 C CB . PRO B ? 19 ? -2.199 22.714 6.930 1.0 98.64 19 B 1 -ATOM 132 C CG . PRO B ? 19 ? -0.724 23.019 7.196 1.0 97.42 19 B 1 -ATOM 133 C CD . PRO B ? 19 ? -0.047 21.676 6.966 1.0 98.58 19 B 1 -ATOM 134 N N . ILE B ? 20 ? -4.580 20.554 6.711 1.0 98.91 20 B 1 -ATOM 135 C CA . ILE B ? 20 ? -5.602 20.000 5.824 1.0 98.92 20 B 1 -ATOM 136 C C . ILE B ? 20 ? -6.082 21.120 4.902 1.0 98.88 20 B 1 -ATOM 137 O O . ILE B ? 20 ? -6.692 22.094 5.349 1.0 98.72 20 B 1 -ATOM 138 C CB . ILE B ? 20 ? -6.743 19.337 6.624 1.0 98.91 20 B 1 -ATOM 139 C CG1 . ILE B ? 20 ? -6.201 18.148 7.459 1.0 98.71 20 B 1 -ATOM 140 C CG2 . ILE B ? 20 ? -7.846 18.857 5.662 1.0 98.74 20 B 1 -ATOM 141 C CD1 . ILE B ? 20 ? -7.220 17.554 8.439 1.0 97.88 20 B 1 -ATOM 142 N N . GLY B ? 21 ? -5.804 20.982 3.613 1.0 98.75 21 B 1 -ATOM 143 C CA . GLY B ? 21 ? -6.281 21.896 2.586 1.0 98.72 21 B 1 -ATOM 144 C C . GLY B ? 21 ? -7.734 21.623 2.214 1.0 98.82 21 B 1 -ATOM 145 O O . GLY B ? 21 ? -8.168 20.470 2.151 1.0 98.7 21 B 1 -ATOM 146 N N . SER B ? 22 ? -8.485 22.683 1.923 1.0 98.66 22 B 1 -ATOM 147 C CA . SER B ? 22 ? -9.796 22.552 1.284 1.0 98.59 22 B 1 -ATOM 148 C C . SER B ? 22 ? -9.655 22.098 -0.170 1.0 98.49 22 B 1 -ATOM 149 O O . SER B ? 22 ? -8.636 22.337 -0.816 1.0 98.02 22 B 1 -ATOM 150 C CB . SER B ? 22 ? -10.558 23.872 1.335 1.0 98.4 22 B 1 -ATOM 151 O OG . SER B ? 22 ? -10.837 24.247 2.666 1.0 96.69 22 B 1 -ATOM 152 N N . PHE B ? 23 ? -10.701 21.476 -0.711 1.0 98.37 23 B 1 -ATOM 153 C CA . PHE B ? 23 ? -10.698 20.970 -2.082 1.0 98.21 23 B 1 -ATOM 154 C C . PHE B ? 23 ? -10.367 22.070 -3.100 1.0 97.87 23 B 1 -ATOM 155 O O . PHE B ? 23 ? -11.026 23.108 -3.140 1.0 97.13 23 B 1 -ATOM 156 C CB . PHE B ? 23 ? -12.050 20.328 -2.390 1.0 98.06 23 B 1 -ATOM 157 C CG . PHE B ? 23 ? -12.122 19.658 -3.751 1.0 98.34 23 B 1 -ATOM 158 C CD1 . PHE B ? 23 ? -13.091 20.059 -4.692 1.0 97.83 23 B 1 -ATOM 159 C CD2 . PHE B ? 23 ? -11.232 18.621 -4.075 1.0 97.7 23 B 1 -ATOM 160 C CE1 . PHE B ? 23 ? -13.180 19.412 -5.939 1.0 97.09 23 B 1 -ATOM 161 C CE2 . PHE B ? 23 ? -11.314 17.977 -5.326 1.0 97.07 23 B 1 -ATOM 162 C CZ . PHE B ? 23 ? -12.293 18.371 -6.253 1.0 97.71 23 B 1 -ATOM 163 N N . ARG B ? 24 ? -9.354 21.817 -3.926 1.0 97.77 24 B 1 -ATOM 164 C CA . ARG B ? 24 ? -8.855 22.732 -4.967 1.0 97.18 24 B 1 -ATOM 165 C C . ARG B ? 24 ? -8.487 24.125 -4.433 1.0 96.55 24 B 1 -ATOM 166 O O . ARG B ? 24 ? -8.689 25.127 -5.113 1.0 94.42 24 B 1 -ATOM 167 C CB . ARG B ? 24 ? -9.824 22.794 -6.160 1.0 96.57 24 B 1 -ATOM 168 C CG . ARG B ? 24 ? -10.117 21.410 -6.773 1.0 93.84 24 B 1 -ATOM 169 C CD . ARG B ? 24 ? -10.974 21.539 -8.032 1.0 88.58 24 B 1 -ATOM 170 N NE . ARG B ? 24 ? -10.208 22.137 -9.137 1.0 82.76 24 B 1 -ATOM 171 C CZ . ARG B ? 24 ? -10.691 22.630 -10.273 1.0 76.6 24 B 1 -ATOM 172 N NH1 . ARG B ? 24 ? -11.967 22.630 -10.536 1.0 71.68 24 B 1 -ATOM 173 N NH2 . ARG B ? 24 ? -9.878 23.120 -11.167 1.0 71.03 24 B 1 -ATOM 174 N N . SER B ? 25 ? -7.927 24.187 -3.229 1.0 97.32 25 B 1 -ATOM 175 C CA . SER B ? 25 ? -7.499 25.415 -2.559 1.0 96.94 25 B 1 -ATOM 176 C C . SER B ? 25 ? -5.973 25.459 -2.400 1.0 96.65 25 B 1 -ATOM 177 O O . SER B ? 25 ? -5.260 25.347 -3.405 1.0 95.32 25 B 1 -ATOM 178 C CB . SER B ? 25 ? -8.280 25.558 -1.251 1.0 96.62 25 B 1 -ATOM 179 O OG . SER B ? 25 ? -8.051 26.816 -0.672 1.0 93.75 25 B 1 -ATOM 180 N N . ALA B ? 26 ? -5.458 25.613 -1.195 1.0 96.77 26 B 1 -ATOM 181 C CA . ALA B ? 26 ? -4.028 25.778 -0.921 1.0 96.59 26 B 1 -ATOM 182 C C . ALA B ? 26 ? -3.149 24.681 -1.543 1.0 96.99 26 B 1 -ATOM 183 O O . ALA B ? 26 ? -2.082 24.968 -2.085 1.0 96.13 26 B 1 -ATOM 184 C CB . ALA B ? 26 ? -3.833 25.824 0.594 1.0 95.62 26 B 1 -ATOM 185 N N . PHE B ? 27 ? -3.614 23.425 -1.522 1.0 97.72 27 B 1 -ATOM 186 C CA . PHE B ? 27 ? -2.877 22.271 -2.039 1.0 97.88 27 B 1 -ATOM 187 C C . PHE B ? 27 ? -3.365 21.776 -3.409 1.0 97.51 27 B 1 -ATOM 188 O O . PHE B ? 27 ? -3.017 20.674 -3.822 1.0 96.69 27 B 1 -ATOM 189 C CB . PHE B ? 27 ? -2.844 21.162 -0.979 1.0 98.04 27 B 1 -ATOM 190 C CG . PHE B ? 27 ? -2.248 21.535 0.370 1.0 98.35 27 B 1 -ATOM 191 C CD1 . PHE B ? 27 ? -1.217 22.489 0.480 1.0 97.88 27 B 1 -ATOM 192 C CD2 . PHE B ? 27 ? -2.712 20.894 1.533 1.0 97.85 27 B 1 -ATOM 193 C CE1 . PHE B ? 27 ? -0.673 22.815 1.735 1.0 97.66 27 B 1 -ATOM 194 C CE2 . PHE B ? 27 ? -2.168 21.208 2.789 1.0 97.57 27 B 1 -ATOM 195 C CZ . PHE B ? 27 ? -1.151 22.175 2.891 1.0 98.07 27 B 1 -ATOM 196 N N . ASN B ? 28 ? -4.117 22.584 -4.151 1.0 97.08 28 B 1 -ATOM 197 C CA . ASN B ? 28 ? -4.717 22.214 -5.442 1.0 95.8 28 B 1 -ATOM 198 C C . ASN B ? 28 ? -3.740 21.565 -6.445 1.0 95.04 28 B 1 -ATOM 199 O O . ASN B ? 28 ? -4.120 20.673 -7.199 1.0 90.87 28 B 1 -ATOM 200 C CB . ASN B ? 28 ? -5.312 23.489 -6.052 1.0 93.54 28 B 1 -ATOM 201 C CG . ASN B ? 28 ? -6.030 23.240 -7.366 1.0 89.51 28 B 1 -ATOM 202 O OD1 . ASN B ? 28 ? -6.785 22.307 -7.533 1.0 81.51 28 B 1 -ATOM 203 N ND2 . ASN B ? 28 ? -5.839 24.108 -8.334 1.0 79.83 28 B 1 -ATOM 204 N N . ASN B ? 29 ? -2.487 22.023 -6.453 1.0 95.29 29 B 1 -ATOM 205 C CA . ASN B ? 29 ? -1.446 21.543 -7.363 1.0 94.27 29 B 1 -ATOM 206 C C . ASN B ? 29 ? -0.306 20.818 -6.635 1.0 95.52 29 B 1 -ATOM 207 O O . ASN B ? 29 ? 0.767 20.630 -7.204 1.0 93.57 29 B 1 -ATOM 208 C CB . ASN B ? 29 ? -0.940 22.729 -8.199 1.0 90.51 29 B 1 -ATOM 209 C CG . ASN B ? 29 ? -2.009 23.323 -9.101 1.0 80.58 29 B 1 -ATOM 210 O OD1 . ASN B ? 29 ? -2.871 22.656 -9.635 1.0 68.46 29 B 1 -ATOM 211 N ND2 . ASN B ? 29 ? -1.967 24.618 -9.314 1.0 70.32 29 B 1 -ATOM 212 N N . VAL B ? 30 ? -0.507 20.429 -5.381 1.0 96.89 30 B 1 -ATOM 213 C CA . VAL B ? 30 ? 0.502 19.718 -4.585 1.0 97.77 30 B 1 -ATOM 214 C C . VAL B ? 30 ? 0.254 18.214 -4.697 1.0 98.2 30 B 1 -ATOM 215 O O . VAL B ? 30 ? -0.737 17.724 -4.154 1.0 98.17 30 B 1 -ATOM 216 C CB . VAL B ? 30 ? 0.509 20.180 -3.119 1.0 97.82 30 B 1 -ATOM 217 C CG1 . VAL B ? 30 ? 1.662 19.517 -2.355 1.0 97.35 30 B 1 -ATOM 218 C CG2 . VAL B ? 30 ? 0.690 21.699 -3.011 1.0 97.24 30 B 1 -ATOM 219 N N . PRO B ? 31 ? 1.137 17.448 -5.366 1.0 98.24 31 B 1 -ATOM 220 C CA . PRO B ? 31 ? 0.980 16.001 -5.464 1.0 98.42 31 B 1 -ATOM 221 C C . PRO B ? 31 ? 0.896 15.343 -4.084 1.0 98.73 31 B 1 -ATOM 222 O O . PRO B ? 31 ? 1.609 15.739 -3.155 1.0 98.71 31 B 1 -ATOM 223 C CB . PRO B ? 31 ? 2.198 15.505 -6.247 1.0 97.81 31 B 1 -ATOM 224 C CG . PRO B ? 31 ? 2.634 16.730 -7.053 1.0 96.2 31 B 1 -ATOM 225 C CD . PRO B ? 31 ? 2.300 17.887 -6.117 1.0 97.86 31 B 1 -ATOM 226 N N . VAL B ? 32 ? 0.102 14.273 -3.964 1.0 98.73 32 B 1 -ATOM 227 C CA . VAL B ? 32 ? -0.031 13.511 -2.711 1.0 98.87 32 B 1 -ATOM 228 C C . VAL B ? 32 ? 1.324 13.041 -2.163 1.0 98.91 32 B 1 -ATOM 229 O O . VAL B ? 32 ? 1.552 13.052 -0.958 1.0 98.87 32 B 1 -ATOM 230 C CB . VAL B ? 32 ? -0.999 12.329 -2.906 1.0 98.75 32 B 1 -ATOM 231 C CG1 . VAL B ? 32 ? -0.458 11.225 -3.831 1.0 97.97 32 B 1 -ATOM 232 C CG2 . VAL B ? 32 ? -1.389 11.709 -1.561 1.0 97.6 32 B 1 -ATOM 233 N N . THR B ? 33 ? 2.265 12.724 -3.055 1.0 98.81 33 B 1 -ATOM 234 C CA . THR B ? 33 ? 3.629 12.319 -2.694 1.0 98.83 33 B 1 -ATOM 235 C C . THR B ? 33 ? 4.437 13.444 -2.046 1.0 98.86 33 B 1 -ATOM 236 O O . THR B ? 33 ? 5.313 13.169 -1.234 1.0 98.74 33 B 1 -ATOM 237 C CB . THR B ? 33 ? 4.382 11.815 -3.929 1.0 98.69 33 B 1 -ATOM 238 O OG1 . THR B ? 33 ? 4.344 12.780 -4.958 1.0 97.26 33 B 1 -ATOM 239 C CG2 . THR B ? 33 ? 3.759 10.529 -4.479 1.0 96.73 33 B 1 -ATOM 240 N N . VAL B ? 34 ? 4.147 14.706 -2.351 1.0 98.71 34 B 1 -ATOM 241 C CA . VAL B ? 34 ? 4.764 15.869 -1.694 1.0 98.61 34 B 1 -ATOM 242 C C . VAL B ? 34 ? 4.172 16.064 -0.303 1.0 98.74 34 B 1 -ATOM 243 O O . VAL B ? 34 ? 4.930 16.210 0.650 1.0 98.69 34 B 1 -ATOM 244 C CB . VAL B ? 34 ? 4.628 17.145 -2.549 1.0 98.24 34 B 1 -ATOM 245 C CG1 . VAL B ? 34 ? 5.156 18.386 -1.822 1.0 97.33 34 B 1 -ATOM 246 C CG2 . VAL B ? 34 ? 5.410 17.000 -3.861 1.0 97.47 34 B 1 -ATOM 247 N N . LEU B ? 35 ? 2.848 15.978 -0.160 1.0 98.74 35 B 1 -ATOM 248 C CA . LEU B ? 35 ? 2.174 16.033 1.142 1.0 98.85 35 B 1 -ATOM 249 C C . LEU B ? 35 ? 2.718 14.946 2.086 1.0 98.91 35 B 1 -ATOM 250 O O . LEU B ? 35 ? 3.163 15.242 3.194 1.0 98.89 35 B 1 -ATOM 251 C CB . LEU B ? 35 ? 0.650 15.879 0.948 1.0 98.82 35 B 1 -ATOM 252 C CG . LEU B ? 35 ? -0.031 16.979 0.108 1.0 98.61 35 B 1 -ATOM 253 C CD1 . LEU B ? 35 ? -1.489 16.605 -0.149 1.0 98.35 35 B 1 -ATOM 254 C CD2 . LEU B ? 35 ? 0.007 18.334 0.810 1.0 98.17 35 B 1 -ATOM 255 N N . GLY B ? 36 ? 2.761 13.703 1.608 1.0 98.89 36 B 1 -ATOM 256 C CA . GLY B ? 36 ? 3.292 12.577 2.376 1.0 98.93 36 B 1 -ATOM 257 C C . GLY B ? 36 ? 4.771 12.736 2.739 1.0 98.95 36 B 1 -ATOM 258 O O . GLY B ? 36 ? 5.158 12.486 3.879 1.0 98.93 36 B 1 -ATOM 259 N N . ARG B ? 37 ? 5.597 13.191 1.798 1.0 98.9 37 B 1 -ATOM 260 C CA . ARG B ? 37 ? 7.030 13.457 2.010 1.0 98.86 37 B 1 -ATOM 261 C C . ARG B ? 37 ? 7.266 14.463 3.136 1.0 98.89 37 B 1 -ATOM 262 O O . ARG B ? 37 ? 8.097 14.220 4.009 1.0 98.78 37 B 1 -ATOM 263 C CB . ARG B ? 37 ? 7.640 13.961 0.696 1.0 98.47 37 B 1 -ATOM 264 C CG . ARG B ? 37 ? 9.139 14.282 0.803 1.0 97.18 37 B 1 -ATOM 265 C CD . ARG B ? 37 ? 9.633 14.977 -0.467 1.0 94.99 37 B 1 -ATOM 266 N NE . ARG B ? 37 ? 9.206 16.380 -0.505 1.0 91.22 37 B 1 -ATOM 267 C CZ . ARG B ? 37 ? 9.109 17.172 -1.558 1.0 91.51 37 B 1 -ATOM 268 N NH1 . ARG B ? 37 ? 9.396 16.763 -2.765 1.0 83.78 37 B 1 -ATOM 269 N NH2 . ARG B ? 37 ? 8.726 18.396 -1.400 1.0 86.95 37 B 1 -ATOM 270 N N . GLU B ? 38 ? 6.553 15.583 3.108 1.0 98.81 38 B 1 -ATOM 271 C CA . GLU B ? 38 ? 6.729 16.632 4.113 1.0 98.76 38 B 1 -ATOM 272 C C . GLU B ? 38 ? 6.198 16.192 5.487 1.0 98.83 38 B 1 -ATOM 273 O O . GLU B ? 38 ? 6.890 16.375 6.489 1.0 98.73 38 B 1 -ATOM 274 C CB . GLU B ? 38 ? 6.100 17.948 3.634 1.0 98.56 38 B 1 -ATOM 275 C CG . GLU B ? 38 ? 6.784 18.560 2.391 1.0 97.66 38 B 1 -ATOM 276 C CD . GLU B ? 38 ? 8.319 18.630 2.495 1.0 97.04 38 B 1 -ATOM 277 O OE1 . GLU B ? 38 ? 9.006 18.199 1.535 1.0 93.85 38 B 1 -ATOM 278 O OE2 . GLU B ? 38 ? 8.841 19.056 3.543 1.0 94.02 38 B 1 -ATOM 279 N N . ALA B ? 39 ? 5.050 15.500 5.536 1.0 98.86 39 B 1 -ATOM 280 C CA . ALA B ? 39 ? 4.553 14.917 6.784 1.0 98.92 39 B 1 -ATOM 281 C C . ALA B ? 39 ? 5.546 13.907 7.387 1.0 98.94 39 B 1 -ATOM 282 O O . ALA B ? 39 ? 5.796 13.930 8.592 1.0 98.91 39 B 1 -ATOM 283 C CB . ALA B ? 39 ? 3.191 14.269 6.525 1.0 98.91 39 B 1 -ATOM 284 N N . LEU B ? 40 ? 6.173 13.061 6.557 1.0 98.94 40 B 1 -ATOM 285 C CA . LEU B ? 40 ? 7.174 12.097 7.017 1.0 98.95 40 B 1 -ATOM 286 C C . LEU B ? 40 ? 8.443 12.789 7.530 1.0 98.94 40 B 1 -ATOM 287 O O . LEU B ? 40 ? 8.930 12.442 8.605 1.0 98.91 40 B 1 -ATOM 288 C CB . LEU B ? 40 ? 7.471 11.082 5.899 1.0 98.95 40 B 1 -ATOM 289 C CG . LEU B ? 40 ? 8.505 10.009 6.302 1.0 98.82 40 B 1 -ATOM 290 C CD1 . LEU B ? 40 ? 8.120 9.248 7.571 1.0 98.51 40 B 1 -ATOM 291 C CD2 . LEU B ? 40 ? 8.655 8.987 5.177 1.0 98.52 40 B 1 -ATOM 292 N N . LYS B ? 41 ? 8.956 13.798 6.826 1.0 98.91 41 B 1 -ATOM 293 C CA . LYS B ? 41 ? 10.074 14.617 7.323 1.0 98.86 41 B 1 -ATOM 294 C C . LYS B ? 41 ? 9.740 15.256 8.673 1.0 98.86 41 B 1 -ATOM 295 O O . LYS B ? 41 ? 10.570 15.237 9.578 1.0 98.72 41 B 1 -ATOM 296 C CB . LYS B ? 41 ? 10.410 15.724 6.321 1.0 98.73 41 B 1 -ATOM 297 C CG . LYS B ? 41 ? 11.162 15.232 5.073 1.0 97.57 41 B 1 -ATOM 298 C CD . LYS B ? 41 ? 11.324 16.443 4.153 1.0 95.83 41 B 1 -ATOM 299 C CE . LYS B ? 41 ? 12.074 16.124 2.868 1.0 89.81 41 B 1 -ATOM 300 N NZ . LYS B ? 41 ? 11.993 17.306 1.979 1.0 84.3 41 B 1 -ATOM 301 N N . GLY B ? 42 ? 8.524 15.778 8.809 1.0 98.83 42 B 1 -ATOM 302 C CA . GLY B ? 42 ? 8.035 16.357 10.055 1.0 98.81 42 B 1 -ATOM 303 C C . GLY B ? 42 ? 7.991 15.345 11.200 1.0 98.86 42 B 1 -ATOM 304 O O . GLY B ? 42 ? 8.507 15.626 12.281 1.0 98.73 42 B 1 -ATOM 305 N N . ALA B ? 43 ? 7.460 14.145 10.955 1.0 98.85 43 B 1 -ATOM 306 C CA . ALA B ? 43 ? 7.395 13.081 11.959 1.0 98.89 43 B 1 -ATOM 307 C C . ALA B ? 43 ? 8.792 12.594 12.386 1.0 98.89 43 B 1 -ATOM 308 O O . ALA B ? 43 ? 9.053 12.425 13.577 1.0 98.8 43 B 1 -ATOM 309 C CB . ALA B ? 43 ? 6.537 11.937 11.405 1.0 98.9 43 B 1 -ATOM 310 N N . LEU B ? 44 ? 9.718 12.430 11.435 1.0 98.9 44 B 1 -ATOM 311 C CA . LEU B ? 44 ? 11.112 12.062 11.714 1.0 98.87 44 B 1 -ATOM 312 C C . LEU B ? 44 ? 11.830 13.146 12.530 1.0 98.77 44 B 1 -ATOM 313 O O . LEU B ? 44 ? 12.534 12.831 13.489 1.0 98.55 44 B 1 -ATOM 314 C CB . LEU B ? 44 ? 11.845 11.805 10.385 1.0 98.89 44 B 1 -ATOM 315 C CG . LEU B ? 44 ? 11.422 10.510 9.665 1.0 98.79 44 B 1 -ATOM 316 C CD1 . LEU B ? 44 ? 12.005 10.491 8.253 1.0 98.59 44 B 1 -ATOM 317 C CD2 . LEU B ? 44 ? 11.908 9.260 10.398 1.0 98.57 44 B 1 -ATOM 318 N N . LYS B ? 45 ? 11.604 14.419 12.204 1.0 98.75 45 B 1 -ATOM 319 C CA . LYS B ? 45 ? 12.144 15.554 12.961 1.0 98.6 45 B 1 -ATOM 320 C C . LYS B ? 45 ? 11.559 15.621 14.374 1.0 98.57 45 B 1 -ATOM 321 O O . LYS B ? 45 ? 12.302 15.850 15.324 1.0 98.12 45 B 1 -ATOM 322 C CB . LYS B ? 45 ? 11.892 16.842 12.160 1.0 98.24 45 B 1 -ATOM 323 C CG . LYS B ? 45 ? 12.641 18.054 12.742 1.0 89.49 45 B 1 -ATOM 324 C CD . LYS B ? 45 ? 12.371 19.298 11.885 1.0 84.13 45 B 1 -ATOM 325 C CE . LYS B ? 45 ? 13.137 20.512 12.427 1.0 71.78 45 B 1 -ATOM 326 N NZ . LYS B ? 45 ? 12.831 21.741 11.648 1.0 62.79 45 B 1 -ATOM 327 N N . ASN B ? 46 ? 10.251 15.378 14.519 1.0 98.46 46 B 1 -ATOM 328 C CA . ASN B ? 46 ? 9.577 15.309 15.823 1.0 98.34 46 B 1 -ATOM 329 C C . ASN B ? 46 ? 10.126 14.173 16.698 1.0 98.37 46 B 1 -ATOM 330 O O . ASN B ? 46 ? 10.304 14.354 17.900 1.0 97.97 46 B 1 -ATOM 331 C CB . ASN B ? 46 ? 8.064 15.151 15.583 1.0 98.06 46 B 1 -ATOM 332 C CG . ASN B ? 46 ? 7.271 15.114 16.880 1.0 97.37 46 B 1 -ATOM 333 O OD1 . ASN B ? 46 ? 6.806 14.082 17.335 1.0 90.82 46 B 1 -ATOM 334 N ND2 . ASN B ? 46 ? 7.102 16.248 17.518 1.0 89.6 46 B 1 -ATOM 335 N N . ALA B ? 47 ? 10.460 13.037 16.084 1.0 98.56 47 B 1 -ATOM 336 C CA . ALA B ? 47 ? 11.052 11.885 16.756 1.0 98.57 47 B 1 -ATOM 337 C C . ALA B ? 47 ? 12.554 12.032 17.060 1.0 98.48 47 B 1 -ATOM 338 O O . ALA B ? 47 ? 13.100 11.213 17.798 1.0 97.72 47 B 1 -ATOM 339 C CB . ALA B ? 47 ? 10.808 10.657 15.873 1.0 98.49 47 B 1 -ATOM 340 N N . ASN B ? 48 ? 13.244 13.024 16.484 1.0 98.33 48 B 1 -ATOM 341 C CA . ASN B ? 48 ? 14.712 13.081 16.448 1.0 98.11 48 B 1 -ATOM 342 C C . ASN B ? 48 ? 15.360 11.832 15.813 1.0 98.36 48 B 1 -ATOM 343 O O . ASN B ? 48 ? 16.462 11.427 16.184 1.0 97.37 48 B 1 -ATOM 344 C CB . ASN B ? 48 ? 15.265 13.460 17.836 1.0 97.05 48 B 1 -ATOM 345 C CG . ASN B ? 48 ? 15.742 14.895 17.942 1.0 87.22 48 B 1 -ATOM 346 O OD1 . ASN B ? 48 ? 16.036 15.580 16.983 1.0 78.73 48 B 1 -ATOM 347 N ND2 . ASN B ? 48 ? 15.880 15.386 19.156 1.0 74.79 48 B 1 -ATOM 348 N N . VAL B ? 49 ? 14.686 11.218 14.844 1.0 98.52 49 B 1 -ATOM 349 C CA . VAL B ? 49 ? 15.163 10.037 14.108 1.0 98.7 49 B 1 -ATOM 350 C C . VAL B ? 49 ? 15.748 10.464 12.766 1.0 98.76 49 B 1 -ATOM 351 O O . VAL B ? 49 ? 15.104 11.147 11.972 1.0 98.62 49 B 1 -ATOM 352 C CB . VAL B ? 49 ? 14.038 8.999 13.949 1.0 98.61 49 B 1 -ATOM 353 C CG1 . VAL B ? 49 ? 14.411 7.840 13.017 1.0 97.99 49 B 1 -ATOM 354 C CG2 . VAL B ? 49 ? 13.700 8.381 15.313 1.0 97.82 49 B 1 -ATOM 355 N N . LYS B ? 50 ? 16.982 10.027 12.482 1.0 98.61 50 B 1 -ATOM 356 C CA . LYS B ? 50 ? 17.563 10.209 11.147 1.0 98.58 50 B 1 -ATOM 357 C C . LYS B ? 50 ? 16.797 9.355 10.131 1.0 98.76 50 B 1 -ATOM 358 O O . LYS B ? 50 ? 16.574 8.175 10.405 1.0 98.59 50 B 1 -ATOM 359 C CB . LYS B ? 50 ? 19.050 9.841 11.132 1.0 97.93 50 B 1 -ATOM 360 C CG . LYS B ? 50 ? 19.918 10.903 11.821 1.0 85.28 50 B 1 -ATOM 361 C CD . LYS B ? 50 ? 21.401 10.545 11.670 1.0 79.07 50 B 1 -ATOM 362 C CE . LYS B ? 50 ? 22.278 11.624 12.309 1.0 67.98 50 B 1 -ATOM 363 N NZ . LYS B ? 50 ? 23.723 11.312 12.146 1.0 58.1 50 B 1 -ATOM 364 N N . PRO B ? 51 ? 16.489 9.886 8.943 1.0 98.72 51 B 1 -ATOM 365 C CA . PRO B ? 51 ? 15.777 9.126 7.905 1.0 98.74 51 B 1 -ATOM 366 C C . PRO B ? 51 ? 16.429 7.778 7.553 1.0 98.77 51 B 1 -ATOM 367 O O . PRO B ? 51 ? 15.737 6.801 7.304 1.0 98.62 51 B 1 -ATOM 368 C CB . PRO B ? 51 ? 15.735 10.059 6.692 1.0 98.58 51 B 1 -ATOM 369 C CG . PRO B ? 51 ? 15.771 11.456 7.305 1.0 97.46 51 B 1 -ATOM 370 C CD . PRO B ? 51 ? 16.671 11.269 8.526 1.0 98.62 51 B 1 -ATOM 371 N N . SER B ? 52 ? 17.761 7.703 7.620 1.0 98.7 52 B 1 -ATOM 372 C CA . SER B ? 52 ? 18.529 6.480 7.341 1.0 98.54 52 B 1 -ATOM 373 C C . SER B ? 52 ? 18.328 5.335 8.348 1.0 98.6 52 B 1 -ATOM 374 O O . SER B ? 52 ? 18.782 4.227 8.089 1.0 97.96 52 B 1 -ATOM 375 C CB . SER B ? 52 ? 20.018 6.825 7.273 1.0 97.95 52 B 1 -ATOM 376 O OG . SER B ? 52 ? 20.458 7.415 8.487 1.0 93.47 52 B 1 -ATOM 377 N N . LEU B ? 53 ? 17.682 5.575 9.492 1.0 98.71 53 B 1 -ATOM 378 C CA . LEU B ? 53 ? 17.343 4.523 10.460 1.0 98.66 53 B 1 -ATOM 379 C C . LEU B ? 53 ? 16.051 3.777 10.103 1.0 98.75 53 B 1 -ATOM 380 O O . LEU B ? 53 ? 15.811 2.693 10.630 1.0 98.41 53 B 1 -ATOM 381 C CB . LEU B ? 53 ? 17.230 5.125 11.873 1.0 98.23 53 B 1 -ATOM 382 C CG . LEU B ? 53 ? 18.550 5.644 12.469 1.0 93.33 53 B 1 -ATOM 383 C CD1 . LEU B ? 53 ? 18.278 6.263 13.841 1.0 89.04 53 B 1 -ATOM 384 C CD2 . LEU B ? 53 ? 19.586 4.529 12.650 1.0 89.21 53 B 1 -ATOM 385 N N . VAL B ? 54 ? 15.226 4.345 9.237 1.0 98.81 54 B 1 -ATOM 386 C CA . VAL B ? 54 ? 13.962 3.731 8.814 1.0 98.87 54 B 1 -ATOM 387 C C . VAL B ? 54 ? 14.258 2.491 7.976 1.0 98.86 54 B 1 -ATOM 388 O O . VAL B ? 54 ? 15.014 2.553 7.009 1.0 98.75 54 B 1 -ATOM 389 C CB . VAL B ? 54 ? 13.083 4.731 8.042 1.0 98.83 54 B 1 -ATOM 390 C CG1 . VAL B ? 54 ? 11.751 4.101 7.627 1.0 98.52 54 B 1 -ATOM 391 C CG2 . VAL B ? 54 ? 12.771 5.969 8.895 1.0 98.45 54 B 1 -ATOM 392 N N . GLN B ? 55 ? 13.635 1.373 8.330 1.0 98.86 55 B 1 -ATOM 393 C CA . GLN B ? 55 ? 13.832 0.073 7.674 1.0 98.82 55 B 1 -ATOM 394 C C . GLN B ? 55 ? 12.636 -0.340 6.809 1.0 98.82 55 B 1 -ATOM 395 O O . GLN B ? 55 ? 12.810 -0.965 5.764 1.0 98.56 55 B 1 -ATOM 396 C CB . GLN B ? 55 ? 14.095 -0.978 8.757 1.0 98.64 55 B 1 -ATOM 397 C CG . GLN B ? 55 ? 15.418 -0.754 9.502 1.0 98.25 55 B 1 -ATOM 398 C CD . GLN B ? 55 ? 15.536 -1.644 10.738 1.0 97.89 55 B 1 -ATOM 399 O OE1 . GLN B ? 55 ? 14.579 -1.871 11.462 1.0 93.54 55 B 1 -ATOM 400 N NE2 . GLN B ? 55 ? 16.701 -2.160 11.035 1.0 92.71 55 B 1 -ATOM 401 N N . GLU B ? 56 ? 11.425 0.014 7.247 1.0 98.83 56 B 1 -ATOM 402 C CA . GLU B ? 56 ? 10.185 -0.303 6.530 1.0 98.86 56 B 1 -ATOM 403 C C . GLU B ? 56 ? 9.142 0.807 6.725 1.0 98.91 56 B 1 -ATOM 404 O O . GLU B ? 56 ? 9.152 1.533 7.724 1.0 98.87 56 B 1 -ATOM 405 C CB . GLU B ? 56 ? 9.683 -1.699 6.956 1.0 98.74 56 B 1 -ATOM 406 C CG . GLU B ? 56 ? 8.534 -2.221 6.085 1.0 98.36 56 B 1 -ATOM 407 C CD . GLU B ? 56 ? 8.337 -3.748 6.111 1.0 98.56 56 B 1 -ATOM 408 O OE1 . GLU B ? 56 ? 7.444 -4.226 5.366 1.0 97.21 56 B 1 -ATOM 409 O OE2 . GLU B ? 56 ? 9.085 -4.464 6.811 1.0 97.46 56 B 1 -ATOM 410 N N . ALA B ? 57 ? 8.246 0.961 5.755 1.0 98.93 57 B 1 -ATOM 411 C CA . ALA B ? 57 ? 7.168 1.938 5.776 1.0 98.94 57 B 1 -ATOM 412 C C . ALA B ? 57 ? 5.852 1.351 5.262 1.0 98.94 57 B 1 -ATOM 413 O O . ALA B ? 57 ? 5.822 0.659 4.241 1.0 98.86 57 B 1 -ATOM 414 C CB . ALA B ? 57 ? 7.581 3.158 4.946 1.0 98.89 57 B 1 -ATOM 415 N N . PHE B ? 58 ? 4.755 1.695 5.925 1.0 98.97 58 B 1 -ATOM 416 C CA . PHE B ? 58 ? 3.390 1.464 5.454 1.0 98.97 58 B 1 -ATOM 417 C C . PHE B ? 58 ? 2.658 2.806 5.379 1.0 98.96 58 B 1 -ATOM 418 O O . PHE B ? 58 ? 2.576 3.523 6.376 1.0 98.89 58 B 1 -ATOM 419 C CB . PHE B ? 58 ? 2.658 0.493 6.382 1.0 98.93 58 B 1 -ATOM 420 C CG . PHE B ? 58 ? 3.217 -0.915 6.382 1.0 98.9 58 B 1 -ATOM 421 C CD1 . PHE B ? 58 ? 2.743 -1.863 5.457 1.0 98.48 58 B 1 -ATOM 422 C CD2 . PHE B ? 58 ? 4.216 -1.283 7.305 1.0 98.49 58 B 1 -ATOM 423 C CE1 . PHE B ? 58 ? 3.257 -3.168 5.450 1.0 98.28 58 B 1 -ATOM 424 C CE2 . PHE B ? 58 ? 4.740 -2.588 7.302 1.0 98.2 58 B 1 -ATOM 425 C CZ . PHE B ? 58 ? 4.260 -3.531 6.373 1.0 98.41 58 B 1 -ATOM 426 N N . ILE B ? 59 ? 2.108 3.164 4.216 1.0 98.95 59 B 1 -ATOM 427 C CA . ILE B ? 59 ? 1.418 4.449 4.014 1.0 98.96 59 B 1 -ATOM 428 C C . ILE B ? 59 ? 0.047 4.211 3.379 1.0 98.94 59 B 1 -ATOM 429 O O . ILE B ? 59 ? -0.058 3.600 2.319 1.0 98.87 59 B 1 -ATOM 430 C CB . ILE B ? 59 ? 2.284 5.437 3.196 1.0 98.95 59 B 1 -ATOM 431 C CG1 . ILE B ? 59 ? 3.655 5.662 3.885 1.0 98.77 59 B 1 -ATOM 432 C CG2 . ILE B ? 59 ? 1.531 6.772 3.022 1.0 98.84 59 B 1 -ATOM 433 C CD1 . ILE B ? 59 ? 4.597 6.626 3.151 1.0 98.3 59 B 1 -ATOM 434 N N . GLY B ? 60 ? -1.010 4.700 4.022 1.0 98.95 60 B 1 -ATOM 435 C CA . GLY B ? 60 ? -2.372 4.652 3.511 1.0 98.94 60 B 1 -ATOM 436 C C . GLY B ? 60 ? -2.619 5.687 2.416 1.0 98.95 60 B 1 -ATOM 437 O O . GLY B ? 60 ? -2.310 6.857 2.592 1.0 98.88 60 B 1 -ATOM 438 N N . VAL B ? 61 ? -3.217 5.255 1.304 1.0 98.93 61 B 1 -ATOM 439 C CA . VAL B ? 61 ? -3.727 6.136 0.245 1.0 98.92 61 B 1 -ATOM 440 C C . VAL B ? 61 ? -4.869 5.415 -0.469 1.0 98.9 61 B 1 -ATOM 441 O O . VAL B ? 61 ? -4.776 4.208 -0.710 1.0 98.67 61 B 1 -ATOM 442 C CB . VAL B ? 61 ? -2.601 6.585 -0.718 1.0 98.8 61 B 1 -ATOM 443 C CG1 . VAL B ? 61 ? -1.894 5.429 -1.439 1.0 97.92 61 B 1 -ATOM 444 C CG2 . VAL B ? 61 ? -3.101 7.598 -1.761 1.0 97.1 61 B 1 -ATOM 445 N N . VAL B ? 62 ? -5.965 6.115 -0.753 1.0 98.86 62 B 1 -ATOM 446 C CA . VAL B ? 62 ? -7.191 5.490 -1.283 1.0 98.81 62 B 1 -ATOM 447 C C . VAL B ? 62 ? -7.283 5.610 -2.800 1.0 98.73 62 B 1 -ATOM 448 O O . VAL B ? 62 ? -7.564 4.619 -3.476 1.0 98.36 62 B 1 -ATOM 449 C CB . VAL B ? 62 ? -8.451 6.061 -0.606 1.0 98.74 62 B 1 -ATOM 450 C CG1 . VAL B ? 62 ? -9.708 5.303 -1.044 1.0 98.29 62 B 1 -ATOM 451 C CG2 . VAL B ? 62 ? -8.357 5.972 0.923 1.0 98.39 62 B 1 -ATOM 452 N N . VAL B ? 63 ? -7.035 6.802 -3.332 1.0 98.74 63 B 1 -ATOM 453 C CA . VAL B ? 63 ? -7.143 7.101 -4.767 1.0 98.69 63 B 1 -ATOM 454 C C . VAL B ? 63 ? -5.816 7.663 -5.292 1.0 98.58 63 B 1 -ATOM 455 O O . VAL B ? 63 ? -5.706 8.856 -5.575 1.0 98.19 63 B 1 -ATOM 456 C CB . VAL B ? 63 ? -8.346 8.021 -5.078 1.0 98.56 63 B 1 -ATOM 457 C CG1 . VAL B ? 63 ? -8.657 7.964 -6.576 1.0 97.59 63 B 1 -ATOM 458 C CG2 . VAL B ? 63 ? -9.620 7.610 -4.326 1.0 97.74 63 B 1 -ATOM 459 N N . PRO B ? 64 ? -4.770 6.829 -5.421 1.0 98.6 64 B 1 -ATOM 460 C CA . PRO B ? 64 ? -3.447 7.281 -5.859 1.0 98.33 64 B 1 -ATOM 461 C C . PRO B ? 64 ? -3.335 7.502 -7.374 1.0 98.36 64 B 1 -ATOM 462 O O . PRO B ? 64 ? -2.228 7.650 -7.889 1.0 97.51 64 B 1 -ATOM 463 C CB . PRO B ? 64 ? -2.493 6.194 -5.358 1.0 97.45 64 B 1 -ATOM 464 C CG . PRO B ? 64 ? -3.331 4.923 -5.512 1.0 96.85 64 B 1 -ATOM 465 C CD . PRO B ? 64 ? -4.733 5.402 -5.121 1.0 97.87 64 B 1 -ATOM 466 N N . SER B ? 65 ? -4.445 7.516 -8.097 1.0 98.42 65 B 1 -ATOM 467 C CA . SER B ? 65 ? -4.479 7.680 -9.553 1.0 98.48 65 B 1 -ATOM 468 C C . SER B ? 65 ? -3.710 8.928 -9.994 1.0 98.47 65 B 1 -ATOM 469 O O . SER B ? 65 ? -3.946 10.020 -9.482 1.0 98.28 65 B 1 -ATOM 470 C CB . SER B ? 65 ? -5.927 7.775 -10.048 1.0 98.3 65 B 1 -ATOM 471 O OG . SER B ? 65 ? -6.700 6.704 -9.536 1.0 95.38 65 B 1 -ATOM 472 N N . ASN B ? 66 ? -2.791 8.763 -10.941 1.0 97.95 66 B 1 -ATOM 473 C CA . ASN B ? 66 ? -1.875 9.795 -11.438 1.0 97.98 66 B 1 -ATOM 474 C C . ASN B ? 66 ? -0.817 10.277 -10.416 1.0 98.09 66 B 1 -ATOM 475 O O . ASN B ? 66 ? -0.103 11.247 -10.679 1.0 97.7 66 B 1 -ATOM 476 C CB . ASN B ? 66 ? -2.694 10.928 -12.091 1.0 97.64 66 B 1 -ATOM 477 C CG . ASN B ? 66 ? -1.879 11.854 -12.967 1.0 97.26 66 B 1 -ATOM 478 O OD1 . ASN B ? 66 ? -0.963 11.458 -13.670 1.0 92.99 66 B 1 -ATOM 479 N ND2 . ASN B ? 66 ? -2.222 13.123 -12.993 1.0 92.54 66 B 1 -ATOM 480 N N . ALA B ? 67 ? -0.651 9.597 -9.281 1.0 98.57 67 B 1 -ATOM 481 C CA . ALA B ? 67 ? 0.435 9.887 -8.341 1.0 98.56 67 B 1 -ATOM 482 C C . ALA B ? 67 ? 1.810 9.362 -8.809 1.0 98.55 67 B 1 -ATOM 483 O O . ALA B ? 67 ? 2.838 9.739 -8.244 1.0 97.94 67 B 1 -ATOM 484 C CB . ALA B ? 67 ? 0.057 9.336 -6.964 1.0 98.4 67 B 1 -ATOM 485 N N . GLY B ? 68 ? 1.840 8.532 -9.844 1.0 98.32 68 B 1 -ATOM 486 C CA . GLY B ? 68 ? 3.041 7.864 -10.337 1.0 98.42 68 B 1 -ATOM 487 C C . GLY B ? 68 ? 3.328 6.541 -9.626 1.0 98.52 68 B 1 -ATOM 488 O O . GLY B ? 68 ? 2.700 6.189 -8.628 1.0 98.01 68 B 1 -ATOM 489 N N . GLN B ? 69 ? 4.310 5.791 -10.143 1.0 98.33 69 B 1 -ATOM 490 C CA . GLN B ? 69 ? 4.647 4.458 -9.644 1.0 98.24 69 B 1 -ATOM 491 C C . GLN B ? 69 ? 5.012 4.464 -8.156 1.0 98.31 69 B 1 -ATOM 492 O O . GLN B ? 69 ? 5.917 5.176 -7.717 1.0 97.88 69 B 1 -ATOM 493 C CB . GLN B ? 69 ? 5.786 3.869 -10.486 1.0 97.68 69 B 1 -ATOM 494 C CG . GLN B ? 69 ? 6.081 2.410 -10.112 1.0 95.99 69 B 1 -ATOM 495 C CD . GLN B ? 69 ? 7.312 1.878 -10.828 1.0 95.62 69 B 1 -ATOM 496 O OE1 . GLN B ? 69 ? 8.433 2.184 -10.465 1.0 88.57 69 B 1 -ATOM 497 N NE2 . GLN B ? 69 ? 7.150 1.070 -11.849 1.0 87.37 69 B 1 -ATOM 498 N N . GLY B ? 70 ? 4.345 3.611 -7.387 1.0 98.05 70 B 1 -ATOM 499 C CA . GLY B ? 70 ? 4.649 3.409 -5.976 1.0 98.16 70 B 1 -ATOM 500 C C . GLY B ? 70 ? 4.664 4.704 -5.157 1.0 98.48 70 B 1 -ATOM 501 O O . GLY B ? 70 ? 5.721 5.079 -4.646 1.0 97.92 70 B 1 -ATOM 502 N N . PRO B ? 71 ? 3.533 5.401 -4.993 1.0 98.57 71 B 1 -ATOM 503 C CA . PRO B ? 71 ? 3.497 6.714 -4.337 1.0 98.55 71 B 1 -ATOM 504 C C . PRO B ? 71 ? 4.078 6.702 -2.920 1.0 98.71 71 B 1 -ATOM 505 O O . PRO B ? 71 ? 4.783 7.633 -2.534 1.0 98.51 71 B 1 -ATOM 506 C CB . PRO B ? 71 ? 2.021 7.132 -4.360 1.0 97.97 71 B 1 -ATOM 507 C CG . PRO B ? 71 ? 1.263 5.814 -4.523 1.0 96.19 71 B 1 -ATOM 508 C CD . PRO B ? 71 ? 2.198 4.988 -5.389 1.0 98.08 71 B 1 -ATOM 509 N N . ALA B ? 72 ? 3.873 5.631 -2.161 1.0 98.66 72 B 1 -ATOM 510 C CA . ALA B ? 72 ? 4.478 5.474 -0.840 1.0 98.78 72 B 1 -ATOM 511 C C . ALA B ? 72 ? 6.015 5.406 -0.905 1.0 98.84 72 B 1 -ATOM 512 O O . ALA B ? 72 ? 6.699 5.998 -0.073 1.0 98.78 72 B 1 -ATOM 513 C CB . ALA B ? 72 ? 3.889 4.222 -0.185 1.0 98.73 72 B 1 -ATOM 514 N N . ARG B ? 73 ? 6.574 4.744 -1.919 1.0 98.35 73 B 1 -ATOM 515 C CA . ARG B ? 73 ? 8.033 4.682 -2.141 1.0 98.39 73 B 1 -ATOM 516 C C . ARG B ? 73 ? 8.604 6.066 -2.449 1.0 98.54 73 B 1 -ATOM 517 O O . ARG B ? 73 ? 9.642 6.417 -1.898 1.0 98.45 73 B 1 -ATOM 518 C CB . ARG B ? 73 ? 8.324 3.657 -3.252 1.0 98.15 73 B 1 -ATOM 519 C CG . ARG B ? 73 ? 9.819 3.467 -3.574 1.0 97.01 73 B 1 -ATOM 520 C CD . ARG B ? 73 ? 10.620 2.812 -2.434 1.0 95.9 73 B 1 -ATOM 521 N NE . ARG B ? 73 ? 11.978 2.480 -2.901 1.0 96.92 73 B 1 -ATOM 522 C CZ . ARG B ? 73 ? 12.997 2.047 -2.182 1.0 97.44 73 B 1 -ATOM 523 N NH1 . ARG B ? 73 ? 12.919 1.832 -0.904 1.0 94.05 73 B 1 -ATOM 524 N NH2 . ARG B ? 73 ? 14.138 1.818 -2.750 1.0 94.96 73 B 1 -ATOM 525 N N . GLN B ? 74 ? 7.914 6.866 -3.258 1.0 98.5 74 B 1 -ATOM 526 C CA . GLN B ? 74 ? 8.298 8.253 -3.549 1.0 98.39 74 B 1 -ATOM 527 C C . GLN B ? 74 ? 8.360 9.106 -2.273 1.0 98.63 74 B 1 -ATOM 528 O O . GLN B ? 74 ? 9.314 9.856 -2.078 1.0 98.6 74 B 1 -ATOM 529 C CB . GLN B ? 74 ? 7.304 8.898 -4.527 1.0 98.32 74 B 1 -ATOM 530 C CG . GLN B ? 74 ? 7.188 8.195 -5.885 1.0 97.85 74 B 1 -ATOM 531 C CD . GLN B ? 74 ? 6.217 8.938 -6.800 1.0 98.18 74 B 1 -ATOM 532 O OE1 . GLN B ? 74 ? 6.253 10.154 -6.915 1.0 93.38 74 B 1 -ATOM 533 N NE2 . GLN B ? 74 ? 5.308 8.252 -7.456 1.0 93.75 74 B 1 -ATOM 534 N N . VAL B ? 75 ? 7.375 8.966 -1.388 1.0 98.79 75 B 1 -ATOM 535 C CA . VAL B ? 75 ? 7.327 9.662 -0.092 1.0 98.83 75 B 1 -ATOM 536 C C . VAL B ? 75 ? 8.544 9.322 0.762 1.0 98.83 75 B 1 -ATOM 537 O O . VAL B ? 75 ? 9.224 10.220 1.257 1.0 98.76 75 B 1 -ATOM 538 C CB . VAL B ? 75 ? 6.023 9.300 0.649 1.0 98.78 75 B 1 -ATOM 539 C CG1 . VAL B ? 75 ? 6.033 9.704 2.128 1.0 98.37 75 B 1 -ATOM 540 C CG2 . VAL B ? 75 ? 4.827 9.984 -0.025 1.0 98.19 75 B 1 -ATOM 541 N N . VAL B ? 76 ? 8.834 8.034 0.915 1.0 98.84 76 B 1 -ATOM 542 C CA . VAL B ? 76 ? 9.891 7.528 1.798 1.0 98.8 76 B 1 -ATOM 543 C C . VAL B ? 76 ? 11.283 7.921 1.296 1.0 98.75 76 B 1 -ATOM 544 O O . VAL B ? 76 ? 12.087 8.441 2.067 1.0 98.61 76 B 1 -ATOM 545 C CB . VAL B ? 76 ? 9.724 6.005 1.966 1.0 98.7 76 B 1 -ATOM 546 C CG1 . VAL B ? 76 ? 10.901 5.345 2.681 1.0 97.97 76 B 1 -ATOM 547 C CG2 . VAL B ? 76 ? 8.459 5.722 2.791 1.0 98.07 76 B 1 -ATOM 548 N N . LEU B ? 77 ? 11.559 7.748 0.003 1.0 98.74 77 B 1 -ATOM 549 C CA . LEU B ? 77 ? 12.828 8.191 -0.585 1.0 98.65 77 B 1 -ATOM 550 C C . LEU B ? 77 ? 12.951 9.722 -0.593 1.0 98.56 77 B 1 -ATOM 551 O O . LEU B ? 77 ? 14.002 10.260 -0.255 1.0 98.26 77 B 1 -ATOM 552 C CB . LEU B ? 77 ? 12.983 7.613 -2.001 1.0 98.59 77 B 1 -ATOM 553 C CG . LEU B ? 77 ? 13.111 6.078 -2.073 1.0 98.05 77 B 1 -ATOM 554 C CD1 . LEU B ? 77 ? 13.372 5.673 -3.523 1.0 96.94 77 B 1 -ATOM 555 C CD2 . LEU B ? 77 ? 14.245 5.524 -1.211 1.0 96.62 77 B 1 -ATOM 556 N N . GLY B ? 78 ? 11.867 10.433 -0.902 1.0 98.71 78 B 1 -ATOM 557 C CA . GLY B ? 78 ? 11.835 11.896 -0.883 1.0 98.65 78 B 1 -ATOM 558 C C . GLY B ? 78 ? 12.067 12.501 0.509 1.0 98.72 78 B 1 -ATOM 559 O O . GLY B ? 78 ? 12.626 13.595 0.620 1.0 98.41 78 B 1 -ATOM 560 N N . ALA B ? 79 ? 11.701 11.777 1.571 1.0 98.77 79 B 1 -ATOM 561 C CA . ALA B ? 79 ? 11.992 12.166 2.951 1.0 98.79 79 B 1 -ATOM 562 C C . ALA B ? 79 ? 13.453 11.898 3.379 1.0 98.77 79 B 1 -ATOM 563 O O . ALA B ? 79 ? 13.840 12.278 4.485 1.0 98.53 79 B 1 -ATOM 564 C CB . ALA B ? 79 ? 10.987 11.478 3.878 1.0 98.77 79 B 1 -ATOM 565 N N . GLY B ? 80 ? 14.264 11.279 2.519 1.0 98.68 80 B 1 -ATOM 566 C CA . GLY B ? 80 ? 15.680 10.994 2.765 1.0 98.66 80 B 1 -ATOM 567 C C . GLY B ? 80 ? 15.955 9.636 3.417 1.0 98.77 80 B 1 -ATOM 568 O O . GLY B ? 80 ? 17.064 9.420 3.904 1.0 98.31 80 B 1 -ATOM 569 N N . CYS B ? 81 ? 14.973 8.730 3.442 1.0 98.75 81 B 1 -ATOM 570 C CA . CYS B ? 81 ? 15.195 7.352 3.882 1.0 98.76 81 B 1 -ATOM 571 C C . CYS B ? 81 ? 16.126 6.609 2.909 1.0 98.71 81 B 1 -ATOM 572 O O . CYS B ? 81 ? 16.227 6.953 1.731 1.0 98.36 81 B 1 -ATOM 573 C CB . CYS B ? 81 ? 13.858 6.617 4.035 1.0 98.76 81 B 1 -ATOM 574 S SG . CYS B ? 81 ? 12.795 7.454 5.256 1.0 98.63 81 B 1 -ATOM 575 N N . ASP B ? 82 ? 16.791 5.565 3.410 1.0 98.62 82 B 1 -ATOM 576 C CA . ASP B ? 82 ? 17.722 4.783 2.602 1.0 98.57 82 B 1 -ATOM 577 C C . ASP B ? 82 ? 17.004 4.000 1.487 1.0 98.6 82 B 1 -ATOM 578 O O . ASP B ? 82 ? 15.859 3.567 1.635 1.0 98.31 82 B 1 -ATOM 579 C CB . ASP B ? 82 ? 18.534 3.844 3.504 1.0 98.33 82 B 1 -ATOM 580 C CG . ASP B ? 82 ? 19.673 3.224 2.696 1.0 97.21 82 B 1 -ATOM 581 O OD1 . ASP B ? 82 ? 19.516 2.063 2.270 1.0 94.58 82 B 1 -ATOM 582 O OD2 . ASP B ? 82 ? 20.646 3.960 2.419 1.0 94.23 82 B 1 -ATOM 583 N N . VAL B ? 83 ? 17.691 3.780 0.373 1.0 98.6 83 B 1 -ATOM 584 C CA . VAL B ? 83 ? 17.139 3.010 -0.757 1.0 98.54 83 B 1 -ATOM 585 C C . VAL B ? 83 ? 16.807 1.557 -0.392 1.0 98.61 83 B 1 -ATOM 586 O O . VAL B ? 83 ? 15.972 0.943 -1.050 1.0 98.06 83 B 1 -ATOM 587 C CB . VAL B ? 83 ? 18.069 3.045 -1.981 1.0 98.0 83 B 1 -ATOM 588 C CG1 . VAL B ? 83 ? 18.187 4.465 -2.541 1.0 95.58 83 B 1 -ATOM 589 C CG2 . VAL B ? 83 ? 19.475 2.495 -1.683 1.0 95.26 83 B 1 -ATOM 590 N N . SER B ? 84 ? 17.407 1.025 0.682 1.0 98.46 84 B 1 -ATOM 591 C CA . SER B ? 84 ? 17.104 -0.304 1.224 1.0 98.47 84 B 1 -ATOM 592 C C . SER B ? 84 ? 15.764 -0.388 1.973 1.0 98.57 84 B 1 -ATOM 593 O O . SER B ? 84 ? 15.295 -1.490 2.248 1.0 98.23 84 B 1 -ATOM 594 C CB . SER B ? 84 ? 18.239 -0.769 2.139 1.0 98.28 84 B 1 -ATOM 595 O OG . SER B ? 84 ? 18.327 0.028 3.301 1.0 96.67 84 B 1 -ATOM 596 N N . THR B ? 85 ? 15.131 0.747 2.279 1.0 98.61 85 B 1 -ATOM 597 C CA . THR B ? 85 ? 13.853 0.796 3.004 1.0 98.68 85 B 1 -ATOM 598 C C . THR B ? 85 ? 12.754 0.089 2.221 1.0 98.67 85 B 1 -ATOM 599 O O . THR B ? 85 ? 12.491 0.419 1.064 1.0 98.52 85 B 1 -ATOM 600 C CB . THR B ? 85 ? 13.418 2.243 3.280 1.0 98.64 85 B 1 -ATOM 601 O OG1 . THR B ? 85 ? 14.475 2.998 3.815 1.0 96.95 85 B 1 -ATOM 602 C CG2 . THR B ? 85 ? 12.268 2.322 4.283 1.0 97.15 85 B 1 -ATOM 603 N N . VAL B ? 86 ? 12.070 -0.856 2.866 1.0 98.74 86 B 1 -ATOM 604 C CA . VAL B ? 86 ? 10.927 -1.574 2.285 1.0 98.76 86 B 1 -ATOM 605 C C . VAL B ? 86 ? 9.679 -0.707 2.415 1.0 98.82 86 B 1 -ATOM 606 O O . VAL B ? 86 ? 9.396 -0.191 3.491 1.0 98.61 86 B 1 -ATOM 607 C CB . VAL B ? 86 ? 10.737 -2.932 2.977 1.0 98.45 86 B 1 -ATOM 608 C CG1 . VAL B ? 86 ? 9.571 -3.708 2.355 1.0 97.36 86 B 1 -ATOM 609 C CG2 . VAL B ? 86 ? 12.003 -3.793 2.850 1.0 97.44 86 B 1 -ATOM 610 N N . VAL B ? 87 ? 8.913 -0.539 1.340 1.0 98.71 87 B 1 -ATOM 611 C CA . VAL B ? 87 ? 7.750 0.366 1.353 1.0 98.76 87 B 1 -ATOM 612 C C . VAL B ? 87 ? 6.523 -0.289 0.736 1.0 98.74 87 B 1 -ATOM 613 O O . VAL B ? 87 ? 6.583 -0.812 -0.370 1.0 98.52 87 B 1 -ATOM 614 C CB . VAL B ? 87 ? 8.044 1.706 0.657 1.0 98.59 87 B 1 -ATOM 615 C CG1 . VAL B ? 87 ? 6.907 2.699 0.927 1.0 97.46 87 B 1 -ATOM 616 C CG2 . VAL B ? 87 ? 9.350 2.351 1.141 1.0 97.47 87 B 1 -ATOM 617 N N . THR B ? 88 ? 5.396 -0.193 1.436 1.0 98.8 88 B 1 -ATOM 618 C CA . THR B ? 88 ? 4.098 -0.710 0.987 1.0 98.79 88 B 1 -ATOM 619 C C . THR B ? 88 ? 3.018 0.358 1.153 1.0 98.83 88 B 1 -ATOM 620 O O . THR B ? 88 ? 2.855 0.914 2.237 1.0 98.78 88 B 1 -ATOM 621 C CB . THR B ? 88 ? 3.728 -1.976 1.770 1.0 98.72 88 B 1 -ATOM 622 O OG1 . THR B ? 88 ? 4.779 -2.920 1.702 1.0 97.5 88 B 1 -ATOM 623 C CG2 . THR B ? 88 ? 2.492 -2.670 1.214 1.0 97.75 88 B 1 -ATOM 624 N N . ALA B ? 89 ? 2.264 0.641 0.090 1.0 98.88 89 B 1 -ATOM 625 C CA . ALA B ? 89 ? 1.032 1.418 0.186 1.0 98.85 89 B 1 -ATOM 626 C C . ALA B ? 89 ? -0.141 0.498 0.556 1.0 98.82 89 B 1 -ATOM 627 O O . ALA B ? 89 ? -0.215 -0.636 0.080 1.0 98.62 89 B 1 -ATOM 628 C CB . ALA B ? 89 ? 0.781 2.168 -1.124 1.0 98.72 89 B 1 -ATOM 629 N N . VAL B ? 90 ? -1.061 0.982 1.393 1.0 98.76 90 B 1 -ATOM 630 C CA . VAL B ? 90 ? -2.252 0.234 1.815 1.0 98.68 90 B 1 -ATOM 631 C C . VAL B ? 90 ? -3.528 1.012 1.504 1.0 98.78 90 B 1 -ATOM 632 O O . VAL B ? 90 ? -3.579 2.225 1.665 1.0 98.39 90 B 1 -ATOM 633 C CB . VAL B ? 90 ? -2.200 -0.183 3.301 1.0 97.05 90 B 1 -ATOM 634 C CG1 . VAL B ? 90 ? -1.013 -1.105 3.591 1.0 92.38 90 B 1 -ATOM 635 C CG2 . VAL B ? 90 ? -2.121 0.986 4.278 1.0 92.17 90 B 1 -ATOM 636 N N . ASN B ? 91 ? -4.577 0.299 1.078 1.0 98.68 91 B 1 -ATOM 637 C CA . ASN B ? 91 ? -5.911 0.845 0.888 1.0 98.7 91 B 1 -ATOM 638 C C . ASN B ? 91 ? -6.926 0.008 1.673 1.0 98.74 91 B 1 -ATOM 639 O O . ASN B ? 91 ? -7.252 -1.118 1.308 1.0 98.58 91 B 1 -ATOM 640 C CB . ASN B ? 91 ? -6.224 0.951 -0.617 1.0 98.47 91 B 1 -ATOM 641 C CG . ASN B ? 91 ? -7.608 1.526 -0.897 1.0 97.65 91 B 1 -ATOM 642 O OD1 . ASN B ? 91 ? -8.369 1.888 -0.012 1.0 93.9 91 B 1 -ATOM 643 N ND2 . ASN B ? 91 ? -7.988 1.615 -2.151 1.0 92.97 91 B 1 -ATOM 644 N N . LYS B ? 92 ? -7.434 0.581 2.743 1.0 98.62 92 B 1 -ATOM 645 C CA . LYS B ? 92 ? -8.609 0.131 3.492 1.0 98.73 92 B 1 -ATOM 646 C C . LYS B ? 92 ? -9.630 1.280 3.548 1.0 98.71 92 B 1 -ATOM 647 O O . LYS B ? 92 ? -10.175 1.588 4.607 1.0 98.26 92 B 1 -ATOM 648 C CB . LYS B ? 92 ? -8.186 -0.416 4.865 1.0 98.64 92 B 1 -ATOM 649 C CG . LYS B ? 92 ? -9.322 -1.191 5.566 1.0 97.99 92 B 1 -ATOM 650 C CD . LYS B ? 92 ? -8.840 -1.806 6.883 1.0 97.21 92 B 1 -ATOM 651 C CE . LYS B ? 92 ? -9.963 -2.540 7.616 1.0 95.96 92 B 1 -ATOM 652 N NZ . LYS B ? 92 ? -10.826 -1.627 8.403 1.0 95.16 92 B 1 -ATOM 653 N N . MET B ? 93 ? -9.825 1.929 2.405 1.0 98.79 93 B 1 -ATOM 654 C CA . MET B ? 93 ? -10.689 3.100 2.276 1.0 98.71 93 B 1 -ATOM 655 C C . MET B ? 93 ? -10.343 4.146 3.347 1.0 98.8 93 B 1 -ATOM 656 O O . MET B ? 93 ? -9.151 4.390 3.610 1.0 98.42 93 B 1 -ATOM 657 C CB . MET B ? 93 ? -12.172 2.678 2.218 1.0 98.14 93 B 1 -ATOM 658 C CG . MET B ? 93 ? -12.507 1.792 0.997 1.0 93.31 93 B 1 -ATOM 659 S SD . MET B ? 93 ? -11.821 0.121 1.007 1.0 83.61 93 B 1 -ATOM 660 C CE . MET B ? 93 ? -13.046 -0.735 2.026 1.0 70.99 93 B 1 -ATOM 661 N N . CYS B ? 94 ? -11.339 4.755 3.991 1.0 98.62 94 B 1 -ATOM 662 C CA . CYS B ? 94 ? -11.111 5.836 4.954 1.0 98.44 94 B 1 -ATOM 663 C C . CYS B ? 94 ? -10.304 5.420 6.201 1.0 98.66 94 B 1 -ATOM 664 O O . CYS B ? 94 ? -9.845 6.282 6.939 1.0 97.96 94 B 1 -ATOM 665 C CB . CYS B ? 94 ? -12.471 6.418 5.353 1.0 96.94 94 B 1 -ATOM 666 S SG . CYS B ? 94 ? -13.554 6.672 3.912 1.0 89.75 94 B 1 -ATOM 667 N N . ALA B ? 95 ? -10.095 4.120 6.446 1.0 98.76 95 B 1 -ATOM 668 C CA . ALA B ? 95 ? -9.266 3.608 7.540 1.0 98.86 95 B 1 -ATOM 669 C C . ALA B ? 95 ? -7.811 3.296 7.129 1.0 98.91 95 B 1 -ATOM 670 O O . ALA B ? 95 ? -7.040 2.791 7.945 1.0 98.82 95 B 1 -ATOM 671 C CB . ALA B ? 95 ? -9.957 2.391 8.161 1.0 98.73 95 B 1 -ATOM 672 N N . SER B ? 96 ? -7.411 3.599 5.898 1.0 98.9 96 B 1 -ATOM 673 C CA . SER B ? 96 ? -6.101 3.245 5.331 1.0 98.91 96 B 1 -ATOM 674 C C . SER B ? 96 ? -4.916 3.685 6.197 1.0 98.93 96 B 1 -ATOM 675 O O . SER B ? 96 ? -4.036 2.877 6.489 1.0 98.87 96 B 1 -ATOM 676 C CB . SER B ? 96 ? -5.964 3.853 3.931 1.0 98.83 96 B 1 -ATOM 677 O OG . SER B ? 96 ? -6.973 3.343 3.083 1.0 98.29 96 B 1 -ATOM 678 N N . GLY B ? 97 ? -4.916 4.933 6.661 1.0 98.92 97 B 1 -ATOM 679 C CA . GLY B ? 97 ? -3.850 5.450 7.525 1.0 98.94 97 B 1 -ATOM 680 C C . GLY B ? 97 ? -3.732 4.707 8.864 1.0 98.96 97 B 1 -ATOM 681 O O . GLY B ? 97 ? -2.628 4.491 9.356 1.0 98.9 97 B 1 -ATOM 682 N N . MET B ? 98 ? -4.851 4.254 9.435 1.0 98.95 98 B 1 -ATOM 683 C CA . MET B ? 98 ? -4.835 3.454 10.666 1.0 98.95 98 B 1 -ATOM 684 C C . MET B ? 98 ? -4.384 2.010 10.405 1.0 98.95 98 B 1 -ATOM 685 O O . MET B ? 98 ? -3.601 1.466 11.181 1.0 98.9 98 B 1 -ATOM 686 C CB . MET B ? 98 ? -6.211 3.503 11.336 1.0 98.85 98 B 1 -ATOM 687 C CG . MET B ? 98 ? -6.172 2.868 12.731 1.0 97.58 98 B 1 -ATOM 688 S SD . MET B ? 98 ? -7.728 2.980 13.648 1.0 97.35 98 B 1 -ATOM 689 C CE . MET B ? 98 ? -7.755 4.746 14.034 1.0 93.33 98 B 1 -ATOM 690 N N . LYS B ? 99 ? -4.822 1.393 9.298 1.0 98.92 99 B 1 -ATOM 691 C CA . LYS B ? 99 ? -4.361 0.047 8.922 1.0 98.92 99 B 1 -ATOM 692 C C . LYS B ? 99 ? -2.855 0.017 8.636 1.0 98.92 99 B 1 -ATOM 693 O O . LYS B ? 99 ? -2.204 -0.954 8.996 1.0 98.86 99 B 1 -ATOM 694 C CB . LYS B ? 99 ? -5.189 -0.502 7.748 1.0 98.87 99 B 1 -ATOM 695 C CG . LYS B ? 99 ? -4.939 -2.002 7.461 1.0 98.52 99 B 1 -ATOM 696 C CD . LYS B ? 99 ? -5.378 -2.930 8.608 1.0 97.94 99 B 1 -ATOM 697 C CE . LYS B ? 99 ? -5.288 -4.417 8.230 1.0 97.31 99 B 1 -ATOM 698 N NZ . LYS B ? 99 ? -5.880 -5.313 9.262 1.0 96.17 99 B 1 -ATOM 699 N N . ALA B ? 100 ? -2.294 1.087 8.075 1.0 98.96 100 B 1 -ATOM 700 C CA . ALA B ? 100 ? -0.848 1.230 7.909 1.0 98.96 100 B 1 -ATOM 701 C C . ALA B ? 100 ? -0.106 1.158 9.258 1.0 98.95 100 B 1 -ATOM 702 O O . ALA B ? 100 ? 0.861 0.409 9.390 1.0 98.91 100 B 1 -ATOM 703 C CB . ALA B ? 100 ? -0.567 2.552 7.180 1.0 98.94 100 B 1 -ATOM 704 N N . ILE B ? 101 ? -0.610 1.853 10.281 1.0 98.96 101 B 1 -ATOM 705 C CA . ILE B ? 101 ? -0.059 1.804 11.644 1.0 98.96 101 B 1 -ATOM 706 C C . ILE B ? 101 ? -0.204 0.395 12.247 1.0 98.92 101 B 1 -ATOM 707 O O . ILE B ? 101 ? 0.727 -0.098 12.879 1.0 98.84 101 B 1 -ATOM 708 C CB . ILE B ? 101 ? -0.706 2.890 12.537 1.0 98.96 101 B 1 -ATOM 709 C CG1 . ILE B ? 101 ? -0.410 4.309 11.988 1.0 98.86 101 B 1 -ATOM 710 C CG2 . ILE B ? 101 ? -0.198 2.786 13.985 1.0 98.88 101 B 1 -ATOM 711 C CD1 . ILE B ? 101 ? -1.206 5.431 12.671 1.0 98.69 101 B 1 -ATOM 712 N N . ALA B ? 102 ? -1.329 -0.288 12.013 1.0 98.91 102 B 1 -ATOM 713 C CA . ALA B ? 102 ? -1.531 -1.666 12.464 1.0 98.86 102 B 1 -ATOM 714 C C . ALA B ? 102 ? -0.537 -2.647 11.809 1.0 98.8 102 B 1 -ATOM 715 O O . ALA B ? 102 ? 0.064 -3.467 12.499 1.0 98.6 102 B 1 -ATOM 716 C CB . ALA B ? 102 ? -2.985 -2.072 12.190 1.0 98.78 102 B 1 -ATOM 717 N N . CYS B ? 103 ? -0.299 -2.523 10.498 1.0 98.85 103 B 1 -ATOM 718 C CA . CYS B ? 103 ? 0.708 -3.315 9.791 1.0 98.8 103 B 1 -ATOM 719 C C . CYS B ? 103 ? 2.118 -3.074 10.358 1.0 98.72 103 B 1 -ATOM 720 O O . CYS B ? 103 ? 2.844 -4.031 10.615 1.0 98.53 103 B 1 -ATOM 721 C CB . CYS B ? 103 ? 0.661 -2.987 8.290 1.0 98.8 103 B 1 -ATOM 722 S SG . CYS B ? 103 ? -0.873 -3.598 7.529 1.0 98.45 103 B 1 -ATOM 723 N N . ALA B ? 104 ? 2.476 -1.813 10.617 1.0 98.83 104 B 1 -ATOM 724 C CA . ALA B ? 104 ? 3.755 -1.461 11.231 1.0 98.82 104 B 1 -ATOM 725 C C . ALA B ? 104 ? 3.907 -2.059 12.643 1.0 98.72 104 B 1 -ATOM 726 O O . ALA B ? 104 ? 4.955 -2.613 12.967 1.0 98.53 104 B 1 -ATOM 727 C CB . ALA B ? 104 ? 3.875 0.065 11.253 1.0 98.83 104 B 1 -ATOM 728 N N . ALA B ? 105 ? 2.850 -2.014 13.458 1.0 98.72 105 B 1 -ATOM 729 C CA . ALA B ? 105 ? 2.839 -2.630 14.783 1.0 98.62 105 B 1 -ATOM 730 C C . ALA B ? 105 ? 3.068 -4.149 14.713 1.0 98.42 105 B 1 -ATOM 731 O O . ALA B ? 105 ? 3.889 -4.675 15.462 1.0 98.13 105 B 1 -ATOM 732 C CB . ALA B ? 105 ? 1.516 -2.293 15.479 1.0 98.6 105 B 1 -ATOM 733 N N . SER B ? 106 ? 2.413 -4.842 13.775 1.0 98.44 106 B 1 -ATOM 734 C CA . SER B ? 106 ? 2.589 -6.286 13.568 1.0 98.21 106 B 1 -ATOM 735 C C . SER B ? 106 ? 4.032 -6.656 13.201 1.0 97.95 106 B 1 -ATOM 736 O O . SER B ? 106 ? 4.582 -7.611 13.744 1.0 97.45 106 B 1 -ATOM 737 C CB . SER B ? 106 ? 1.642 -6.787 12.472 1.0 98.07 106 B 1 -ATOM 738 O OG . SER B ? 106 ? 0.285 -6.581 12.822 1.0 96.6 106 B 1 -ATOM 739 N N . ILE B ? 107 ? 4.670 -5.873 12.326 1.0 98.06 107 B 1 -ATOM 740 C CA . ILE B ? 107 ? 6.074 -6.069 11.925 1.0 97.63 107 B 1 -ATOM 741 C C . ILE B ? 107 ? 7.027 -5.901 13.123 1.0 97.84 107 B 1 -ATOM 742 O O . ILE B ? 107 ? 7.936 -6.708 13.302 1.0 97.0 107 B 1 -ATOM 743 C CB . ILE B ? 107 ? 6.422 -5.108 10.764 1.0 95.71 107 B 1 -ATOM 744 C CG1 . ILE B ? 107 ? 5.657 -5.456 9.462 1.0 87.48 107 B 1 -ATOM 745 C CG2 . ILE B ? 107 ? 7.930 -5.044 10.477 1.0 83.84 107 B 1 -ATOM 746 C CD1 . ILE B ? 107 ? 5.970 -6.820 8.843 1.0 81.0 107 B 1 -ATOM 747 N N . LEU B ? 108 ? 6.793 -4.887 13.964 1.0 98.16 108 B 1 -ATOM 748 C CA . LEU B ? 108 ? 7.586 -4.645 15.173 1.0 98.2 108 B 1 -ATOM 749 C C . LEU B ? 108 ? 7.386 -5.740 16.230 1.0 97.79 108 B 1 -ATOM 750 O O . LEU B ? 108 ? 8.355 -6.189 16.839 1.0 97.33 108 B 1 -ATOM 751 C CB . LEU B ? 108 ? 7.223 -3.267 15.748 1.0 98.47 108 B 1 -ATOM 752 C CG . LEU B ? 108 ? 7.683 -2.075 14.889 1.0 98.42 108 B 1 -ATOM 753 C CD1 . LEU B ? 108 ? 7.055 -0.792 15.434 1.0 98.29 108 B 1 -ATOM 754 C CD2 . LEU B ? 108 ? 9.201 -1.905 14.904 1.0 98.22 108 B 1 -ATOM 755 N N . GLN B ? 109 ? 6.152 -6.211 16.429 1.0 97.88 109 B 1 -ATOM 756 C CA . GLN B ? 109 ? 5.856 -7.308 17.364 1.0 97.59 109 B 1 -ATOM 757 C C . GLN B ? 109 ? 6.537 -8.620 16.968 1.0 97.2 109 B 1 -ATOM 758 O O . GLN B ? 109 ? 6.950 -9.380 17.839 1.0 96.44 109 B 1 -ATOM 759 C CB . GLN B ? 109 ? 4.347 -7.548 17.444 1.0 97.46 109 B 1 -ATOM 760 C CG . GLN B ? 109 ? 3.618 -6.520 18.309 1.0 96.41 109 B 1 -ATOM 761 C CD . GLN B ? 109 ? 2.171 -6.963 18.511 1.0 96.59 109 B 1 -ATOM 762 O OE1 . GLN B ? 109 ? 1.284 -6.653 17.739 1.0 91.86 109 B 1 -ATOM 763 N NE2 . GLN B ? 109 ? 1.894 -7.742 19.538 1.0 90.77 109 B 1 -ATOM 764 N N . LEU B ? 110 ? 6.669 -8.881 15.668 1.0 97.51 110 B 1 -ATOM 765 C CA . LEU B ? 110 ? 7.351 -10.063 15.135 1.0 97.08 110 B 1 -ATOM 766 C C . LEU B ? 110 ? 8.881 -9.915 15.080 1.0 96.56 110 B 1 -ATOM 767 O O . LEU B ? 110 ? 9.550 -10.827 14.606 1.0 95.31 110 B 1 -ATOM 768 C CB . LEU B ? 110 ? 6.761 -10.407 13.759 1.0 97.05 110 B 1 -ATOM 769 C CG . LEU B ? 110 ? 5.329 -10.968 13.813 1.0 96.76 110 B 1 -ATOM 770 C CD1 . LEU B ? 110 ? 4.773 -11.056 12.395 1.0 96.05 110 B 1 -ATOM 771 C CD2 . LEU B ? 110 ? 5.279 -12.367 14.434 1.0 95.89 110 B 1 -ATOM 772 N N . ASP B ? 111 ? 9.436 -8.786 15.548 1.0 96.51 111 B 1 -ATOM 773 C CA . ASP B ? 111 ? 10.878 -8.485 15.506 1.0 96.0 111 B 1 -ATOM 774 C C . ASP B ? 111 ? 11.484 -8.565 14.088 1.0 96.38 111 B 1 -ATOM 775 O O . ASP B ? 111 ? 12.674 -8.825 13.916 1.0 94.71 111 B 1 -ATOM 776 C CB . ASP B ? 111 ? 11.639 -9.307 16.577 1.0 94.45 111 B 1 -ATOM 777 C CG . ASP B ? 111 ? 12.254 -8.499 17.721 1.0 90.92 111 B 1 -ATOM 778 O OD1 . ASP B ? 111 ? 12.358 -7.257 17.654 1.0 86.05 111 B 1 -ATOM 779 O OD2 . ASP B ? 111 ? 12.631 -9.118 18.749 1.0 84.66 111 B 1 -ATOM 780 N N . LEU B ? 112 ? 10.666 -8.352 13.047 1.0 96.81 112 B 1 -ATOM 781 C CA . LEU B ? 112 ? 11.115 -8.336 11.647 1.0 96.79 112 B 1 -ATOM 782 C C . LEU B ? 112 ? 11.858 -7.045 11.295 1.0 97.12 112 B 1 -ATOM 783 O O . LEU B ? 112 ? 12.711 -7.041 10.407 1.0 96.3 112 B 1 -ATOM 784 C CB . LEU B ? 112 ? 9.903 -8.525 10.717 1.0 96.53 112 B 1 -ATOM 785 C CG . LEU B ? 112 ? 9.189 -9.886 10.844 1.0 95.86 112 B 1 -ATOM 786 C CD1 . LEU B ? 112 ? 7.929 -9.884 9.983 1.0 94.45 112 B 1 -ATOM 787 C CD2 . LEU B ? 112 ? 10.078 -11.043 10.385 1.0 94.15 112 B 1 -ATOM 788 N N . GLN B ? 113 ? 11.518 -5.963 11.991 1.0 97.27 113 B 1 -ATOM 789 C CA . GLN B ? 113 ? 12.138 -4.639 11.888 1.0 97.78 113 B 1 -ATOM 790 C C . GLN B ? 113 ? 12.183 -3.995 13.283 1.0 97.91 113 B 1 -ATOM 791 O O . GLN B ? 113 ? 11.436 -4.377 14.179 1.0 97.4 113 B 1 -ATOM 792 C CB . GLN B ? 113 ? 11.338 -3.746 10.930 1.0 97.78 113 B 1 -ATOM 793 C CG . GLN B ? 113 ? 11.170 -4.267 9.501 1.0 97.33 113 B 1 -ATOM 794 C CD . GLN B ? 113 ? 12.432 -4.314 8.642 1.0 97.67 113 B 1 -ATOM 795 O OE1 . GLN B ? 113 ? 13.560 -4.159 9.073 1.0 93.66 113 B 1 -ATOM 796 N NE2 . GLN B ? 113 ? 12.257 -4.542 7.360 1.0 94.31 113 B 1 -ATOM 797 N N . GLU B ? 114 ? 13.048 -2.992 13.451 1.0 98.39 114 B 1 -ATOM 798 C CA . GLU B ? 114 ? 13.208 -2.233 14.699 1.0 98.41 114 B 1 -ATOM 799 C C . GLU B ? 114 ? 12.737 -0.770 14.571 1.0 98.66 114 B 1 -ATOM 800 O O . GLU B ? 114 ? 12.297 -0.174 15.546 1.0 98.38 114 B 1 -ATOM 801 C CB . GLU B ? 114 ? 14.689 -2.322 15.113 1.0 97.52 114 B 1 -ATOM 802 C CG . GLU B ? 114 ? 14.987 -1.754 16.509 1.0 94.15 114 B 1 -ATOM 803 C CD . GLU B ? 114 ? 16.502 -1.822 16.805 1.0 92.82 114 B 1 -ATOM 804 O OE1 . GLU B ? 114 ? 16.934 -2.465 17.782 1.0 85.55 114 B 1 -ATOM 805 O OE2 . GLU B ? 114 ? 17.304 -1.228 16.041 1.0 87.24 114 B 1 -ATOM 806 N N . MET B ? 115 ? 12.821 -0.193 13.367 1.0 98.71 115 B 1 -ATOM 807 C CA . MET B ? 115 ? 12.406 1.188 13.090 1.0 98.8 115 B 1 -ATOM 808 C C . MET B ? 115 ? 11.498 1.236 11.865 1.0 98.88 115 B 1 -ATOM 809 O O . MET B ? 115 ? 11.948 1.005 10.740 1.0 98.76 115 B 1 -ATOM 810 C CB . MET B ? 115 ? 13.654 2.064 12.894 1.0 98.55 115 B 1 -ATOM 811 C CG . MET B ? 115 ? 13.329 3.560 12.883 1.0 94.06 115 B 1 -ATOM 812 S SD . MET B ? 115 ? 12.754 4.265 14.463 1.0 94.83 115 B 1 -ATOM 813 C CE . MET B ? 115 ? 14.203 3.966 15.502 1.0 88.26 115 B 1 -ATOM 814 N N . VAL B ? 116 ? 10.233 1.563 12.078 1.0 98.92 116 B 1 -ATOM 815 C CA . VAL B ? 116 ? 9.196 1.576 11.039 1.0 98.93 116 B 1 -ATOM 816 C C . VAL B ? 116 ? 8.477 2.922 11.045 1.0 98.96 116 B 1 -ATOM 817 O O . VAL B ? 116 ? 8.205 3.493 12.097 1.0 98.89 116 B 1 -ATOM 818 C CB . VAL B ? 116 ? 8.212 0.400 11.222 1.0 98.62 116 B 1 -ATOM 819 C CG1 . VAL B ? 116 ? 7.217 0.315 10.064 1.0 93.66 116 B 1 -ATOM 820 C CG2 . VAL B ? 116 ? 8.943 -0.953 11.287 1.0 91.68 116 B 1 -ATOM 821 N N . VAL B ? 117 ? 8.146 3.432 9.873 1.0 98.95 117 B 1 -ATOM 822 C CA . VAL B ? 117 ? 7.249 4.585 9.733 1.0 98.95 117 B 1 -ATOM 823 C C . VAL B ? 117 ? 5.911 4.138 9.162 1.0 98.96 117 B 1 -ATOM 824 O O . VAL B ? 117 ? 5.833 3.200 8.369 1.0 98.89 117 B 1 -ATOM 825 C CB . VAL B ? 117 ? 7.866 5.746 8.930 1.0 98.83 117 B 1 -ATOM 826 C CG1 . VAL B ? 117 ? 9.120 6.277 9.625 1.0 97.91 117 B 1 -ATOM 827 C CG2 . VAL B ? 117 ? 8.221 5.364 7.491 1.0 97.59 117 B 1 -ATOM 828 N N . ALA B ? 118 ? 4.843 4.809 9.562 1.0 98.96 118 B 1 -ATOM 829 C CA . ALA B ? 118 ? 3.507 4.531 9.064 1.0 98.96 118 B 1 -ATOM 830 C C . ALA B ? 118 ? 2.679 5.811 8.997 1.0 98.97 118 B 1 -ATOM 831 O O . ALA B ? 118 ? 3.028 6.829 9.587 1.0 98.89 118 B 1 -ATOM 832 C CB . ALA B ? 118 ? 2.853 3.472 9.954 1.0 98.87 118 B 1 -ATOM 833 N N . GLY B ? 119 ? 1.565 5.759 8.288 1.0 98.94 119 B 1 -ATOM 834 C CA . GLY B ? 119 ? 0.663 6.896 8.207 1.0 98.92 119 B 1 -ATOM 835 C C . GLY B ? 119 ? -0.283 6.808 7.028 1.0 98.95 119 B 1 -ATOM 836 O O . GLY B ? 119 ? -0.569 5.729 6.512 1.0 98.83 119 B 1 -ATOM 837 N N . GLY B ? 120 ? -0.775 7.964 6.616 1.0 98.97 120 B 1 -ATOM 838 C CA . GLY B ? 120 ? -1.690 8.053 5.494 1.0 98.97 120 B 1 -ATOM 839 C C . GLY B ? 120 ? -1.647 9.411 4.817 1.0 98.98 120 B 1 -ATOM 840 O O . GLY B ? 120 ? -1.252 10.415 5.412 1.0 98.92 120 B 1 -ATOM 841 N N . MET B ? 121 ? -2.051 9.418 3.557 1.0 98.97 121 B 1 -ATOM 842 C CA . MET B ? 121 ? -2.059 10.607 2.721 1.0 98.96 121 B 1 -ATOM 843 C C . MET B ? 121 ? -3.198 10.540 1.708 1.0 98.96 121 B 1 -ATOM 844 O O . MET B ? 121 ? -3.588 9.462 1.268 1.0 98.88 121 B 1 -ATOM 845 C CB . MET B ? 121 ? -0.693 10.773 2.037 1.0 98.84 121 B 1 -ATOM 846 C CG . MET B ? 121 ? -0.331 9.630 1.075 1.0 98.81 121 B 1 -ATOM 847 S SD . MET B ? 121 ? 1.369 9.749 0.453 1.0 98.79 121 B 1 -ATOM 848 C CE . MET B ? 121 ? 1.370 8.389 -0.722 1.0 97.75 121 B 1 -ATOM 849 N N . GLU B ? 122 ? -3.699 11.700 1.322 1.0 98.97 122 B 1 -ATOM 850 C CA . GLU B ? 122 ? -4.640 11.825 0.207 1.0 98.96 122 B 1 -ATOM 851 C C . GLU B ? 122 ? -4.525 13.214 -0.409 1.0 98.95 122 B 1 -ATOM 852 O O . GLU B ? 122 ? -4.377 14.205 0.305 1.0 98.87 122 B 1 -ATOM 853 C CB . GLU B ? 122 ? -6.074 11.577 0.677 1.0 98.91 122 B 1 -ATOM 854 C CG . GLU B ? 122 ? -6.969 10.955 -0.412 1.0 98.49 122 B 1 -ATOM 855 C CD . GLU B ? 122 ? -6.630 9.476 -0.650 1.0 98.87 122 B 1 -ATOM 856 O OE1 . GLU B ? 122 ? -6.276 9.108 -1.782 1.0 97.83 122 B 1 -ATOM 857 O OE2 . GLU B ? 122 ? -6.701 8.683 0.325 1.0 98.04 122 B 1 -ATOM 858 N N . SER B ? 123 ? -4.611 13.298 -1.714 1.0 98.89 123 B 1 -ATOM 859 C CA . SER B ? 123 ? -4.878 14.541 -2.429 1.0 98.87 123 B 1 -ATOM 860 C C . SER B ? 123 ? -6.118 14.344 -3.282 1.0 98.86 123 B 1 -ATOM 861 O O . SER B ? 123 ? -6.031 13.891 -4.421 1.0 98.65 123 B 1 -ATOM 862 C CB . SER B ? 123 ? -3.686 14.981 -3.272 1.0 98.73 123 B 1 -ATOM 863 O OG . SER B ? 123 ? -4.048 16.145 -3.992 1.0 97.9 123 B 1 -ATOM 864 N N . MET B ? 124 ? -7.280 14.682 -2.743 1.0 98.74 124 B 1 -ATOM 865 C CA . MET B ? 124 ? -8.535 14.594 -3.492 1.0 98.7 124 B 1 -ATOM 866 C C . MET B ? 124 ? -8.545 15.609 -4.646 1.0 98.6 124 B 1 -ATOM 867 O O . MET B ? 124 ? -9.075 15.310 -5.710 1.0 98.38 124 B 1 -ATOM 868 C CB . MET B ? 124 ? -9.736 14.754 -2.553 1.0 98.72 124 B 1 -ATOM 869 C CG . MET B ? 124 ? -9.696 13.741 -1.396 1.0 98.27 124 B 1 -ATOM 870 S SD . MET B ? 124 ? -11.157 13.691 -0.322 1.0 98.01 124 B 1 -ATOM 871 C CE . MET B ? 124 ? -12.261 12.696 -1.348 1.0 94.75 124 B 1 -ATOM 872 N N . SER B ? 125 ? -7.883 16.749 -4.488 1.0 98.63 125 B 1 -ATOM 873 C CA . SER B ? 125 ? -7.701 17.754 -5.549 1.0 98.42 125 B 1 -ATOM 874 C C . SER B ? 125 ? -6.933 17.228 -6.767 1.0 98.26 125 B 1 -ATOM 875 O O . SER B ? 125 ? -7.234 17.618 -7.894 1.0 97.81 125 B 1 -ATOM 876 C CB . SER B ? 125 ? -6.942 18.964 -4.999 1.0 98.15 125 B 1 -ATOM 877 O OG . SER B ? 125 ? -7.682 19.592 -3.972 1.0 97.27 125 B 1 -ATOM 878 N N . CYS B ? 126 ? -5.966 16.341 -6.556 1.0 98.49 126 B 1 -ATOM 879 C CA . CYS B ? 126 ? -5.142 15.769 -7.622 1.0 98.37 126 B 1 -ATOM 880 C C . CYS B ? 126 ? -5.721 14.487 -8.241 1.0 98.4 126 B 1 -ATOM 881 O O . CYS B ? 126 ? -5.139 13.971 -9.196 1.0 98.03 126 B 1 -ATOM 882 C CB . CYS B ? 126 ? -3.716 15.552 -7.106 1.0 98.11 126 B 1 -ATOM 883 S SG . CYS B ? 126 ? -2.867 17.145 -6.843 1.0 97.23 126 B 1 -ATOM 884 N N . VAL B ? 127 ? -6.849 13.961 -7.751 1.0 98.15 127 B 1 -ATOM 885 C CA . VAL B ? 127 ? -7.507 12.799 -8.368 1.0 98.16 127 B 1 -ATOM 886 C C . VAL B ? 127 ? -8.033 13.194 -9.750 1.0 97.95 127 B 1 -ATOM 887 O O . VAL B ? 127 ? -8.806 14.149 -9.854 1.0 97.94 127 B 1 -ATOM 888 C CB . VAL B ? 127 ? -8.641 12.238 -7.488 1.0 98.25 127 B 1 -ATOM 889 C CG1 . VAL B ? 127 ? -9.387 11.095 -8.189 1.0 97.52 127 B 1 -ATOM 890 C CG2 . VAL B ? 127 ? -8.091 11.684 -6.170 1.0 96.87 127 B 1 -ATOM 891 N N . PRO B ? 128 ? -7.653 12.474 -10.816 1.0 98.09 128 B 1 -ATOM 892 C CA . PRO B ? 128 ? -8.053 12.812 -12.175 1.0 97.99 128 B 1 -ATOM 893 C C . PRO B ? 128 ? -9.478 12.345 -12.508 1.0 98.05 128 B 1 -ATOM 894 O O . PRO B ? 128 ? -10.113 11.584 -11.774 1.0 98.15 128 B 1 -ATOM 895 C CB . PRO B ? 128 ? -6.998 12.142 -13.055 1.0 97.78 128 B 1 -ATOM 896 C CG . PRO B ? 128 ? -6.682 10.862 -12.283 1.0 97.47 128 B 1 -ATOM 897 C CD . PRO B ? 128 ? -6.749 11.325 -10.832 1.0 98.13 128 B 1 -ATOM 898 N N . PHE B ? 129 ? -9.960 12.771 -13.668 1.0 97.7 129 B 1 -ATOM 899 C CA . PHE B ? 129 ? -11.042 12.091 -14.371 1.0 97.55 129 B 1 -ATOM 900 C C . PHE B ? 129 ? -10.486 10.912 -15.173 1.0 97.76 129 B 1 -ATOM 901 O O . PHE B ? 129 ? -9.325 10.925 -15.586 1.0 97.58 129 B 1 -ATOM 902 C CB . PHE B ? 129 ? -11.787 13.072 -15.275 1.0 97.06 129 B 1 -ATOM 903 C CG . PHE B ? 129 ? -12.403 14.239 -14.543 1.0 96.79 129 B 1 -ATOM 904 C CD1 . PHE B ? 129 ? -13.613 14.074 -13.844 1.0 92.81 129 B 1 -ATOM 905 C CD2 . PHE B ? 129 ? -11.766 15.494 -14.538 1.0 92.41 129 B 1 -ATOM 906 C CE1 . PHE B ? 129 ? -14.183 15.156 -13.148 1.0 90.48 129 B 1 -ATOM 907 C CE2 . PHE B ? 129 ? -12.331 16.577 -13.841 1.0 90.44 129 B 1 -ATOM 908 C CZ . PHE B ? 129 ? -13.542 16.408 -13.148 1.0 93.1 129 B 1 -ATOM 909 N N . TYR B ? 130 ? -11.330 9.917 -15.429 1.0 97.94 130 B 1 -ATOM 910 C CA . TYR B ? 130 ? -10.959 8.704 -16.152 1.0 97.82 130 B 1 -ATOM 911 C C . TYR B ? 130 ? -11.669 8.597 -17.496 1.0 97.45 130 B 1 -ATOM 912 O O . TYR B ? 130 ? -12.878 8.805 -17.593 1.0 96.97 130 B 1 -ATOM 913 C CB . TYR B ? 130 ? -11.257 7.463 -15.301 1.0 97.81 130 B 1 -ATOM 914 C CG . TYR B ? 130 ? -10.686 7.433 -13.894 1.0 98.27 130 B 1 -ATOM 915 C CD1 . TYR B ? 130 ? -9.458 8.040 -13.576 1.0 97.04 130 B 1 -ATOM 916 C CD2 . TYR B ? 130 ? -11.396 6.755 -12.885 1.0 96.58 130 B 1 -ATOM 917 C CE1 . TYR B ? 130 ? -8.941 7.980 -12.269 1.0 96.78 130 B 1 -ATOM 918 C CE2 . TYR B ? 130 ? -10.888 6.680 -11.576 1.0 96.51 130 B 1 -ATOM 919 C CZ . TYR B ? 130 ? -9.659 7.299 -11.271 1.0 98.14 130 B 1 -ATOM 920 O OH . TYR B ? 130 ? -9.156 7.228 -10.004 1.0 97.88 130 B 1 -ATOM 921 N N . LEU B ? 131 ? -10.915 8.183 -18.512 1.0 97.18 131 B 1 -ATOM 922 C CA . LEU B ? 131 ? -11.440 7.714 -19.787 1.0 96.81 131 B 1 -ATOM 923 C C . LEU B ? 131 ? -11.095 6.225 -19.940 1.0 96.75 131 B 1 -ATOM 924 O O . LEU B ? 131 ? -9.919 5.896 -20.135 1.0 96.67 131 B 1 -ATOM 925 C CB . LEU B ? 131 ? -10.871 8.567 -20.931 1.0 96.31 131 B 1 -ATOM 926 C CG . LEU B ? 131 ? -11.413 8.160 -22.318 1.0 94.93 131 B 1 -ATOM 927 C CD1 . LEU B ? 131 ? -12.912 8.434 -22.452 1.0 92.04 131 B 1 -ATOM 928 C CD2 . LEU B ? 131 ? -10.693 8.941 -23.408 1.0 91.12 131 B 1 -ATOM 929 N N . PRO B ? 132 ? -12.079 5.313 -19.874 1.0 96.7 132 B 1 -ATOM 930 C CA . PRO B ? 132 ? -11.842 3.894 -20.122 1.0 95.71 132 B 1 -ATOM 931 C C . PRO B ? 132 ? -11.264 3.634 -21.515 1.0 95.65 132 B 1 -ATOM 932 O O . PRO B ? 132 ? -11.540 4.359 -22.471 1.0 94.72 132 B 1 -ATOM 933 C CB . PRO B ? 132 ? -13.197 3.204 -19.941 1.0 94.42 132 B 1 -ATOM 934 C CG . PRO B ? 132 ? -13.949 4.151 -19.012 1.0 94.11 132 B 1 -ATOM 935 C CD . PRO B ? 132 ? -13.452 5.525 -19.450 1.0 96.27 132 B 1 -ATOM 936 N N . ARG B ? 133 ? -10.505 2.554 -21.656 1.0 96.19 133 B 1 -ATOM 937 C CA . ARG B ? 133 ? -10.030 2.088 -22.966 1.0 95.29 133 B 1 -ATOM 938 C C . ARG B ? 133 ? -11.192 1.529 -23.784 1.0 94.67 133 B 1 -ATOM 939 O O . ARG B ? 133 ? -12.076 0.872 -23.256 1.0 91.93 133 B 1 -ATOM 940 C CB . ARG B ? 133 ? -8.932 1.029 -22.805 1.0 93.72 133 B 1 -ATOM 941 C CG . ARG B ? 133 ? -7.690 1.595 -22.112 1.0 90.72 133 B 1 -ATOM 942 C CD . ARG B ? 133 ? -6.589 0.540 -22.021 1.0 89.16 133 B 1 -ATOM 943 N NE . ARG B ? 133 ? -5.519 1.037 -21.165 1.0 93.91 133 B 1 -ATOM 944 C CZ . ARG B ? 133 ? -4.461 1.763 -21.504 1.0 95.74 133 B 1 -ATOM 945 N NH1 . ARG B ? 133 ? -4.096 1.999 -22.730 1.0 90.29 133 B 1 -ATOM 946 N NH2 . ARG B ? 133 ? -3.756 2.289 -20.567 1.0 92.65 133 B 1 -ATOM 947 N N . GLY B ? 134 ? -11.121 1.725 -25.087 1.0 93.84 134 B 1 -ATOM 948 C CA . GLY B ? 134 ? -12.123 1.219 -26.023 1.0 92.84 134 B 1 -ATOM 949 C C . GLY B ? 134 ? -12.458 2.239 -27.102 1.0 93.83 134 B 1 -ATOM 950 O O . GLY B ? 134 ? -11.907 3.342 -27.129 1.0 91.05 134 B 1 -ATOM 951 N N . GLU B ? 135 ? -13.365 1.855 -27.989 1.0 90.78 135 B 1 -ATOM 952 C CA . GLU B ? 135 ? -13.937 2.799 -28.943 1.0 89.71 135 B 1 -ATOM 953 C C . GLU B ? 135 ? -14.843 3.801 -28.234 1.0 90.36 135 B 1 -ATOM 954 O O . GLU B ? 135 ? -15.655 3.447 -27.377 1.0 87.64 135 B 1 -ATOM 955 C CB . GLU B ? 135 ? -14.712 2.078 -30.053 1.0 87.27 135 B 1 -ATOM 956 C CG . GLU B ? 135 ? -13.782 1.526 -31.137 1.0 77.54 135 B 1 -ATOM 957 C CD . GLU B ? 135 ? -14.544 0.979 -32.351 1.0 70.47 135 B 1 -ATOM 958 O OE1 . GLU B ? 135 ? -13.950 0.984 -33.454 1.0 64.44 135 B 1 -ATOM 959 O OE2 . GLU B ? 135 ? -15.709 0.559 -32.172 1.0 65.73 135 B 1 -ATOM 960 N N . ILE B ? 136 ? -14.712 5.068 -28.629 1.0 88.84 136 B 1 -ATOM 961 C CA . ILE B ? 136 ? -15.631 6.125 -28.212 1.0 89.13 136 B 1 -ATOM 962 C C . ILE B ? 136 ? -16.764 6.173 -29.241 1.0 89.48 136 B 1 -ATOM 963 O O . ILE B ? 136 ? -16.495 6.392 -30.427 1.0 87.42 136 B 1 -ATOM 964 C CB . ILE B ? 136 ? -14.897 7.474 -28.061 1.0 88.66 136 B 1 -ATOM 965 C CG1 . ILE B ? 136 ? -13.785 7.351 -26.992 1.0 87.13 136 B 1 -ATOM 966 C CG2 . ILE B ? 136 ? -15.901 8.580 -27.687 1.0 87.31 136 B 1 -ATOM 967 C CD1 . ILE B ? 136 ? -12.924 8.610 -26.835 1.0 82.89 136 B 1 -ATOM 968 N N . PRO B ? 137 ? -18.020 5.974 -28.827 1.0 88.94 137 B 1 -ATOM 969 C CA . PRO B ? 137 ? -19.144 5.989 -29.751 1.0 88.1 137 B 1 -ATOM 970 C C . PRO B ? 137 ? -19.386 7.389 -30.322 1.0 88.96 137 B 1 -ATOM 971 O O . PRO B ? 137 ? -18.951 8.406 -29.771 1.0 86.76 137 B 1 -ATOM 972 C CB . PRO B ? 137 ? -20.334 5.467 -28.941 1.0 86.45 137 B 1 -ATOM 973 C CG . PRO B ? 137 ? -19.997 5.884 -27.512 1.0 84.71 137 B 1 -ATOM 974 C CD . PRO B ? 137 ? -18.476 5.740 -27.467 1.0 88.72 137 B 1 -ATOM 975 N N . PHE B ? 138 ? -20.138 7.448 -31.414 1.0 89.88 138 B 1 -ATOM 976 C CA . PHE B ? 138 ? -20.636 8.711 -31.946 1.0 85.91 138 B 1 -ATOM 977 C C . PHE B ? 138 ? -21.399 9.498 -30.868 1.0 84.21 138 B 1 -ATOM 978 O O . PHE B ? 138 ? -22.182 8.926 -30.109 1.0 82.19 138 B 1 -ATOM 979 C CB . PHE B ? 138 ? -21.523 8.436 -33.167 1.0 86.14 138 B 1 -ATOM 980 C CG . PHE B ? 138 ? -22.101 9.699 -33.775 1.0 85.57 138 B 1 -ATOM 981 C CD1 . PHE B ? 138 ? -23.394 10.131 -33.421 1.0 82.16 138 B 1 -ATOM 982 C CD2 . PHE B ? 138 ? -21.333 10.475 -34.664 1.0 85.2 138 B 1 -ATOM 983 C CE1 . PHE B ? 138 ? -23.913 11.324 -33.956 1.0 81.54 138 B 1 -ATOM 984 C CE2 . PHE B ? 138 ? -21.846 11.670 -35.202 1.0 84.7 138 B 1 -ATOM 985 C CZ . PHE B ? 138 ? -23.136 12.093 -34.847 1.0 85.54 138 B 1 -ATOM 986 N N . GLY B ? 139 ? -21.167 10.799 -30.810 1.0 87.6 139 B 1 -ATOM 987 C CA . GLY B ? 139 ? -21.720 11.680 -29.774 1.0 84.34 139 B 1 -ATOM 988 C C . GLY B ? 139 ? -20.818 11.842 -28.546 1.0 85.9 139 B 1 -ATOM 989 O O . GLY B ? 139 ? -21.107 12.678 -27.692 1.0 82.42 139 B 1 -ATOM 990 N N . GLY B ? 140 ? -19.723 11.102 -28.468 1.0 89.08 140 B 1 -ATOM 991 C CA . GLY B ? 140 ? -18.756 11.193 -27.381 1.0 88.29 140 B 1 -ATOM 992 C C . GLY B ? 140 ? -19.064 10.264 -26.207 1.0 88.8 140 B 1 -ATOM 993 O O . GLY B ? 140 ? -19.912 9.374 -26.278 1.0 87.13 140 B 1 -ATOM 994 N N . THR B ? 141 ? -18.331 10.467 -25.104 1.0 90.16 141 B 1 -ATOM 995 C CA . THR B ? 141 ? -18.480 9.695 -23.866 1.0 90.81 141 B 1 -ATOM 996 C C . THR B ? 141 ? -18.361 10.608 -22.649 1.0 91.73 141 B 1 -ATOM 997 O O . THR B ? 141 ? -17.857 11.731 -22.744 1.0 90.57 141 B 1 -ATOM 998 C CB . THR B ? 141 ? -17.464 8.541 -23.821 1.0 89.04 141 B 1 -ATOM 999 O OG1 . THR B ? 141 ? -17.808 7.665 -22.772 1.0 84.58 141 B 1 -ATOM 1000 C CG2 . THR B ? 141 ? -16.019 8.988 -23.597 1.0 84.34 141 B 1 -ATOM 1001 N N . LYS B ? 142 ? -18.821 10.136 -21.489 1.0 93.86 142 B 1 -ATOM 1002 C CA . LYS B ? 142 ? -18.591 10.826 -20.219 1.0 94.36 142 B 1 -ATOM 1003 C C . LYS B ? 142 ? -17.262 10.388 -19.613 1.0 95.51 142 B 1 -ATOM 1004 O O . LYS B ? 142 ? -16.961 9.197 -19.562 1.0 94.19 142 B 1 -ATOM 1005 C CB . LYS B ? 142 ? -19.753 10.594 -19.244 1.0 91.15 142 B 1 -ATOM 1006 C CG . LYS B ? 142 ? -20.960 11.482 -19.584 1.0 76.92 142 B 1 -ATOM 1007 C CD . LYS B ? 142 ? -22.053 11.328 -18.520 1.0 75.0 142 B 1 -ATOM 1008 C CE . LYS B ? 142 ? -23.191 12.316 -18.781 1.0 63.28 142 B 1 -ATOM 1009 N NZ . LYS B ? 142 ? -24.252 12.210 -17.748 1.0 56.02 142 B 1 -ATOM 1010 N N . LEU B ? 143 ? -16.514 11.362 -19.110 1.0 95.98 143 B 1 -ATOM 1011 C CA . LEU B ? 143 ? -15.404 11.102 -18.201 1.0 96.48 143 B 1 -ATOM 1012 C C . LEU B ? 143 ? -15.954 10.711 -16.827 1.0 97.2 143 B 1 -ATOM 1013 O O . LEU B ? 143 ? -16.973 11.234 -16.377 1.0 96.67 143 B 1 -ATOM 1014 C CB . LEU B ? 143 ? -14.499 12.337 -18.112 1.0 95.26 143 B 1 -ATOM 1015 C CG . LEU B ? 143 ? -13.767 12.681 -19.420 1.0 92.28 143 B 1 -ATOM 1016 C CD1 . LEU B ? 143 ? -13.030 14.005 -19.251 1.0 89.34 143 B 1 -ATOM 1017 C CD2 . LEU B ? 143 ? -12.743 11.616 -19.810 1.0 88.56 143 B 1 -ATOM 1018 N N . ILE B ? 144 ? -15.261 9.803 -16.163 1.0 96.63 144 B 1 -ATOM 1019 C CA . ILE B ? 144 ? -15.604 9.309 -14.829 1.0 97.04 144 B 1 -ATOM 1020 C C . ILE B ? 144 ? -14.779 10.094 -13.809 1.0 97.48 144 B 1 -ATOM 1021 O O . ILE B ? 144 ? -13.557 10.140 -13.910 1.0 97.46 144 B 1 -ATOM 1022 C CB . ILE B ? 144 ? -15.353 7.788 -14.749 1.0 96.9 144 B 1 -ATOM 1023 C CG1 . ILE B ? 144 ? -16.223 7.025 -15.782 1.0 95.96 144 B 1 -ATOM 1024 C CG2 . ILE B ? 144 ? -15.626 7.265 -13.327 1.0 96.19 144 B 1 -ATOM 1025 C CD1 . ILE B ? 144 ? -15.787 5.572 -15.996 1.0 92.99 144 B 1 -ATOM 1026 N N . ASP B ? 145 ? -15.430 10.700 -12.811 1.0 96.21 145 B 1 -ATOM 1027 C CA . ASP B ? 145 ? -14.717 11.355 -11.713 1.0 96.88 145 B 1 -ATOM 1028 C C . ASP B ? 145 ? -14.136 10.295 -10.765 1.0 97.07 145 B 1 -ATOM 1029 O O . ASP B ? 145 ? -14.877 9.530 -10.144 1.0 97.22 145 B 1 -ATOM 1030 C CB . ASP B ? 145 ? -15.645 12.350 -10.992 1.0 96.82 145 B 1 -ATOM 1031 C CG . ASP B ? 145 ? -14.890 13.234 -9.990 1.0 97.15 145 B 1 -ATOM 1032 O OD1 . ASP B ? 145 ? -13.833 12.821 -9.470 1.0 95.43 145 B 1 -ATOM 1033 O OD2 . ASP B ? 145 ? -15.307 14.384 -9.744 1.0 94.91 145 B 1 -ATOM 1034 N N . GLY B ? 146 ? -12.812 10.257 -10.641 1.0 97.53 146 B 1 -ATOM 1035 C CA . GLY B ? 146 ? -12.113 9.301 -9.791 1.0 97.52 146 B 1 -ATOM 1036 C C . GLY B ? 146 ? -12.426 9.431 -8.301 1.0 97.85 146 B 1 -ATOM 1037 O O . GLY B ? 146 ? -12.365 8.436 -7.581 1.0 97.88 146 B 1 -ATOM 1038 N N . ILE B ? 147 ? -12.818 10.614 -7.821 1.0 98.11 147 B 1 -ATOM 1039 C CA . ILE B ? 147 ? -13.157 10.830 -6.403 1.0 98.05 147 B 1 -ATOM 1040 C C . ILE B ? 147 ? -14.375 9.991 -5.989 1.0 97.98 147 B 1 -ATOM 1041 O O . ILE B ? 147 ? -14.227 9.139 -5.115 1.0 98.0 147 B 1 -ATOM 1042 C CB . ILE B ? 147 ? -13.338 12.323 -6.057 1.0 98.09 147 B 1 -ATOM 1043 C CG1 . ILE B ? 147 ? -12.038 13.120 -6.297 1.0 97.45 147 B 1 -ATOM 1044 C CG2 . ILE B ? 147 ? -13.794 12.479 -4.590 1.0 97.43 147 B 1 -ATOM 1045 C CD1 . ILE B ? 147 ? -12.233 14.637 -6.161 1.0 96.5 147 B 1 -ATOM 1046 N N . PRO B ? 148 ? -15.575 10.180 -6.567 1.0 98.28 148 B 1 -ATOM 1047 C CA . PRO B ? 148 ? -16.704 9.320 -6.224 1.0 98.01 148 B 1 -ATOM 1048 C C . PRO B ? 148 ? -16.460 7.872 -6.655 1.0 97.91 148 B 1 -ATOM 1049 O O . PRO B ? 148 ? -16.741 6.971 -5.876 1.0 97.68 148 B 1 -ATOM 1050 C CB . PRO B ? 148 ? -17.926 9.935 -6.913 1.0 97.49 148 B 1 -ATOM 1051 C CG . PRO B ? 148 ? -17.322 10.730 -8.072 1.0 95.63 148 B 1 -ATOM 1052 C CD . PRO B ? 148 ? -15.998 11.207 -7.498 1.0 97.81 148 B 1 -ATOM 1053 N N . ARG B ? 149 ? -15.896 7.634 -7.839 1.0 98.11 149 B 1 -ATOM 1054 C CA . ARG B ? 149 ? -15.749 6.282 -8.404 1.0 97.94 149 B 1 -ATOM 1055 C C . ARG B ? 149 ? -14.934 5.352 -7.505 1.0 97.94 149 B 1 -ATOM 1056 O O . ARG B ? 149 ? -15.403 4.263 -7.177 1.0 97.56 149 B 1 -ATOM 1057 C CB . ARG B ? 149 ? -15.144 6.388 -9.814 1.0 97.78 149 B 1 -ATOM 1058 C CG . ARG B ? 149 ? -14.850 5.025 -10.480 1.0 97.03 149 B 1 -ATOM 1059 C CD . ARG B ? 149 ? -16.098 4.136 -10.594 1.0 95.7 149 B 1 -ATOM 1060 N NE . ARG B ? 149 ? -15.781 2.872 -11.261 1.0 95.26 149 B 1 -ATOM 1061 C CZ . ARG B ? 149 ? -16.454 1.745 -11.178 1.0 94.95 149 B 1 -ATOM 1062 N NH1 . ARG B ? 149 ? -17.553 1.651 -10.484 1.0 90.92 149 B 1 -ATOM 1063 N NH2 . ARG B ? 149 ? -16.016 0.686 -11.797 1.0 91.59 149 B 1 -ATOM 1064 N N . ASP B ? 150 ? -13.736 5.766 -7.116 1.0 98.56 150 B 1 -ATOM 1065 C CA . ASP B ? 150 ? -12.781 4.934 -6.372 1.0 98.52 150 B 1 -ATOM 1066 C C . ASP B ? 150 ? -12.702 5.292 -4.874 1.0 98.48 150 B 1 -ATOM 1067 O O . ASP B ? 150 ? -12.128 4.532 -4.087 1.0 97.96 150 B 1 -ATOM 1068 C CB . ASP B ? 150 ? -11.397 5.029 -7.039 1.0 98.48 150 B 1 -ATOM 1069 C CG . ASP B ? 150 ? -11.322 4.393 -8.437 1.0 98.6 150 B 1 -ATOM 1070 O OD1 . ASP B ? 150 ? -12.108 3.470 -8.742 1.0 97.43 150 B 1 -ATOM 1071 O OD2 . ASP B ? 150 ? -10.431 4.797 -9.215 1.0 97.41 150 B 1 -ATOM 1072 N N . GLY B ? 151 ? -13.302 6.410 -4.466 1.0 98.58 151 B 1 -ATOM 1073 C CA . GLY B ? 151 ? -13.260 6.900 -3.093 1.0 98.48 151 B 1 -ATOM 1074 C C . GLY B ? 151 ? -14.590 6.865 -2.337 1.0 98.55 151 B 1 -ATOM 1075 O O . GLY B ? 151 ? -14.657 6.320 -1.235 1.0 97.95 151 B 1 -ATOM 1076 N N . LEU B ? 152 ? -15.649 7.454 -2.908 1.0 98.56 152 B 1 -ATOM 1077 C CA . LEU B ? 152 ? -16.841 7.853 -2.145 1.0 98.57 152 B 1 -ATOM 1078 C C . LEU B ? 152 ? -18.146 7.134 -2.521 1.0 98.51 152 B 1 -ATOM 1079 O O . LEU B ? 152 ? -19.149 7.321 -1.825 1.0 97.91 152 B 1 -ATOM 1080 C CB . LEU B ? 152 ? -17.026 9.378 -2.252 1.0 98.44 152 B 1 -ATOM 1081 C CG . LEU B ? 152 ? -15.821 10.239 -1.823 1.0 97.96 152 B 1 -ATOM 1082 C CD1 . LEU B ? 152 ? -16.223 11.710 -1.897 1.0 97.22 152 B 1 -ATOM 1083 C CD2 . LEU B ? 152 ? -15.355 9.946 -0.398 1.0 96.95 152 B 1 -ATOM 1084 N N . ASN B ? 153 ? -18.188 6.352 -3.599 1.0 98.41 153 B 1 -ATOM 1085 C CA . ASN B ? 153 ? -19.379 5.616 -4.026 1.0 98.27 153 B 1 -ATOM 1086 C C . ASN B ? 153 ? -19.367 4.194 -3.465 1.0 98.24 153 B 1 -ATOM 1087 O O . ASN B ? 153 ? -18.421 3.444 -3.702 1.0 97.59 153 B 1 -ATOM 1088 C CB . ASN B ? 153 ? -19.492 5.631 -5.558 1.0 97.82 153 B 1 -ATOM 1089 C CG . ASN B ? 153 ? -20.903 5.291 -6.022 1.0 95.19 153 B 1 -ATOM 1090 O OD1 . ASN B ? 153 ? -21.843 6.000 -5.722 1.0 85.38 153 B 1 -ATOM 1091 N ND2 . ASN B ? 153 ? -21.086 4.229 -6.771 1.0 85.04 153 B 1 -ATOM 1092 N N . ASP B ? 154 ? -20.424 3.815 -2.749 1.0 98.21 154 B 1 -ATOM 1093 C CA . ASP B ? 154 ? -20.682 2.426 -2.381 1.0 98.08 154 B 1 -ATOM 1094 C C . ASP B ? 154 ? -21.063 1.648 -3.645 1.0 98.07 154 B 1 -ATOM 1095 O O . ASP B ? 154 ? -22.128 1.859 -4.224 1.0 97.25 154 B 1 -ATOM 1096 C CB . ASP B ? 154 ? -21.788 2.365 -1.319 1.0 97.52 154 B 1 -ATOM 1097 C CG . ASP B ? 154 ? -22.101 0.927 -0.902 1.0 96.62 154 B 1 -ATOM 1098 O OD1 . ASP B ? 154 ? -22.716 0.189 -1.700 1.0 91.69 154 B 1 -ATOM 1099 O OD2 . ASP B ? 154 ? -21.734 0.543 0.225 1.0 91.17 154 B 1 -ATOM 1100 N N . VAL B ? 155 ? -20.196 0.748 -4.078 1.0 97.9 155 B 1 -ATOM 1101 C CA . VAL B ? 155 ? -20.373 -0.003 -5.332 1.0 97.7 155 B 1 -ATOM 1102 C C . VAL B ? 155 ? -21.424 -1.110 -5.242 1.0 97.78 155 B 1 -ATOM 1103 O O . VAL B ? 155 ? -21.805 -1.671 -6.262 1.0 96.23 155 B 1 -ATOM 1104 C CB . VAL B ? 155 ? -19.038 -0.599 -5.820 1.0 96.65 155 B 1 -ATOM 1105 C CG1 . VAL B ? 155 ? -17.975 0.484 -6.024 1.0 91.95 155 B 1 -ATOM 1106 C CG2 . VAL B ? 155 ? -18.486 -1.662 -4.851 1.0 92.17 155 B 1 -ATOM 1107 N N . TYR B ? 156 ? -21.878 -1.456 -4.036 1.0 97.39 156 B 1 -ATOM 1108 C CA . TYR B ? 156 ? -22.844 -2.535 -3.813 1.0 97.07 156 B 1 -ATOM 1109 C C . TYR B ? 156 ? -24.281 -2.030 -3.928 1.0 97.19 156 B 1 -ATOM 1110 O O . TYR B ? 156 ? -25.151 -2.742 -4.417 1.0 95.24 156 B 1 -ATOM 1111 C CB . TYR B ? 156 ? -22.601 -3.169 -2.438 1.0 96.64 156 B 1 -ATOM 1112 C CG . TYR B ? 156 ? -21.150 -3.505 -2.157 1.0 97.16 156 B 1 -ATOM 1113 C CD1 . TYR B ? 156 ? -20.566 -4.677 -2.684 1.0 95.44 156 B 1 -ATOM 1114 C CD2 . TYR B ? 156 ? -20.354 -2.606 -1.415 1.0 95.81 156 B 1 -ATOM 1115 C CE1 . TYR B ? 156 ? -19.203 -4.946 -2.473 1.0 95.0 156 B 1 -ATOM 1116 C CE2 . TYR B ? 156 ? -18.990 -2.864 -1.200 1.0 94.86 156 B 1 -ATOM 1117 C CZ . TYR B ? 156 ? -18.415 -4.034 -1.731 1.0 96.6 156 B 1 -ATOM 1118 O OH . TYR B ? 156 ? -17.082 -4.273 -1.531 1.0 95.72 156 B 1 -ATOM 1119 N N . ASN B ? 157 ? -24.517 -0.797 -3.481 1.0 97.55 157 B 1 -ATOM 1120 C CA . ASN B ? 157 ? -25.824 -0.134 -3.532 1.0 97.4 157 B 1 -ATOM 1121 C C . ASN B ? 157 ? -25.870 1.003 -4.569 1.0 97.83 157 B 1 -ATOM 1122 O O . ASN B ? 157 ? -26.925 1.589 -4.777 1.0 96.63 157 B 1 -ATOM 1123 C CB . ASN B ? 157 ? -26.156 0.384 -2.125 1.0 96.84 157 B 1 -ATOM 1124 C CG . ASN B ? 157 ? -26.128 -0.715 -1.078 1.0 95.36 157 B 1 -ATOM 1125 O OD1 . ASN B ? 157 ? -27.077 -1.464 -0.907 1.0 87.8 157 B 1 -ATOM 1126 N ND2 . ASN B ? 157 ? -25.039 -0.840 -0.349 1.0 87.05 157 B 1 -ATOM 1127 N N . ASP B ? 158 ? -24.739 1.316 -5.183 1.0 97.64 158 B 1 -ATOM 1128 C CA . ASP B ? 158 ? -24.530 2.413 -6.137 1.0 97.92 158 B 1 -ATOM 1129 C C . ASP B ? 158 ? -25.008 3.782 -5.621 1.0 98.2 158 B 1 -ATOM 1130 O O . ASP B ? 158 ? -25.701 4.544 -6.291 1.0 97.63 158 B 1 -ATOM 1131 C CB . ASP B ? 158 ? -25.037 2.030 -7.538 1.0 97.49 158 B 1 -ATOM 1132 C CG . ASP B ? 158 ? -24.432 2.918 -8.632 1.0 96.36 158 B 1 -ATOM 1133 O OD1 . ASP B ? 158 ? -23.279 3.389 -8.440 1.0 93.68 158 B 1 -ATOM 1134 O OD2 . ASP B ? 158 ? -25.087 3.097 -9.679 1.0 92.81 158 B 1 -ATOM 1135 N N . ILE B ? 159 ? -24.627 4.092 -4.384 1.0 98.38 159 B 1 -ATOM 1136 C CA . ILE B ? 159 ? -24.923 5.362 -3.715 1.0 98.46 159 B 1 -ATOM 1137 C C . ILE B ? 159 ? -23.667 5.923 -3.042 1.0 98.59 159 B 1 -ATOM 1138 O O . ILE B ? 159 ? -22.773 5.187 -2.627 1.0 98.32 159 B 1 -ATOM 1139 C CB . ILE B ? 159 ? -26.092 5.225 -2.709 1.0 98.22 159 B 1 -ATOM 1140 C CG1 . ILE B ? 159 ? -25.797 4.199 -1.596 1.0 97.4 159 B 1 -ATOM 1141 C CG2 . ILE B ? 159 ? -27.404 4.904 -3.452 1.0 96.74 159 B 1 -ATOM 1142 C CD1 . ILE B ? 159 ? -26.893 4.082 -0.526 1.0 96.31 159 B 1 -ATOM 1143 N N . LEU B ? 160 ? -23.606 7.243 -2.884 1.0 98.44 160 B 1 -ATOM 1144 C CA . LEU B ? 160 ? -22.489 7.894 -2.197 1.0 98.54 160 B 1 -ATOM 1145 C C . LEU B ? 160 ? -22.488 7.579 -0.692 1.0 98.62 160 B 1 -ATOM 1146 O O . LEU B ? 160 ? -23.531 7.335 -0.088 1.0 98.48 160 B 1 -ATOM 1147 C CB . LEU B ? 160 ? -22.538 9.408 -2.455 1.0 98.48 160 B 1 -ATOM 1148 C CG . LEU B ? 160 ? -22.270 9.820 -3.917 1.0 98.09 160 B 1 -ATOM 1149 C CD1 . LEU B ? 160 ? -22.537 11.314 -4.087 1.0 97.23 160 B 1 -ATOM 1150 C CD2 . LEU B ? 160 ? -20.819 9.554 -4.333 1.0 97.06 160 B 1 -ATOM 1151 N N . MET B ? 161 ? -21.320 7.689 -0.062 1.0 98.66 161 B 1 -ATOM 1152 C CA . MET B ? 161 ? -21.158 7.515 1.389 1.0 98.67 161 B 1 -ATOM 1153 C C . MET B ? 161 ? -22.149 8.362 2.212 1.0 98.76 161 B 1 -ATOM 1154 O O . MET B ? 161 ? -22.680 7.891 3.213 1.0 98.73 161 B 1 -ATOM 1155 C CB . MET B ? 161 ? -19.722 7.887 1.796 1.0 98.64 161 B 1 -ATOM 1156 C CG . MET B ? 161 ? -18.622 6.990 1.212 1.0 97.95 161 B 1 -ATOM 1157 S SD . MET B ? 161 ? -18.604 5.265 1.776 1.0 97.7 161 B 1 -ATOM 1158 C CE . MET B ? 161 ? -19.672 4.482 0.542 1.0 94.75 161 B 1 -ATOM 1159 N N . GLY B ? 162 ? -22.443 9.577 1.764 1.0 98.73 162 B 1 -ATOM 1160 C CA . GLY B ? 162 ? -23.423 10.442 2.429 1.0 98.79 162 B 1 -ATOM 1161 C C . GLY B ? 162 ? -24.852 9.890 2.402 1.0 98.84 162 B 1 -ATOM 1162 O O . GLY B ? 162 ? -25.572 10.034 3.385 1.0 98.76 162 B 1 -ATOM 1163 N N . ALA B ? 163 ? -25.253 9.198 1.330 1.0 98.78 163 B 1 -ATOM 1164 C CA . ALA B ? 163 ? -26.552 8.523 1.264 1.0 98.77 163 B 1 -ATOM 1165 C C . ALA B ? 163 ? -26.601 7.283 2.179 1.0 98.79 163 B 1 -ATOM 1166 O O . ALA B ? 163 ? -27.629 7.003 2.793 1.0 98.61 163 B 1 -ATOM 1167 C CB . ALA B ? 163 ? -26.845 8.171 -0.200 1.0 98.7 163 B 1 -ATOM 1168 N N . CYS B ? 164 ? -25.479 6.583 2.346 1.0 98.79 164 B 1 -ATOM 1169 C CA . CYS B ? 164 ? -25.350 5.533 3.360 1.0 98.77 164 B 1 -ATOM 1170 C C . CYS B ? 164 ? -25.503 6.109 4.782 1.0 98.81 164 B 1 -ATOM 1171 O O . CYS B ? 164 ? -26.190 5.523 5.617 1.0 98.72 164 B 1 -ATOM 1172 C CB . CYS B ? 164 ? -23.993 4.827 3.218 1.0 98.71 164 B 1 -ATOM 1173 S SG . CYS B ? 164 ? -23.728 4.141 1.558 1.0 98.41 164 B 1 -ATOM 1174 N N . ALA B ? 165 ? -24.909 7.282 5.046 1.0 98.81 165 B 1 -ATOM 1175 C CA . ALA B ? 165 ? -25.051 7.972 6.329 1.0 98.83 165 B 1 -ATOM 1176 C C . ALA B ? 165 ? -26.499 8.433 6.588 1.0 98.84 165 B 1 -ATOM 1177 O O . ALA B ? 165 ? -26.989 8.273 7.705 1.0 98.77 165 B 1 -ATOM 1178 C CB . ALA B ? 165 ? -24.061 9.139 6.375 1.0 98.79 165 B 1 -ATOM 1179 N N . ASP B ? 166 ? -27.212 8.919 5.563 1.0 98.82 166 B 1 -ATOM 1180 C CA . ASP B ? 166 ? -28.646 9.244 5.648 1.0 98.8 166 B 1 -ATOM 1181 C C . ASP B ? 166 ? -29.483 8.026 6.062 1.0 98.77 166 B 1 -ATOM 1182 O O . ASP B ? 166 ? -30.345 8.128 6.937 1.0 98.59 166 B 1 -ATOM 1183 C CB . ASP B ? 166 ? -29.159 9.762 4.291 1.0 98.7 166 B 1 -ATOM 1184 C CG . ASP B ? 166 ? -28.897 11.244 4.020 1.0 98.54 166 B 1 -ATOM 1185 O OD1 . ASP B ? 166 ? -28.805 12.030 4.989 1.0 96.75 166 B 1 -ATOM 1186 O OD2 . ASP B ? 166 ? -28.907 11.627 2.829 1.0 96.99 166 B 1 -ATOM 1187 N N . LYS B ? 167 ? -29.201 6.850 5.475 1.0 98.72 167 B 1 -ATOM 1188 C CA . LYS B ? 167 ? -29.876 5.594 5.830 1.0 98.61 167 B 1 -ATOM 1189 C C . LYS B ? 167 ? -29.636 5.231 7.299 1.0 98.68 167 B 1 -ATOM 1190 O O . LYS B ? 167 ? -30.592 4.920 8.007 1.0 98.39 167 B 1 -ATOM 1191 C CB . LYS B ? 167 ? -29.437 4.485 4.856 1.0 98.22 167 B 1 -ATOM 1192 C CG . LYS B ? 167 ? -30.070 3.102 5.133 1.0 96.31 167 B 1 -ATOM 1193 C CD . LYS B ? 167 ? -29.148 2.193 5.965 1.0 92.55 167 B 1 -ATOM 1194 C CE . LYS B ? 167 ? -29.762 0.808 6.190 1.0 89.95 167 B 1 -ATOM 1195 N NZ . LYS B ? 167 ? -28.818 -0.113 6.854 1.0 84.89 167 B 1 -ATOM 1196 N N . VAL B ? 168 ? -28.399 5.300 7.765 1.0 98.72 168 B 1 -ATOM 1197 C CA . VAL B ? 168 ? -28.046 5.024 9.170 1.0 98.74 168 B 1 -ATOM 1198 C C . VAL B ? 168 ? -28.747 6.011 10.106 1.0 98.77 168 B 1 -ATOM 1199 O O . VAL B ? 168 ? -29.375 5.591 11.075 1.0 98.66 168 B 1 -ATOM 1200 C CB . VAL B ? 168 ? -26.516 5.038 9.368 1.0 98.61 168 B 1 -ATOM 1201 C CG1 . VAL B ? 168 ? -26.102 4.970 10.842 1.0 97.82 168 B 1 -ATOM 1202 C CG2 . VAL B ? 168 ? -25.871 3.833 8.663 1.0 97.81 168 B 1 -ATOM 1203 N N . ALA B ? 169 ? -28.718 7.311 9.787 1.0 98.82 169 B 1 -ATOM 1204 C CA . ALA B ? 169 ? -29.383 8.337 10.588 1.0 98.82 169 B 1 -ATOM 1205 C C . ALA B ? 169 ? -30.891 8.078 10.721 1.0 98.77 169 B 1 -ATOM 1206 O O . ALA B ? 169 ? -31.434 8.136 11.824 1.0 98.59 169 B 1 -ATOM 1207 C CB . ALA B ? 169 ? -29.110 9.703 9.951 1.0 98.76 169 B 1 -ATOM 1208 N N . LYS B ? 170 ? -31.552 7.722 9.620 1.0 98.73 170 B 1 -ATOM 1209 C CA . LYS B ? 170 ? -32.990 7.416 9.599 1.0 98.63 170 B 1 -ATOM 1210 C C . LYS B ? 170 ? -33.310 6.139 10.380 1.0 98.58 170 B 1 -ATOM 1211 O O . LYS B ? 170 ? -34.251 6.122 11.165 1.0 98.12 170 B 1 -ATOM 1212 C CB . LYS B ? 170 ? -33.465 7.361 8.132 1.0 98.29 170 B 1 -ATOM 1213 C CG . LYS B ? 170 ? -34.994 7.507 7.974 1.0 93.63 170 B 1 -ATOM 1214 C CD . LYS B ? 170 ? -35.377 7.646 6.485 1.0 88.66 170 B 1 -ATOM 1215 C CE . LYS B ? 170 ? -36.868 7.995 6.299 1.0 77.6 170 B 1 -ATOM 1216 N NZ . LYS B ? 170 ? -37.216 8.345 4.884 1.0 67.39 170 B 1 -ATOM 1217 N N . GLN B ? 171 ? -32.511 5.093 10.202 1.0 98.58 171 B 1 -ATOM 1218 C CA . GLN B ? 171 ? -32.719 3.802 10.868 1.0 98.45 171 B 1 -ATOM 1219 C C . GLN B ? 171 ? -32.548 3.881 12.389 1.0 98.44 171 B 1 -ATOM 1220 O O . GLN B ? 171 ? -33.299 3.242 13.127 1.0 97.87 171 B 1 -ATOM 1221 C CB . GLN B ? 171 ? -31.764 2.771 10.252 1.0 98.18 171 B 1 -ATOM 1222 C CG . GLN B ? 171 ? -31.933 1.372 10.876 1.0 96.24 171 B 1 -ATOM 1223 C CD . GLN B ? 171 ? -31.061 0.302 10.212 1.0 95.3 171 B 1 -ATOM 1224 O OE1 . GLN B ? 171 ? -30.454 0.485 9.173 1.0 89.66 171 B 1 -ATOM 1225 N NE2 . GLN B ? 171 ? -30.979 -0.874 10.790 1.0 87.85 171 B 1 -ATOM 1226 N N . PHE B ? 172 ? -31.583 4.657 12.867 1.0 98.56 172 B 1 -ATOM 1227 C CA . PHE B ? 172 ? -31.235 4.757 14.289 1.0 98.44 172 B 1 -ATOM 1228 C C . PHE B ? 172 ? -31.695 6.066 14.946 1.0 98.41 172 B 1 -ATOM 1229 O O . PHE B ? 172 ? -31.243 6.399 16.044 1.0 97.64 172 B 1 -ATOM 1230 C CB . PHE B ? 172 ? -29.740 4.483 14.461 1.0 98.27 172 B 1 -ATOM 1231 C CG . PHE B ? 172 ? -29.323 3.091 14.031 1.0 98.03 172 B 1 -ATOM 1232 C CD1 . PHE B ? 172 ? -29.648 1.978 14.833 1.0 96.38 172 B 1 -ATOM 1233 C CD2 . PHE B ? 172 ? -28.631 2.892 12.825 1.0 96.5 172 B 1 -ATOM 1234 C CE1 . PHE B ? 172 ? -29.273 0.685 14.437 1.0 95.33 172 B 1 -ATOM 1235 C CE2 . PHE B ? 172 ? -28.256 1.599 12.421 1.0 95.38 172 B 1 -ATOM 1236 C CZ . PHE B ? 172 ? -28.576 0.492 13.228 1.0 95.83 172 B 1 -ATOM 1237 N N . ALA B ? 173 ? -32.602 6.806 14.291 1.0 98.44 173 B 1 -ATOM 1238 C CA . ALA B ? 173 ? -33.193 8.049 14.789 1.0 98.35 173 B 1 -ATOM 1239 C C . ALA B ? 173 ? -32.163 9.109 15.241 1.0 98.47 173 B 1 -ATOM 1240 O O . ALA B ? 173 ? -32.359 9.798 16.243 1.0 97.66 173 B 1 -ATOM 1241 C CB . ALA B ? 173 ? -34.268 7.708 15.830 1.0 97.83 173 B 1 -ATOM 1242 N N . ILE B ? 174 ? -31.071 9.258 14.502 1.0 98.7 174 B 1 -ATOM 1243 C CA . ILE B ? 174 ? -30.107 10.354 14.685 1.0 98.77 174 B 1 -ATOM 1244 C C . ILE B ? 174 ? -30.628 11.568 13.904 1.0 98.8 174 B 1 -ATOM 1245 O O . ILE B ? 174 ? -30.482 11.656 12.685 1.0 98.57 174 B 1 -ATOM 1246 C CB . ILE B ? 174 ? -28.686 9.945 14.248 1.0 98.66 174 B 1 -ATOM 1247 C CG1 . ILE B ? 174 ? -28.201 8.605 14.848 1.0 97.33 174 B 1 -ATOM 1248 C CG2 . ILE B ? 174 ? -27.693 11.073 14.583 1.0 98.08 174 B 1 -ATOM 1249 C CD1 . ILE B ? 174 ? -28.097 8.555 16.370 1.0 91.22 174 B 1 -ATOM 1250 N N . THR B ? 175 ? -31.262 12.498 14.594 1.0 98.69 175 B 1 -ATOM 1251 C CA . THR B ? 175 ? -32.012 13.597 13.975 1.0 98.68 175 B 1 -ATOM 1252 C C . THR B ? 175 ? -31.114 14.617 13.278 1.0 98.79 175 B 1 -ATOM 1253 O O . THR B ? 175 ? -29.918 14.734 13.547 1.0 98.63 175 B 1 -ATOM 1254 C CB . THR B ? 175 ? -32.913 14.315 14.993 1.0 98.38 175 B 1 -ATOM 1255 O OG1 . THR B ? 175 ? -32.131 14.977 15.951 1.0 96.34 175 B 1 -ATOM 1256 C CG2 . THR B ? 175 ? -33.872 13.368 15.715 1.0 95.69 175 B 1 -ATOM 1257 N N . ARG B ? 176 ? -31.714 15.416 12.381 1.0 98.59 176 B 1 -ATOM 1258 C CA . ARG B ? 176 ? -31.048 16.552 11.736 1.0 98.65 176 B 1 -ATOM 1259 C C . ARG B ? 176 ? -30.550 17.568 12.766 1.0 98.76 176 B 1 -ATOM 1260 O O . ARG B ? 176 ? -29.406 18.010 12.659 1.0 98.61 176 B 1 -ATOM 1261 C CB . ARG B ? 176 ? -32.014 17.179 10.720 1.0 98.2 176 B 1 -ATOM 1262 C CG . ARG B ? 176 ? -31.506 18.493 10.112 1.0 96.55 176 B 1 -ATOM 1263 C CD . ARG B ? 176 ? -30.194 18.350 9.331 1.0 95.15 176 B 1 -ATOM 1264 N NE . ARG B ? 176 ? -29.738 19.665 8.886 1.0 94.93 176 B 1 -ATOM 1265 C CZ . ARG B ? 176 ? -30.150 20.353 7.826 1.0 96.11 176 B 1 -ATOM 1266 N NH1 . ARG B ? 176 ? -30.986 19.868 6.960 1.0 91.66 176 B 1 -ATOM 1267 N NH2 . ARG B ? 176 ? -29.722 21.565 7.656 1.0 93.37 176 B 1 -ATOM 1268 N N . GLU B ? 177 ? -31.375 17.900 13.762 1.0 98.67 177 B 1 -ATOM 1269 C CA . GLU B ? 177 ? -30.974 18.816 14.841 1.0 98.66 177 B 1 -ATOM 1270 C C . GLU B ? 177 ? -29.750 18.307 15.611 1.0 98.77 177 B 1 -ATOM 1271 O O . GLU B ? 177 ? -28.851 19.086 15.905 1.0 98.6 177 B 1 -ATOM 1272 C CB . GLU B ? 177 ? -32.114 19.030 15.852 1.0 98.3 177 B 1 -ATOM 1273 C CG . GLU B ? 177 ? -33.126 20.110 15.449 1.0 84.25 177 B 1 -ATOM 1274 C CD . GLU B ? 177 ? -34.357 19.603 14.694 1.0 76.04 177 B 1 -ATOM 1275 O OE1 . GLU B ? 177 ? -35.171 20.475 14.318 1.0 69.48 177 B 1 -ATOM 1276 O OE2 . GLU B ? 177 ? -34.471 18.370 14.476 1.0 69.86 177 B 1 -ATOM 1277 N N . GLU B ? 178 ? -29.696 17.018 15.936 1.0 98.76 178 B 1 -ATOM 1278 C CA . GLU B ? 178 ? -28.545 16.439 16.638 1.0 98.74 178 B 1 -ATOM 1279 C C . GLU B ? 178 ? -27.267 16.515 15.795 1.0 98.83 178 B 1 -ATOM 1280 O O . GLU B ? 178 ? -26.216 16.900 16.310 1.0 98.73 178 B 1 -ATOM 1281 C CB . GLU B ? 178 ? -28.827 14.980 17.016 1.0 98.49 178 B 1 -ATOM 1282 C CG . GLU B ? 178 ? -29.831 14.851 18.173 1.0 94.0 178 B 1 -ATOM 1283 C CD . GLU B ? 178 ? -30.120 13.376 18.483 1.0 93.98 178 B 1 -ATOM 1284 O OE1 . GLU B ? 178 ? -30.018 12.983 19.666 1.0 86.39 178 B 1 -ATOM 1285 O OE2 . GLU B ? 178 ? -30.404 12.591 17.550 1.0 88.62 178 B 1 -ATOM 1286 N N . GLN B ? 179 ? -27.358 16.202 14.505 1.0 98.87 179 B 1 -ATOM 1287 C CA . GLN B ? 179 ? -26.223 16.270 13.581 1.0 98.89 179 B 1 -ATOM 1288 C C . GLN B ? 179 ? -25.704 17.703 13.417 1.0 98.91 179 B 1 -ATOM 1289 O O . GLN B ? 179 ? -24.499 17.935 13.489 1.0 98.86 179 B 1 -ATOM 1290 C CB . GLN B ? 179 ? -26.624 15.687 12.221 1.0 98.87 179 B 1 -ATOM 1291 C CG . GLN B ? 179 ? -26.849 14.167 12.259 1.0 98.69 179 B 1 -ATOM 1292 C CD . GLN B ? 179 ? -27.392 13.651 10.935 1.0 98.69 179 B 1 -ATOM 1293 O OE1 . GLN B ? 179 ? -26.810 13.824 9.877 1.0 93.91 179 B 1 -ATOM 1294 N NE2 . GLN B ? 179 ? -28.536 13.013 10.945 1.0 93.79 179 B 1 -ATOM 1295 N N . ASP B ? 180 ? -26.606 18.675 13.243 1.0 98.85 180 B 1 -ATOM 1296 C CA . ASP B ? 180 ? -26.231 20.087 13.114 1.0 98.84 180 B 1 -ATOM 1297 C C . ASP B ? 180 ? -25.637 20.637 14.422 1.0 98.84 180 B 1 -ATOM 1298 O O . ASP B ? 180 ? -24.636 21.354 14.408 1.0 98.68 180 B 1 -ATOM 1299 C CB . ASP B ? 180 ? -27.452 20.918 12.676 1.0 98.77 180 B 1 -ATOM 1300 C CG . ASP B ? 180 ? -27.856 20.740 11.205 1.0 98.7 180 B 1 -ATOM 1301 O OD1 . ASP B ? 180 ? -27.149 20.065 10.428 1.0 97.77 180 B 1 -ATOM 1302 O OD2 . ASP B ? 180 ? -28.868 21.353 10.793 1.0 97.78 180 B 1 -ATOM 1303 N N . LYS B ? 181 ? -26.206 20.261 15.571 1.0 98.82 181 B 1 -ATOM 1304 C CA . LYS B ? 181 ? -25.678 20.644 16.887 1.0 98.78 181 B 1 -ATOM 1305 C C . LYS B ? 181 ? -24.275 20.079 17.116 1.0 98.83 181 B 1 -ATOM 1306 O O . LYS B ? 181 ? -23.402 20.793 17.610 1.0 98.67 181 B 1 -ATOM 1307 C CB . LYS B ? 181 ? -26.673 20.178 17.960 1.0 98.41 181 B 1 -ATOM 1308 C CG . LYS B ? 181 ? -26.432 20.846 19.322 1.0 89.56 181 B 1 -ATOM 1309 C CD . LYS B ? 181 ? -27.458 20.320 20.328 1.0 87.03 181 B 1 -ATOM 1310 C CE . LYS B ? 181 ? -27.298 21.003 21.688 1.0 72.97 181 B 1 -ATOM 1311 N NZ . LYS B ? 181 ? -28.190 20.390 22.699 1.0 64.3 181 B 1 -ATOM 1312 N N . TYR B ? 182 ? -24.042 18.825 16.721 1.0 98.84 182 B 1 -ATOM 1313 C CA . TYR B ? 182 ? -22.720 18.204 16.783 1.0 98.87 182 B 1 -ATOM 1314 C C . TYR B ? 182 ? -21.722 18.877 15.831 1.0 98.9 182 B 1 -ATOM 1315 O O . TYR B ? 182 ? -20.598 19.166 16.231 1.0 98.84 182 B 1 -ATOM 1316 C CB . TYR B ? 182 ? -22.838 16.703 16.494 1.0 98.84 182 B 1 -ATOM 1317 C CG . TYR B ? 182 ? -21.521 15.985 16.692 1.0 98.83 182 B 1 -ATOM 1318 C CD1 . TYR B ? 182 ? -20.566 15.953 15.658 1.0 98.56 182 B 1 -ATOM 1319 C CD2 . TYR B ? 182 ? -21.198 15.432 17.947 1.0 98.57 182 B 1 -ATOM 1320 C CE1 . TYR B ? 182 ? -19.296 15.397 15.880 1.0 98.39 182 B 1 -ATOM 1321 C CE2 . TYR B ? 182 ? -19.933 14.870 18.182 1.0 98.33 182 B 1 -ATOM 1322 C CZ . TYR B ? 182 ? -18.978 14.869 17.146 1.0 98.5 182 B 1 -ATOM 1323 O OH . TYR B ? 182 ? -17.724 14.372 17.384 1.0 97.92 182 B 1 -ATOM 1324 N N . ALA B ? 183 ? -22.140 19.202 14.607 1.0 98.89 183 B 1 -ATOM 1325 C CA . ALA B ? 183 ? -21.301 19.928 13.653 1.0 98.89 183 B 1 -ATOM 1326 C C . ALA B ? 183 ? -20.873 21.297 14.206 1.0 98.89 183 B 1 -ATOM 1327 O O . ALA B ? 183 ? -19.689 21.633 14.192 1.0 98.82 183 B 1 -ATOM 1328 C CB . ALA B ? 183 ? -22.061 20.063 12.331 1.0 98.84 183 B 1 -ATOM 1329 N N . ILE B ? 184 ? -21.808 22.058 14.782 1.0 98.85 184 B 1 -ATOM 1330 C CA . ILE B ? 184 ? -21.514 23.334 15.457 1.0 98.82 184 B 1 -ATOM 1331 C C . ILE B ? 184 ? -20.500 23.133 16.592 1.0 98.83 184 B 1 -ATOM 1332 O O . ILE B ? 184 ? -19.577 23.939 16.739 1.0 98.69 184 B 1 -ATOM 1333 C CB . ILE B ? 184 ? -22.824 23.981 15.971 1.0 98.69 184 B 1 -ATOM 1334 C CG1 . ILE B ? 184 ? -23.674 24.489 14.780 1.0 98.02 184 B 1 -ATOM 1335 C CG2 . ILE B ? 184 ? -22.551 25.143 16.952 1.0 98.25 184 B 1 -ATOM 1336 C CD1 . ILE B ? 184 ? -25.126 24.832 15.142 1.0 95.17 184 B 1 -ATOM 1337 N N . LEU B ? 185 ? -20.650 22.068 17.387 1.0 98.77 185 B 1 -ATOM 1338 C CA . LEU B ? 185 ? -19.708 21.734 18.454 1.0 98.76 185 B 1 -ATOM 1339 C C . LEU B ? 185 ? -18.313 21.431 17.892 1.0 98.83 185 B 1 -ATOM 1340 O O . LEU B ? 185 ? -17.334 21.970 18.406 1.0 98.75 185 B 1 -ATOM 1341 C CB . LEU B ? 185 ? -20.275 20.562 19.275 1.0 98.62 185 B 1 -ATOM 1342 C CG . LEU B ? 185 ? -19.392 20.133 20.464 1.0 97.39 185 B 1 -ATOM 1343 C CD1 . LEU B ? 185 ? -19.263 21.238 21.513 1.0 95.43 185 B 1 -ATOM 1344 C CD2 . LEU B ? 185 ? -20.005 18.902 21.130 1.0 95.36 185 B 1 -ATOM 1345 N N . SER B ? 186 ? -18.219 20.648 16.815 1.0 98.84 186 B 1 -ATOM 1346 C CA . SER B ? 186 ? -16.957 20.342 16.131 1.0 98.88 186 B 1 -ATOM 1347 C C . SER B ? 186 ? -16.249 21.622 15.661 1.0 98.89 186 B 1 -ATOM 1348 O O . SER B ? 186 ? -15.092 21.846 16.010 1.0 98.85 186 B 1 -ATOM 1349 C CB . SER B ? 186 ? -17.213 19.385 14.960 1.0 98.87 186 B 1 -ATOM 1350 O OG . SER B ? 186 ? -15.980 18.938 14.415 1.0 98.59 186 B 1 -ATOM 1351 N N . TYR B ? 187 ? -16.959 22.522 14.976 1.0 98.87 187 B 1 -ATOM 1352 C CA . TYR B ? 187 ? -16.402 23.809 14.526 1.0 98.86 187 B 1 -ATOM 1353 C C . TYR B ? 187 ? -15.956 24.714 15.685 1.0 98.84 187 B 1 -ATOM 1354 O O . TYR B ? 187 ? -14.929 25.383 15.588 1.0 98.66 187 B 1 -ATOM 1355 C CB . TYR B ? 187 ? -17.428 24.548 13.659 1.0 98.8 187 B 1 -ATOM 1356 C CG . TYR B ? 187 ? -17.438 24.106 12.212 1.0 98.72 187 B 1 -ATOM 1357 C CD1 . TYR B ? 187 ? -16.417 24.531 11.340 1.0 97.96 187 B 1 -ATOM 1358 C CD2 . TYR B ? 187 ? -18.461 23.273 11.721 1.0 98.19 187 B 1 -ATOM 1359 C CE1 . TYR B ? 187 ? -16.412 24.123 9.995 1.0 97.84 187 B 1 -ATOM 1360 C CE2 . TYR B ? 187 ? -18.466 22.855 10.378 1.0 97.7 187 B 1 -ATOM 1361 C CZ . TYR B ? 187 ? -17.433 23.283 9.517 1.0 97.98 187 B 1 -ATOM 1362 O OH . TYR B ? 187 ? -17.425 22.867 8.209 1.0 96.85 187 B 1 -ATOM 1363 N N . LYS B ? 188 ? -16.705 24.738 16.798 1.0 98.8 188 B 1 -ATOM 1364 C CA . LYS B ? 188 ? -16.304 25.510 17.986 1.0 98.76 188 B 1 -ATOM 1365 C C . LYS B ? 188 ? -15.058 24.923 18.649 1.0 98.8 188 B 1 -ATOM 1366 O O . LYS B ? 188 ? -14.170 25.679 19.044 1.0 98.61 188 B 1 -ATOM 1367 C CB . LYS B ? 188 ? -17.468 25.599 18.982 1.0 98.64 188 B 1 -ATOM 1368 C CG . LYS B ? 188 ? -18.542 26.587 18.499 1.0 97.04 188 B 1 -ATOM 1369 C CD . LYS B ? 188 ? -19.689 26.667 19.511 1.0 91.61 188 B 1 -ATOM 1370 C CE . LYS B ? 188 ? -20.717 27.698 19.033 1.0 87.22 188 B 1 -ATOM 1371 N NZ . LYS B ? 188 ? -21.839 27.849 19.992 1.0 77.04 188 B 1 -ATOM 1372 N N . ARG B ? 189 ? -14.974 23.601 18.746 1.0 98.85 189 B 1 -ATOM 1373 C CA . ARG B ? 189 ? -13.827 22.897 19.336 1.0 98.86 189 B 1 -ATOM 1374 C C . ARG B ? 189 ? -12.560 23.045 18.492 1.0 98.88 189 B 1 -ATOM 1375 O O . ARG B ? 189 ? -11.516 23.364 19.056 1.0 98.74 189 B 1 -ATOM 1376 C CB . ARG B ? 189 ? -14.178 21.419 19.531 1.0 98.69 189 B 1 -ATOM 1377 C CG . ARG B ? 189 ? -15.099 21.185 20.740 1.0 98.13 189 B 1 -ATOM 1378 C CD . ARG B ? 189 ? -15.491 19.709 20.782 1.0 97.15 189 B 1 -ATOM 1379 N NE . ARG B ? 189 ? -16.146 19.328 22.047 1.0 95.76 189 B 1 -ATOM 1380 C CZ . ARG B ? 189 ? -16.590 18.120 22.345 1.0 95.36 189 B 1 -ATOM 1381 N NH1 . ARG B ? 189 ? -16.547 17.141 21.489 1.0 91.07 189 B 1 -ATOM 1382 N NH2 . ARG B ? 189 ? -17.080 17.867 23.521 1.0 91.54 189 B 1 -ATOM 1383 N N . SER B ? 190 ? -12.643 22.888 17.176 1.0 98.89 190 B 1 -ATOM 1384 C CA . SER B ? 190 ? -11.486 23.071 16.287 1.0 98.86 190 B 1 -ATOM 1385 C C . SER B ? 190 ? -10.978 24.516 16.291 1.0 98.87 190 B 1 -ATOM 1386 O O . SER B ? 190 ? -9.775 24.740 16.409 1.0 98.71 190 B 1 -ATOM 1387 C CB . SER B ? 190 ? -11.814 22.608 14.867 1.0 98.56 190 B 1 -ATOM 1388 O OG . SER B ? 190 ? -12.919 23.309 14.335 1.0 90.94 190 B 1 -ATOM 1389 N N . ALA B ? 191 ? -11.883 25.504 16.274 1.0 98.79 191 B 1 -ATOM 1390 C CA . ALA B ? 191 ? -11.507 26.914 16.377 1.0 98.72 191 B 1 -ATOM 1391 C C . ALA B ? 191 ? -10.835 27.241 17.725 1.0 98.73 191 B 1 -ATOM 1392 O O . ALA B ? 191 ? -9.844 27.970 17.757 1.0 98.5 191 B 1 -ATOM 1393 C CB . ALA B ? 191 ? -12.754 27.778 16.147 1.0 98.51 191 B 1 -ATOM 1394 N N . ALA B ? 192 ? -11.344 26.689 18.829 1.0 98.74 192 B 1 -ATOM 1395 C CA . ALA B ? 192 ? -10.719 26.845 20.142 1.0 98.72 192 B 1 -ATOM 1396 C C . ALA B ? 192 ? -9.331 26.183 20.189 1.0 98.73 192 B 1 -ATOM 1397 O O . ALA B ? 192 ? -8.376 26.818 20.635 1.0 98.5 192 B 1 -ATOM 1398 C CB . ALA B ? 192 ? -11.661 26.285 21.215 1.0 98.64 192 B 1 -ATOM 1399 N N . ALA B ? 193 ? -9.202 24.961 19.658 1.0 98.81 193 B 1 -ATOM 1400 C CA . ALA B ? 193 ? -7.937 24.233 19.600 1.0 98.79 193 B 1 -ATOM 1401 C C . ALA B ? 193 ? -6.866 24.988 18.795 1.0 98.76 193 B 1 -ATOM 1402 O O . ALA B ? 193 ? -5.733 25.129 19.256 1.0 98.54 193 B 1 -ATOM 1403 C CB . ALA B ? 193 ? -8.207 22.844 19.009 1.0 98.72 193 B 1 -ATOM 1404 N N . TRP B ? 194 ? -7.228 25.536 17.633 1.0 98.71 194 B 1 -ATOM 1405 C CA . TRP B ? 194 ? -6.332 26.384 16.842 1.0 98.66 194 B 1 -ATOM 1406 C C . TRP B ? 194 ? -5.928 27.659 17.588 1.0 98.52 194 B 1 -ATOM 1407 O O . TRP B ? 194 ? -4.752 28.012 17.621 1.0 97.99 194 B 1 -ATOM 1408 C CB . TRP B ? 194 ? -6.986 26.705 15.494 1.0 98.56 194 B 1 -ATOM 1409 C CG . TRP B ? 194 ? -6.582 25.743 14.422 1.0 98.43 194 B 1 -ATOM 1410 C CD1 . TRP B ? 194 ? -7.322 24.740 13.905 1.0 97.59 194 B 1 -ATOM 1411 C CD2 . TRP B ? 194 ? -5.271 25.654 13.786 1.0 98.28 194 B 1 -ATOM 1412 N NE1 . TRP B ? 194 ? -6.566 24.023 12.986 1.0 97.55 194 B 1 -ATOM 1413 C CE2 . TRP B ? 194 ? -5.293 24.541 12.901 1.0 97.79 194 B 1 -ATOM 1414 C CE3 . TRP B ? 194 ? -4.072 26.389 13.898 1.0 97.58 194 B 1 -ATOM 1415 C CZ2 . TRP B ? 194 ? -4.146 24.145 12.179 1.0 96.99 194 B 1 -ATOM 1416 C CZ3 . TRP B ? 194 ? -2.933 25.998 13.170 1.0 96.61 194 B 1 -ATOM 1417 C CH2 . TRP B ? 194 ? -2.967 24.883 12.332 1.0 96.54 194 B 1 -ATOM 1418 N N . LYS B ? 195 ? -6.891 28.321 18.248 1.0 98.4 195 B 1 -ATOM 1419 C CA . LYS B ? 195 ? -6.638 29.541 19.022 1.0 98.24 195 B 1 -ATOM 1420 C C . LYS B ? 195 ? -5.697 29.303 20.207 1.0 98.16 195 B 1 -ATOM 1421 O O . LYS B ? 195 ? -4.901 30.180 20.533 1.0 97.57 195 B 1 -ATOM 1422 C CB . LYS B ? 195 ? -7.987 30.108 19.476 1.0 98.02 195 B 1 -ATOM 1423 C CG . LYS B ? 195 ? -7.840 31.503 20.101 1.0 94.02 195 B 1 -ATOM 1424 C CD . LYS B ? 195 ? -9.207 32.026 20.550 1.0 89.51 195 B 1 -ATOM 1425 C CE . LYS B ? 195 ? -9.033 33.409 21.184 1.0 79.24 195 B 1 -ATOM 1426 N NZ . LYS B ? 195 ? -10.305 33.912 21.739 1.0 69.24 195 B 1 -ATOM 1427 N N . GLU B ? 196 ? -5.777 28.131 20.834 1.0 98.49 196 B 1 -ATOM 1428 C CA . GLU B ? 196 ? -4.912 27.728 21.952 1.0 98.29 196 B 1 -ATOM 1429 C C . GLU B ? 196 ? -3.567 27.121 21.499 1.0 98.23 196 B 1 -ATOM 1430 O O . GLU B ? 196 ? -2.723 26.792 22.331 1.0 97.28 196 B 1 -ATOM 1431 C CB . GLU B ? 196 ? -5.664 26.768 22.886 1.0 97.89 196 B 1 -ATOM 1432 C CG . GLU B ? 196 ? -6.887 27.422 23.547 1.0 91.55 196 B 1 -ATOM 1433 C CD . GLU B ? 196 ? -7.023 27.163 25.054 1.0 83.7 196 B 1 -ATOM 1434 O OE1 . GLU B ? 196 ? -7.774 27.939 25.694 1.0 73.95 196 B 1 -ATOM 1435 O OE2 . GLU B ? 196 ? -6.360 26.232 25.575 1.0 75.07 196 B 1 -ATOM 1436 N N . GLY B ? 197 ? -3.342 26.967 20.196 1.0 98.29 197 B 1 -ATOM 1437 C CA . GLY B ? 197 ? -2.102 26.398 19.657 1.0 98.04 197 B 1 -ATOM 1438 C C . GLY B ? 197 ? -1.940 24.895 19.904 1.0 98.19 197 B 1 -ATOM 1439 O O . GLY B ? 197 ? -0.813 24.390 19.882 1.0 97.18 197 B 1 -ATOM 1440 N N . ILE B ? 198 ? -3.037 24.163 20.112 1.0 98.38 198 B 1 -ATOM 1441 C CA . ILE B ? 198 ? -3.035 22.719 20.413 1.0 98.33 198 B 1 -ATOM 1442 C C . ILE B ? 198 ? -2.286 21.904 19.352 1.0 98.26 198 B 1 -ATOM 1443 O O . ILE B ? 198 ? -1.556 20.973 19.685 1.0 97.28 198 B 1 -ATOM 1444 C CB . ILE B ? 198 ? -4.489 22.226 20.577 1.0 98.0 198 B 1 -ATOM 1445 C CG1 . ILE B ? 198 ? -5.188 22.852 21.808 1.0 96.43 198 B 1 -ATOM 1446 C CG2 . ILE B ? 198 ? -4.583 20.686 20.642 1.0 96.82 198 B 1 -ATOM 1447 C CD1 . ILE B ? 198 ? -4.614 22.471 23.177 1.0 92.21 198 B 1 -ATOM 1448 N N . PHE B ? 199 ? -2.423 22.271 18.082 1.0 98.44 199 B 1 -ATOM 1449 C CA . PHE B ? 199 ? -1.835 21.541 16.961 1.0 98.33 199 B 1 -ATOM 1450 C C . PHE B ? 199 ? -0.356 21.868 16.701 1.0 98.0 199 B 1 -ATOM 1451 O O . PHE B ? 199 ? 0.272 21.225 15.863 1.0 96.75 199 B 1 -ATOM 1452 C CB . PHE B ? 199 ? -2.694 21.761 15.712 1.0 98.24 199 B 1 -ATOM 1453 C CG . PHE B ? 199 ? -4.146 21.361 15.874 1.0 98.53 199 B 1 -ATOM 1454 C CD1 . PHE B ? 199 ? -4.486 20.029 16.182 1.0 97.96 199 B 1 -ATOM 1455 C CD2 . PHE B ? 199 ? -5.165 22.317 15.723 1.0 97.95 199 B 1 -ATOM 1456 C CE1 . PHE B ? 199 ? -5.832 19.656 16.331 1.0 97.55 199 B 1 -ATOM 1457 C CE2 . PHE B ? 199 ? -6.516 21.948 15.866 1.0 97.51 199 B 1 -ATOM 1458 C CZ . PHE B ? 199 ? -6.851 20.615 16.171 1.0 98.02 199 B 1 -ATOM 1459 N N . ALA B ? 200 ? 0.238 22.817 17.433 1.0 96.89 200 B 1 -ATOM 1460 C CA . ALA B ? 200 ? 1.603 23.292 17.178 1.0 95.82 200 B 1 -ATOM 1461 C C . ALA B ? 200 ? 2.681 22.188 17.211 1.0 95.86 200 B 1 -ATOM 1462 O O . ALA B ? 200 ? 3.721 22.314 16.569 1.0 94.24 200 B 1 -ATOM 1463 C CB . ALA B ? 200 ? 1.926 24.382 18.204 1.0 94.16 200 B 1 -ATOM 1464 N N . LYS B ? 201 ? 2.442 21.100 17.948 1.0 96.37 201 B 1 -ATOM 1465 C CA . LYS B ? 201 ? 3.372 19.961 18.030 1.0 95.72 201 B 1 -ATOM 1466 C C . LYS B ? 201 ? 3.287 19.011 16.837 1.0 96.87 201 B 1 -ATOM 1467 O O . LYS B ? 201 ? 4.222 18.247 16.625 1.0 95.41 201 B 1 -ATOM 1468 C CB . LYS B ? 201 ? 3.122 19.178 19.324 1.0 92.5 201 B 1 -ATOM 1469 C CG . LYS B ? 201 ? 3.534 19.968 20.572 1.0 83.21 201 B 1 -ATOM 1470 C CD . LYS B ? 201 ? 3.321 19.092 21.809 1.0 78.87 201 B 1 -ATOM 1471 C CE . LYS B ? 201 ? 3.726 19.849 23.074 1.0 67.89 201 B 1 -ATOM 1472 N NZ . LYS B ? 201 ? 3.445 19.036 24.279 1.0 59.88 201 B 1 -ATOM 1473 N N . GLU B ? 202 ? 2.167 19.016 16.120 1.0 97.77 202 B 1 -ATOM 1474 C CA . GLU B ? 202 ? 1.890 18.029 15.069 1.0 97.9 202 B 1 -ATOM 1475 C C . GLU B ? 202 ? 1.816 18.622 13.658 1.0 98.48 202 B 1 -ATOM 1476 O O . GLU B ? 202 ? 2.053 17.901 12.694 1.0 98.11 202 B 1 -ATOM 1477 C CB . GLU B ? 202 ? 0.627 17.230 15.425 1.0 95.32 202 B 1 -ATOM 1478 C CG . GLU B ? 202 ? -0.689 18.019 15.345 1.0 90.2 202 B 1 -ATOM 1479 C CD . GLU B ? 202 ? -1.876 17.210 15.891 1.0 95.62 202 B 1 -ATOM 1480 O OE1 . GLU B ? 202 ? -2.805 16.909 15.120 1.0 91.43 202 B 1 -ATOM 1481 O OE2 . GLU B ? 202 ? -1.856 16.886 17.102 1.0 93.72 202 B 1 -ATOM 1482 N N . ILE B ? 203 ? 1.534 19.918 13.530 1.0 98.45 203 B 1 -ATOM 1483 C CA . ILE B ? 203 ? 1.507 20.611 12.237 1.0 98.35 203 B 1 -ATOM 1484 C C . ILE B ? 203 ? 2.929 20.915 11.768 1.0 98.39 203 B 1 -ATOM 1485 O O . ILE B ? 203 ? 3.759 21.434 12.509 1.0 97.42 203 B 1 -ATOM 1486 C CB . ILE B ? 203 ? 0.647 21.894 12.306 1.0 96.95 203 B 1 -ATOM 1487 C CG1 . ILE B ? 203 ? -0.851 21.565 12.503 1.0 91.57 203 B 1 -ATOM 1488 C CG2 . ILE B ? 203 ? 0.829 22.789 11.069 1.0 93.41 203 B 1 -ATOM 1489 C CD1 . ILE B ? 203 ? -1.607 21.129 11.246 1.0 83.82 203 B 1 -ATOM 1490 N N . ILE B ? 204 ? 3.169 20.657 10.492 1.0 98.5 204 B 1 -ATOM 1491 C CA . ILE B ? 204 ? 4.333 21.146 9.764 1.0 98.14 204 B 1 -ATOM 1492 C C . ILE B ? 204 ? 3.884 22.182 8.723 1.0 98.42 204 B 1 -ATOM 1493 O O . ILE B ? 204 ? 2.944 21.921 7.972 1.0 97.78 204 B 1 -ATOM 1494 C CB . ILE B ? 204 ? 5.129 19.994 9.129 1.0 96.06 204 B 1 -ATOM 1495 C CG1 . ILE B ? 204 ? 4.249 18.952 8.403 1.0 85.06 204 B 1 -ATOM 1496 C CG2 . ILE B ? 204 ? 5.980 19.293 10.198 1.0 77.13 204 B 1 -ATOM 1497 C CD1 . ILE B ? 204 ? 4.823 18.597 7.048 1.0 74.01 204 B 1 -ATOM 1498 N N . PRO B ? 205 ? 4.549 23.343 8.634 1.0 98.09 205 B 1 -ATOM 1499 C CA . PRO B ? 205 ? 4.306 24.287 7.553 1.0 97.74 205 B 1 -ATOM 1500 C C . PRO B ? 205 ? 4.663 23.670 6.197 1.0 97.85 205 B 1 -ATOM 1501 O O . PRO B ? 205 ? 5.663 22.959 6.078 1.0 96.93 205 B 1 -ATOM 1502 C CB . PRO B ? 205 ? 5.170 25.513 7.861 1.0 96.25 205 B 1 -ATOM 1503 C CG . PRO B ? 205 ? 5.536 25.358 9.340 1.0 92.76 205 B 1 -ATOM 1504 C CD . PRO B ? 205 ? 5.554 23.849 9.538 1.0 96.65 205 B 1 -ATOM 1505 N N . LEU B ? 206 ? 3.885 23.980 5.159 1.0 97.8 206 B 1 -ATOM 1506 C CA . LEU B ? 206 ? 4.218 23.649 3.773 1.0 97.72 206 B 1 -ATOM 1507 C C . LEU B ? 206 ? 4.396 24.917 2.949 1.0 97.91 206 B 1 -ATOM 1508 O O . LEU B ? 206 ? 3.509 25.762 2.896 1.0 96.88 206 B 1 -ATOM 1509 C CB . LEU B ? 206 ? 3.154 22.744 3.131 1.0 96.34 206 B 1 -ATOM 1510 C CG . LEU B ? 206 ? 3.569 21.267 3.119 1.0 90.66 206 B 1 -ATOM 1511 C CD1 . LEU B ? 206 ? 3.210 20.588 4.427 1.0 84.48 206 B 1 -ATOM 1512 C CD2 . LEU B ? 206 ? 2.874 20.525 1.980 1.0 85.53 206 B 1 -ATOM 1513 N N . GLU B ? 207 ? 5.516 25.007 2.241 1.0 96.97 207 B 1 -ATOM 1514 C CA . GLU B ? 207 ? 5.656 25.969 1.156 1.0 96.47 207 B 1 -ATOM 1515 C C . GLU B ? 207 ? 4.964 25.454 -0.108 1.0 96.61 207 B 1 -ATOM 1516 O O . GLU B ? 207 ? 5.223 24.346 -0.585 1.0 95.02 207 B 1 -ATOM 1517 C CB . GLU B ? 207 ? 7.124 26.285 0.871 1.0 94.84 207 B 1 -ATOM 1518 C CG . GLU B ? 207 ? 7.735 27.185 1.949 1.0 83.98 207 B 1 -ATOM 1519 C CD . GLU B ? 207 ? 9.108 27.733 1.549 1.0 79.53 207 B 1 -ATOM 1520 O OE1 . GLU B ? 207 ? 9.540 28.715 2.195 1.0 72.1 207 B 1 -ATOM 1521 O OE2 . GLU B ? 207 ? 9.709 27.206 0.580 1.0 72.99 207 B 1 -ATOM 1522 N N . VAL B ? 208 ? 4.095 26.286 -0.669 1.0 95.76 208 B 1 -ATOM 1523 C CA . VAL B ? 208 ? 3.360 26.011 -1.896 1.0 95.39 208 B 1 -ATOM 1524 C C . VAL B ? 208 ? 3.558 27.150 -2.880 1.0 95.14 208 B 1 -ATOM 1525 O O . VAL B ? 208 ? 3.440 28.321 -2.533 1.0 92.98 208 B 1 -ATOM 1526 C CB . VAL B ? 208 ? 1.854 25.772 -1.664 1.0 93.58 208 B 1 -ATOM 1527 C CG1 . VAL B ? 208 ? 1.511 24.332 -2.040 1.0 86.57 208 B 1 -ATOM 1528 C CG2 . VAL B ? 208 ? 1.367 26.001 -0.226 1.0 87.2 208 B 1 -ATOM 1529 N N . THR B ? 209 ? 3.839 26.810 -4.126 1.0 92.15 209 B 1 -ATOM 1530 C CA . THR B ? 209 ? 3.974 27.804 -5.192 1.0 89.88 209 B 1 -ATOM 1531 C C . THR B ? 209 ? 2.635 27.966 -5.906 1.0 88.91 209 B 1 -ATOM 1532 O O . THR B ? 209 ? 2.167 27.054 -6.581 1.0 84.52 209 B 1 -ATOM 1533 C CB . THR B ? 209 ? 5.098 27.432 -6.161 1.0 86.35 209 B 1 -ATOM 1534 O OG1 . THR B ? 209 ? 6.285 27.181 -5.444 1.0 76.05 209 B 1 -ATOM 1535 C CG2 . THR B ? 209 ? 5.405 28.567 -7.133 1.0 73.47 209 B 1 -ATOM 1536 N N . GLN B ? 210 ? 2.027 29.144 -5.789 1.0 86.27 210 B 1 -ATOM 1537 C CA . GLN B ? 210 ? 0.840 29.544 -6.544 1.0 84.12 210 B 1 -ATOM 1538 C C . GLN B ? 210 ? 1.247 30.558 -7.620 1.0 84.26 210 B 1 -ATOM 1539 O O . GLN B ? 210 ? 1.472 31.742 -7.348 1.0 78.36 210 B 1 -ATOM 1540 C CB . GLN B ? 210 ? -0.241 30.093 -5.605 1.0 80.1 210 B 1 -ATOM 1541 C CG . GLN B ? 210 ? -0.896 28.990 -4.753 1.0 73.52 210 B 1 -ATOM 1542 C CD . GLN B ? 210 ? -2.080 29.512 -3.932 1.0 69.07 210 B 1 -ATOM 1543 O OE1 . GLN B ? 210 ? -2.397 30.692 -3.920 1.0 63.38 210 B 1 -ATOM 1544 N NE2 . GLN B ? 210 ? -2.768 28.648 -3.215 1.0 62.25 210 B 1 -ATOM 1545 N N . GLY B ? 211 ? 1.374 30.079 -8.850 1.0 81.96 211 B 1 -ATOM 1546 C CA . GLY B ? 211 ? 1.882 30.879 -9.963 1.0 82.16 211 B 1 -ATOM 1547 C C . GLY B ? 211 ? 3.314 31.358 -9.696 1.0 84.61 211 B 1 -ATOM 1548 O O . GLY B ? 211 ? 4.254 30.566 -9.693 1.0 80.44 211 B 1 -ATOM 1549 N N . LYS B ? 212 ? 3.487 32.668 -9.481 1.0 85.92 212 B 1 -ATOM 1550 C CA . LYS B ? 212 ? 4.801 33.286 -9.203 1.0 87.94 212 B 1 -ATOM 1551 C C . LYS B ? 212 ? 5.058 33.552 -7.714 1.0 89.61 212 B 1 -ATOM 1552 O O . LYS B ? 212 ? 6.107 34.093 -7.376 1.0 85.44 212 B 1 -ATOM 1553 C CB . LYS B ? 212 ? 4.958 34.585 -10.005 1.0 85.41 212 B 1 -ATOM 1554 C CG . LYS B ? 212 ? 5.019 34.348 -11.520 1.0 77.61 212 B 1 -ATOM 1555 C CD . LYS B ? 212 ? 5.356 35.666 -12.236 1.0 69.23 212 B 1 -ATOM 1556 C CE . LYS B ? 212 ? 5.451 35.429 -13.748 1.0 61.35 212 B 1 -ATOM 1557 N NZ . LYS B ? 212 ? 5.824 36.669 -14.482 1.0 51.37 212 B 1 -ATOM 1558 N N . LYS B ? 213 ? 4.104 33.251 -6.836 1.0 89.23 213 B 1 -ATOM 1559 C CA . LYS B ? 213 ? 4.230 33.478 -5.395 1.0 90.39 213 B 1 -ATOM 1560 C C . LYS B ? 213 ? 4.402 32.152 -4.668 1.0 91.94 213 B 1 -ATOM 1561 O O . LYS B ? 213 ? 3.631 31.222 -4.887 1.0 89.04 213 B 1 -ATOM 1562 C CB . LYS B ? 213 ? 3.028 34.257 -4.848 1.0 86.52 213 B 1 -ATOM 1563 C CG . LYS B ? 213 ? 3.070 35.744 -5.238 1.0 74.89 213 B 1 -ATOM 1564 C CD . LYS B ? 213 ? 1.935 36.502 -4.540 1.0 70.82 213 B 1 -ATOM 1565 C CE . LYS B ? 213 ? 2.032 38.008 -4.823 1.0 61.09 213 B 1 -ATOM 1566 N NZ . LYS B ? 213 ? 0.987 38.765 -4.090 1.0 54.14 213 B 1 -ATOM 1567 N N . THR B ? 214 ? 5.369 32.118 -3.760 1.0 92.18 214 B 1 -ATOM 1568 C CA . THR B ? 214 ? 5.477 31.073 -2.747 1.0 92.86 214 B 1 -ATOM 1569 C C . THR B ? 214 ? 4.725 31.532 -1.506 1.0 93.76 214 B 1 -ATOM 1570 O O . THR B ? 214 ? 4.905 32.661 -1.052 1.0 91.8 214 B 1 -ATOM 1571 C CB . THR B ? 214 ? 6.942 30.749 -2.436 1.0 90.35 214 B 1 -ATOM 1572 O OG1 . THR B ? 214 ? 7.621 30.473 -3.645 1.0 81.28 214 B 1 -ATOM 1573 C CG2 . THR B ? 214 ? 7.081 29.519 -1.551 1.0 79.88 214 B 1 -ATOM 1574 N N . ILE B ? 215 ? 3.841 30.684 -0.997 1.0 94.85 215 B 1 -ATOM 1575 C CA . ILE B ? 215 ? 3.043 30.914 0.205 1.0 94.8 215 B 1 -ATOM 1576 C C . ILE B ? 215 ? 3.332 29.766 1.167 1.0 96.23 215 B 1 -ATOM 1577 O O . ILE B ? 215 ? 3.370 28.611 0.749 1.0 95.3 215 B 1 -ATOM 1578 C CB . ILE B ? 215 ? 1.535 31.012 -0.125 1.0 91.72 215 B 1 -ATOM 1579 C CG1 . ILE B ? 215 ? 1.261 32.008 -1.286 1.0 78.47 215 B 1 -ATOM 1580 C CG2 . ILE B ? 215 ? 0.750 31.421 1.136 1.0 75.8 215 B 1 -ATOM 1581 C CD1 . ILE B ? 215 ? -0.213 32.096 -1.707 1.0 71.38 215 B 1 -ATOM 1582 N N . THR B ? 216 ? 3.503 30.074 2.444 1.0 96.72 216 B 1 -ATOM 1583 C CA . THR B ? 216 ? 3.586 29.063 3.498 1.0 97.15 216 B 1 -ATOM 1584 C C . THR B ? 216 ? 2.189 28.808 4.041 1.0 97.32 216 B 1 -ATOM 1585 O O . THR B ? 216 ? 1.509 29.738 4.465 1.0 96.54 216 B 1 -ATOM 1586 C CB . THR B ? 216 ? 4.548 29.483 4.613 1.0 96.55 216 B 1 -ATOM 1587 O OG1 . THR B ? 216 ? 5.779 29.892 4.059 1.0 91.68 216 B 1 -ATOM 1588 C CG2 . THR B ? 216 ? 4.850 28.330 5.561 1.0 91.67 216 B 1 -ATOM 1589 N N . VAL B ? 217 ? 1.742 27.552 4.000 1.0 97.79 217 B 1 -ATOM 1590 C CA . VAL B ? 217 ? 0.475 27.102 4.584 1.0 97.97 217 B 1 -ATOM 1591 C C . VAL B ? 217 ? 0.784 26.462 5.932 1.0 98.18 217 B 1 -ATOM 1592 O O . VAL B ? 217 ? 1.501 25.464 5.996 1.0 97.93 217 B 1 -ATOM 1593 C CB . VAL B ? 217 ? -0.264 26.127 3.653 1.0 97.62 217 B 1 -ATOM 1594 C CG1 . VAL B ? 217 ? -1.636 25.754 4.222 1.0 96.44 217 B 1 -ATOM 1595 C CG2 . VAL B ? 217 ? -0.477 26.737 2.260 1.0 96.53 217 B 1 -ATOM 1596 N N . GLU B ? 218 ? 0.240 27.040 7.005 1.0 97.92 218 B 1 -ATOM 1597 C CA . GLU B ? 218 ? 0.526 26.659 8.394 1.0 97.45 218 B 1 -ATOM 1598 C C . GLU B ? 218 ? -0.730 26.268 9.177 1.0 97.79 218 B 1 -ATOM 1599 O O . GLU B ? 218 ? -0.629 25.731 10.280 1.0 96.69 218 B 1 -ATOM 1600 C CB . GLU B ? 218 ? 1.242 27.815 9.110 1.0 94.91 218 B 1 -ATOM 1601 C CG . GLU B ? 218 ? 2.521 28.254 8.382 1.0 84.51 218 B 1 -ATOM 1602 C CD . GLU B ? 218 ? 3.333 29.297 9.152 1.0 84.06 218 B 1 -ATOM 1603 O OE1 . GLU B ? 218 ? 4.572 29.133 9.195 1.0 76.25 218 B 1 -ATOM 1604 O OE2 . GLU B ? 218 ? 2.727 30.257 9.675 1.0 78.51 218 B 1 -ATOM 1605 N N . GLU B ? 219 ? -1.918 26.515 8.616 1.0 98.01 219 B 1 -ATOM 1606 C CA . GLU B ? 219 ? -3.213 26.276 9.248 1.0 98.02 219 B 1 -ATOM 1607 C C . GLU B ? 219 ? -4.114 25.380 8.402 1.0 98.45 219 B 1 -ATOM 1608 O O . GLU B ? 219 ? -4.117 25.442 7.175 1.0 98.08 219 B 1 -ATOM 1609 C CB . GLU B ? 219 ? -3.931 27.609 9.523 1.0 95.87 219 B 1 -ATOM 1610 C CG . GLU B ? 219 ? -3.412 28.366 10.764 1.0 87.87 219 B 1 -ATOM 1611 C CD . GLU B ? 219 ? -4.316 29.581 11.029 1.0 89.9 219 B 1 -ATOM 1612 O OE1 . GLU B ? 219 ? -4.950 29.682 12.101 1.0 84.33 219 B 1 -ATOM 1613 O OE2 . GLU B ? 219 ? -4.521 30.399 10.102 1.0 86.24 219 B 1 -ATOM 1614 N N . ASP B ? 220 ? -4.955 24.594 9.087 1.0 98.59 220 B 1 -ATOM 1615 C CA . ASP B ? 220 ? -6.085 23.910 8.465 1.0 98.63 220 B 1 -ATOM 1616 C C . ASP B ? 220 ? -7.065 24.947 7.888 1.0 98.52 220 B 1 -ATOM 1617 O O . ASP B ? 220 ? -7.397 25.947 8.533 1.0 98.03 220 B 1 -ATOM 1618 C CB . ASP B ? 220 ? -6.789 23.015 9.501 1.0 98.63 220 B 1 -ATOM 1619 C CG . ASP B ? 220 ? -5.915 21.880 10.048 1.0 98.69 220 B 1 -ATOM 1620 O OD1 . ASP B ? 220 ? -5.214 21.208 9.267 1.0 98.01 220 B 1 -ATOM 1621 O OD2 . ASP B ? 220 ? -5.952 21.607 11.269 1.0 98.05 220 B 1 -ATOM 1622 N N . GLU B ? 221 ? -7.569 24.707 6.676 1.0 98.56 221 B 1 -ATOM 1623 C CA . GLU B ? 221 ? -8.423 25.683 5.979 1.0 98.34 221 B 1 -ATOM 1624 C C . GLU B ? 221 ? -9.907 25.596 6.363 1.0 98.17 221 B 1 -ATOM 1625 O O . GLU B ? 221 ? -10.610 26.608 6.323 1.0 96.92 221 B 1 -ATOM 1626 C CB . GLU B ? 221 ? -8.279 25.517 4.460 1.0 97.87 221 B 1 -ATOM 1627 C CG . GLU B ? 221 ? -6.933 26.012 3.905 1.0 96.64 221 B 1 -ATOM 1628 C CD . GLU B ? 221 ? -7.011 26.031 2.374 1.0 96.99 221 B 1 -ATOM 1629 O OE1 . GLU B ? 221 ? -7.372 27.082 1.790 1.0 94.05 221 B 1 -ATOM 1630 O OE2 . GLU B ? 221 ? -6.804 24.974 1.747 1.0 94.56 221 B 1 -ATOM 1631 N N . GLU B ? 222 ? -10.404 24.395 6.711 1.0 98.38 222 B 1 -ATOM 1632 C CA . GLU B ? 222 ? -11.850 24.147 6.832 1.0 98.26 222 B 1 -ATOM 1633 C C . GLU B ? 222 ? -12.485 24.747 8.088 1.0 98.18 222 B 1 -ATOM 1634 O O . GLU B ? 222 ? -13.620 25.222 8.027 1.0 97.17 222 B 1 -ATOM 1635 C CB . GLU B ? 222 ? -12.147 22.641 6.781 1.0 97.61 222 B 1 -ATOM 1636 C CG . GLU B ? 222 ? -11.902 21.987 5.415 1.0 94.32 222 B 1 -ATOM 1637 C CD . GLU B ? 222 ? -12.805 22.496 4.283 1.0 96.09 222 B 1 -ATOM 1638 O OE1 . GLU B ? 222 ? -12.498 22.164 3.113 1.0 91.77 222 B 1 -ATOM 1639 O OE2 . GLU B ? 222 ? -13.777 23.240 4.536 1.0 92.75 222 B 1 -ATOM 1640 N N . TYR B ? 223 ? -11.785 24.765 9.222 1.0 98.32 223 B 1 -ATOM 1641 C CA . TYR B ? 223 ? -12.368 25.175 10.506 1.0 98.1 223 B 1 -ATOM 1642 C C . TYR B ? 223 ? -12.886 26.621 10.520 1.0 98.04 223 B 1 -ATOM 1643 O O . TYR B ? 223 ? -13.754 26.965 11.327 1.0 96.95 223 B 1 -ATOM 1644 C CB . TYR B ? 223 ? -11.361 24.938 11.639 1.0 97.61 223 B 1 -ATOM 1645 C CG . TYR B ? 223 ? -10.379 26.063 11.873 1.0 97.69 223 B 1 -ATOM 1646 C CD1 . TYR B ? 223 ? -9.149 26.114 11.192 1.0 96.81 223 B 1 -ATOM 1647 C CD2 . TYR B ? 223 ? -10.698 27.075 12.804 1.0 96.9 223 B 1 -ATOM 1648 C CE1 . TYR B ? 223 ? -8.241 27.156 11.442 1.0 95.86 223 B 1 -ATOM 1649 C CE2 . TYR B ? 223 ? -9.798 28.125 13.060 1.0 95.95 223 B 1 -ATOM 1650 C CZ . TYR B ? 223 ? -8.566 28.160 12.381 1.0 95.92 223 B 1 -ATOM 1651 O OH . TYR B ? 223 ? -7.686 29.179 12.644 1.0 94.3 223 B 1 -ATOM 1652 N N . LYS B ? 224 ? -12.395 27.460 9.607 1.0 97.77 224 B 1 -ATOM 1653 C CA . LYS B ? 224 ? -12.828 28.853 9.413 1.0 97.16 224 B 1 -ATOM 1654 C C . LYS B ? 224 ? -14.025 28.977 8.462 1.0 97.49 224 B 1 -ATOM 1655 O O . LYS B ? 224 ? -14.658 30.029 8.415 1.0 95.82 224 B 1 -ATOM 1656 C CB . LYS B ? 224 ? -11.640 29.697 8.908 1.0 95.22 224 B 1 -ATOM 1657 C CG . LYS B ? 224 ? -10.462 29.732 9.904 1.0 92.02 224 B 1 -ATOM 1658 C CD . LYS B ? 224 ? -9.288 30.581 9.390 1.0 88.07 224 B 1 -ATOM 1659 C CE . LYS B ? 224 ? -8.131 30.478 10.394 1.0 80.3 224 B 1 -ATOM 1660 N NZ . LYS B ? 224 ? -6.882 31.136 9.941 1.0 73.34 224 B 1 -ATOM 1661 N N . LYS B ? 225 ? -14.341 27.937 7.695 1.0 97.6 225 B 1 -ATOM 1662 C CA . LYS B ? 225 ? -15.366 27.941 6.641 1.0 97.42 225 B 1 -ATOM 1663 C C . LYS B ? 225 ? -16.734 27.505 7.173 1.0 97.69 225 B 1 -ATOM 1664 O O . LYS B ? 225 ? -17.329 26.535 6.705 1.0 96.12 225 B 1 -ATOM 1665 C CB . LYS B ? 225 ? -14.900 27.100 5.442 1.0 96.55 225 B 1 -ATOM 1666 C CG . LYS B ? 225 ? -13.649 27.682 4.769 1.0 94.96 225 B 1 -ATOM 1667 C CD . LYS B ? 225 ? -13.284 26.853 3.530 1.0 91.99 225 B 1 -ATOM 1668 C CE . LYS B ? 225 ? -12.050 27.449 2.848 1.0 87.32 225 B 1 -ATOM 1669 N NZ . LYS B ? 225 ? -11.633 26.639 1.684 1.0 80.49 225 B 1 -ATOM 1670 N N . VAL B ? 226 ? -17.262 28.229 8.151 1.0 97.74 226 B 1 -ATOM 1671 C CA . VAL B ? 226 ? -18.553 27.933 8.779 1.0 98.03 226 B 1 -ATOM 1672 C C . VAL B ? 226 ? -19.409 29.188 8.919 1.0 98.19 226 B 1 -ATOM 1673 O O . VAL B ? 226 ? -18.925 30.264 9.264 1.0 97.46 226 B 1 -ATOM 1674 C CB . VAL B ? 226 ? -18.349 27.200 10.122 1.0 97.36 226 B 1 -ATOM 1675 C CG1 . VAL B ? 226 ? -17.680 28.058 11.202 1.0 95.96 226 B 1 -ATOM 1676 C CG2 . VAL B ? 226 ? -19.675 26.654 10.665 1.0 95.36 226 B 1 -ATOM 1677 N N . ASN B ? 227 ? -20.716 29.042 8.663 1.0 98.05 227 B 1 -ATOM 1678 C CA . ASN B ? 227 ? -21.739 30.027 9.005 1.0 98.08 227 B 1 -ATOM 1679 C C . ASN B ? 227 ? -22.806 29.332 9.859 1.0 98.33 227 B 1 -ATOM 1680 O O . ASN B ? 227 ? -23.667 28.625 9.335 1.0 97.84 227 B 1 -ATOM 1681 C CB . ASN B ? 227 ? -22.297 30.662 7.717 1.0 97.32 227 B 1 -ATOM 1682 C CG . ASN B ? 227 ? -23.346 31.728 8.000 1.0 95.67 227 B 1 -ATOM 1683 O OD1 . ASN B ? 227 ? -24.018 31.739 9.007 1.0 90.54 227 B 1 -ATOM 1684 N ND2 . ASN B ? 227 ? -23.527 32.662 7.091 1.0 88.6 227 B 1 -ATOM 1685 N N . PHE B ? 228 ? -22.750 29.543 11.172 1.0 98.24 228 B 1 -ATOM 1686 C CA . PHE B ? 228 ? -23.623 28.873 12.138 1.0 98.31 228 B 1 -ATOM 1687 C C . PHE B ? 228 ? -25.114 29.139 11.897 1.0 98.32 228 B 1 -ATOM 1688 O O . PHE B ? 228 ? -25.926 28.231 12.038 1.0 97.4 228 B 1 -ATOM 1689 C CB . PHE B ? 228 ? -23.227 29.292 13.558 1.0 97.97 228 B 1 -ATOM 1690 C CG . PHE B ? 228 ? -21.833 28.864 13.966 1.0 98.12 228 B 1 -ATOM 1691 C CD1 . PHE B ? 228 ? -21.518 27.498 14.062 1.0 96.86 228 B 1 -ATOM 1692 C CD2 . PHE B ? 228 ? -20.845 29.823 14.258 1.0 96.87 228 B 1 -ATOM 1693 C CE1 . PHE B ? 228 ? -20.228 27.090 14.444 1.0 96.01 228 B 1 -ATOM 1694 C CE2 . PHE B ? 228 ? -19.554 29.423 14.642 1.0 96.05 228 B 1 -ATOM 1695 C CZ . PHE B ? 228 ? -19.244 28.052 14.736 1.0 96.93 228 B 1 -ATOM 1696 N N . GLU B ? 229 ? -25.493 30.350 11.476 1.0 98.26 229 B 1 -ATOM 1697 C CA . GLU B ? 229 ? -26.893 30.696 11.191 1.0 98.1 229 B 1 -ATOM 1698 C C . GLU B ? 229 ? -27.441 29.981 9.951 1.0 98.23 229 B 1 -ATOM 1699 O O . GLU B ? 229 ? -28.652 29.783 9.820 1.0 97.1 229 B 1 -ATOM 1700 C CB . GLU B ? 229 ? -27.018 32.201 10.953 1.0 97.39 229 B 1 -ATOM 1701 C CG . GLU B ? 229 ? -26.646 33.059 12.166 1.0 87.29 229 B 1 -ATOM 1702 C CD . GLU B ? 229 ? -26.905 34.548 11.914 1.0 78.63 229 B 1 -ATOM 1703 O OE1 . GLU B ? 229 ? -26.775 35.319 12.889 1.0 70.02 229 B 1 -ATOM 1704 O OE2 . GLU B ? 229 ? -27.242 34.905 10.754 1.0 70.45 229 B 1 -ATOM 1705 N N . LYS B ? 230 ? -26.565 29.605 9.033 1.0 98.08 230 B 1 -ATOM 1706 C CA . LYS B ? 230 ? -26.933 28.935 7.787 1.0 98.11 230 B 1 -ATOM 1707 C C . LYS B ? 230 ? -27.099 27.426 7.967 1.0 98.41 230 B 1 -ATOM 1708 O O . LYS B ? 230 ? -27.900 26.834 7.252 1.0 97.78 230 B 1 -ATOM 1709 C CB . LYS B ? 230 ? -25.899 29.293 6.711 1.0 97.03 230 B 1 -ATOM 1710 C CG . LYS B ? 230 ? -26.442 29.118 5.289 1.0 89.39 230 B 1 -ATOM 1711 C CD . LYS B ? 230 ? -25.379 29.505 4.256 1.0 88.52 230 B 1 -ATOM 1712 C CE . LYS B ? 230 ? -25.943 29.372 2.836 1.0 80.7 230 B 1 -ATOM 1713 N NZ . LYS B ? 230 ? -24.904 29.613 1.811 1.0 73.47 230 B 1 -ATOM 1714 N N . ILE B ? 231 ? -26.389 26.815 8.917 1.0 98.39 231 B 1 -ATOM 1715 C CA . ILE B ? 231 ? -26.370 25.358 9.149 1.0 98.53 231 B 1 -ATOM 1716 C C . ILE B ? 231 ? -27.778 24.742 9.207 1.0 98.52 231 B 1 -ATOM 1717 O O . ILE B ? 231 ? -28.055 23.854 8.400 1.0 98.23 231 B 1 -ATOM 1718 C CB . ILE B ? 231 ? -25.495 24.990 10.373 1.0 98.43 231 B 1 -ATOM 1719 C CG1 . ILE B ? 231 ? -24.014 25.282 10.057 1.0 97.88 231 B 1 -ATOM 1720 C CG2 . ILE B ? 231 ? -25.676 23.512 10.775 1.0 98.06 231 B 1 -ATOM 1721 C CD1 . ILE B ? 231 ? -23.041 25.021 11.215 1.0 96.65 231 B 1 -ATOM 1722 N N . PRO B ? 232 ? -28.713 25.205 10.068 1.0 98.36 232 B 1 -ATOM 1723 C CA . PRO B ? 232 ? -30.042 24.587 10.178 1.0 98.06 232 B 1 -ATOM 1724 C C . PRO B ? 232 ? -30.940 24.812 8.951 1.0 98.15 232 B 1 -ATOM 1725 O O . PRO B ? 232 ? -31.980 24.172 8.819 1.0 97.3 232 B 1 -ATOM 1726 C CB . PRO B ? 232 ? -30.653 25.183 11.454 1.0 97.13 232 B 1 -ATOM 1727 C CG . PRO B ? 232 ? -29.965 26.539 11.600 1.0 94.82 232 B 1 -ATOM 1728 C CD . PRO B ? 232 ? -28.564 26.261 11.069 1.0 97.6 232 B 1 -ATOM 1729 N N . LYS B ? 233 ? -30.560 25.700 8.044 1.0 98.24 233 B 1 -ATOM 1730 C CA . LYS B ? 233 ? -31.318 26.054 6.829 1.0 98.1 233 B 1 -ATOM 1731 C C . LYS B ? 233 ? -30.800 25.356 5.569 1.0 98.21 233 B 1 -ATOM 1732 O O . LYS B ? 233 ? -31.380 25.530 4.496 1.0 96.87 233 B 1 -ATOM 1733 C CB . LYS B ? 233 ? -31.307 27.583 6.649 1.0 97.44 233 B 1 -ATOM 1734 C CG . LYS B ? 233 ? -31.902 28.339 7.852 1.0 95.11 233 B 1 -ATOM 1735 C CD . LYS B ? 233 ? -31.778 29.858 7.655 1.0 91.32 233 B 1 -ATOM 1736 C CE . LYS B ? 233 ? -32.256 30.575 8.925 1.0 83.68 233 B 1 -ATOM 1737 N NZ . LYS B ? 233 ? -31.896 32.015 8.937 1.0 74.49 233 B 1 -ATOM 1738 N N . LEU B ? 234 ? -29.709 24.615 5.666 1.0 98.33 234 B 1 -ATOM 1739 C CA . LEU B ? 234 ? -29.122 23.921 4.522 1.0 98.47 234 B 1 -ATOM 1740 C C . LEU B ? 234 ? -30.043 22.808 4.021 1.0 98.52 234 B 1 -ATOM 1741 O O . LEU B ? 234 ? -30.702 22.119 4.797 1.0 98.11 234 B 1 -ATOM 1742 C CB . LEU B ? 234 ? -27.727 23.381 4.864 1.0 98.28 234 B 1 -ATOM 1743 C CG . LEU B ? 234 ? -26.674 24.469 5.137 1.0 97.56 234 B 1 -ATOM 1744 C CD1 . LEU B ? 234 ? -25.348 23.809 5.492 1.0 96.99 234 B 1 -ATOM 1745 C CD2 . LEU B ? 234 ? -26.443 25.389 3.935 1.0 96.82 234 B 1 -ATOM 1746 N N . LYS B ? 235 ? -30.056 22.609 2.703 1.0 98.37 235 B 1 -ATOM 1747 C CA . LYS B ? 235 ? -30.733 21.466 2.088 1.0 98.36 235 B 1 -ATOM 1748 C C . LYS B ? 235 ? -29.926 20.188 2.325 1.0 98.65 235 B 1 -ATOM 1749 O O . LYS B ? 235 ? -28.697 20.266 2.412 1.0 98.27 235 B 1 -ATOM 1750 C CB . LYS B ? 235 ? -30.962 21.710 0.593 1.0 97.29 235 B 1 -ATOM 1751 C CG . LYS B ? 235 ? -31.978 22.836 0.344 1.0 85.45 235 B 1 -ATOM 1752 C CD . LYS B ? 235 ? -32.294 22.947 -1.152 1.0 79.17 235 B 1 -ATOM 1753 C CE . LYS B ? 235 ? -33.347 24.037 -1.387 1.0 66.01 235 B 1 -ATOM 1754 N NZ . LYS B ? 235 ? -33.747 24.109 -2.817 1.0 55.97 235 B 1 -ATOM 1755 N N . PRO B ? 236 ? -30.599 19.027 2.354 1.0 98.63 236 B 1 -ATOM 1756 C CA . PRO B ? 236 ? -29.922 17.737 2.301 1.0 98.68 236 B 1 -ATOM 1757 C C . PRO B ? 236 ? -28.947 17.675 1.118 1.0 98.72 236 B 1 -ATOM 1758 O O . PRO B ? 236 ? -29.261 18.156 0.027 1.0 98.36 236 B 1 -ATOM 1759 C CB . PRO B ? 236 ? -31.029 16.694 2.177 1.0 98.31 236 B 1 -ATOM 1760 C CG . PRO B ? 236 ? -32.246 17.381 2.781 1.0 96.31 236 B 1 -ATOM 1761 C CD . PRO B ? 236 ? -32.041 18.839 2.387 1.0 98.32 236 B 1 -ATOM 1762 N N . ALA B ? 237 ? -27.768 17.106 1.333 1.0 98.68 237 B 1 -ATOM 1763 C CA . ALA B ? 237 ? -26.694 17.083 0.339 1.0 98.65 237 B 1 -ATOM 1764 C C . ALA B ? 237 ? -26.694 15.831 -0.554 1.0 98.63 237 B 1 -ATOM 1765 O O . ALA B ? 237 ? -26.137 15.870 -1.649 1.0 98.07 237 B 1 -ATOM 1766 C CB . ALA B ? 237 ? -25.359 17.246 1.075 1.0 98.48 237 B 1 -ATOM 1767 N N . PHE B ? 238 ? -27.300 14.737 -0.095 1.0 98.71 238 B 1 -ATOM 1768 C CA . PHE B ? 238 ? -27.187 13.428 -0.752 1.0 98.66 238 B 1 -ATOM 1769 C C . PHE B ? 238 ? -28.529 12.826 -1.161 1.0 98.5 238 B 1 -ATOM 1770 O O . PHE B ? 238 ? -28.662 12.340 -2.285 1.0 97.34 238 B 1 -ATOM 1771 C CB . PHE B ? 238 ? -26.422 12.477 0.169 1.0 98.56 238 B 1 -ATOM 1772 C CG . PHE B ? 238 ? -25.010 12.922 0.465 1.0 98.73 238 B 1 -ATOM 1773 C CD1 . PHE B ? 238 ? -23.990 12.697 -0.476 1.0 98.37 238 B 1 -ATOM 1774 C CD2 . PHE B ? 238 ? -24.709 13.601 1.660 1.0 98.37 238 B 1 -ATOM 1775 C CE1 . PHE B ? 238 ? -22.680 13.133 -0.222 1.0 98.13 238 B 1 -ATOM 1776 C CE2 . PHE B ? 238 ? -23.398 14.043 1.920 1.0 98.07 238 B 1 -ATOM 1777 C CZ . PHE B ? 238 ? -22.384 13.805 0.978 1.0 98.38 238 B 1 -ATOM 1778 N N . THR B ? 239 ? -29.527 12.857 -0.283 1.0 98.5 239 B 1 -ATOM 1779 C CA . THR B ? 239 ? -30.884 12.370 -0.557 1.0 98.34 239 B 1 -ATOM 1780 C C . THR B ? 239 ? -31.902 13.463 -0.242 1.0 98.34 239 B 1 -ATOM 1781 O O . THR B ? 239 ? -31.692 14.291 0.637 1.0 97.66 239 B 1 -ATOM 1782 C CB . THR B ? 239 ? -31.203 11.066 0.194 1.0 97.74 239 B 1 -ATOM 1783 O OG1 . THR B ? 239 ? -31.273 11.268 1.573 1.0 92.84 239 B 1 -ATOM 1784 C CG2 . THR B ? 239 ? -30.161 9.976 -0.056 1.0 92.03 239 B 1 -ATOM 1785 N N . SER B ? 240 ? -33.010 13.489 -0.983 1.0 98.05 240 B 1 -ATOM 1786 C CA . SER B ? 240 ? -34.003 14.569 -0.887 1.0 97.54 240 B 1 -ATOM 1787 C C . SER B ? 240 ? -34.670 14.675 0.487 1.0 97.44 240 B 1 -ATOM 1788 O O . SER B ? 240 ? -35.005 15.773 0.919 1.0 95.11 240 B 1 -ATOM 1789 C CB . SER B ? 240 ? -35.067 14.400 -1.974 1.0 96.38 240 B 1 -ATOM 1790 O OG . SER B ? 240 ? -35.434 13.046 -2.135 1.0 84.3 240 B 1 -ATOM 1791 N N . GLU B ? 241 ? -34.817 13.552 1.192 1.0 97.27 241 B 1 -ATOM 1792 C CA . GLU B ? 241 ? -35.353 13.472 2.559 1.0 96.67 241 B 1 -ATOM 1793 C C . GLU B ? 241 ? -34.262 13.196 3.607 1.0 97.37 241 B 1 -ATOM 1794 O O . GLU B ? 241 ? -34.560 12.830 4.743 1.0 95.29 241 B 1 -ATOM 1795 C CB . GLU B ? 241 ? -36.436 12.390 2.638 1.0 94.61 241 B 1 -ATOM 1796 C CG . GLU B ? 241 ? -37.617 12.608 1.693 1.0 85.69 241 B 1 -ATOM 1797 C CD . GLU B ? 241 ? -38.743 11.587 1.933 1.0 73.79 241 B 1 -ATOM 1798 O OE1 . GLU B ? 241 ? -39.804 11.744 1.290 1.0 65.33 241 B 1 -ATOM 1799 O OE2 . GLU B ? 241 ? -38.552 10.643 2.755 1.0 66.98 241 B 1 -ATOM 1800 N N . GLY B ? 242 ? -33.003 13.342 3.230 1.0 97.95 242 B 1 -ATOM 1801 C CA . GLY B ? 242 ? -31.873 13.068 4.098 1.0 98.26 242 B 1 -ATOM 1802 C C . GLY B ? 242 ? -31.656 14.132 5.173 1.0 98.63 242 B 1 -ATOM 1803 O O . GLY B ? 242 ? -32.160 15.254 5.106 1.0 98.28 242 B 1 -ATOM 1804 N N . SER B ? 243 ? -30.861 13.783 6.163 1.0 98.71 243 B 1 -ATOM 1805 C CA . SER B ? 243 ? -30.453 14.664 7.262 1.0 98.75 243 B 1 -ATOM 1806 C C . SER B ? 243 ? -29.008 15.151 7.137 1.0 98.79 243 B 1 -ATOM 1807 O O . SER B ? 243 ? -28.632 16.145 7.757 1.0 98.46 243 B 1 -ATOM 1808 C CB . SER B ? 243 ? -30.672 13.936 8.589 1.0 98.56 243 B 1 -ATOM 1809 O OG . SER B ? 243 ? -30.012 12.689 8.601 1.0 98.08 243 B 1 -ATOM 1810 N N . VAL B ? 244 ? -28.202 14.482 6.318 1.0 98.88 244 B 1 -ATOM 1811 C CA . VAL B ? 244 ? -26.811 14.862 6.067 1.0 98.9 244 B 1 -ATOM 1812 C C . VAL B ? 244 ? -26.755 16.069 5.129 1.0 98.89 244 B 1 -ATOM 1813 O O . VAL B ? 244 ? -27.368 16.094 4.061 1.0 98.78 244 B 1 -ATOM 1814 C CB . VAL B ? 244 ? -25.989 13.680 5.532 1.0 98.86 244 B 1 -ATOM 1815 C CG1 . VAL B ? 244 ? -24.518 14.059 5.366 1.0 98.49 244 B 1 -ATOM 1816 C CG2 . VAL B ? 244 ? -26.043 12.481 6.492 1.0 98.37 244 B 1 -ATOM 1817 N N . THR B ? 245 ? -26.001 17.085 5.537 1.0 98.84 245 B 1 -ATOM 1818 C CA . THR B ? 245 ? -25.818 18.341 4.793 1.0 98.84 245 B 1 -ATOM 1819 C C . THR B ? 245 ? -24.340 18.649 4.583 1.0 98.84 245 B 1 -ATOM 1820 O O . THR B ? 245 ? -23.468 18.001 5.162 1.0 98.66 245 B 1 -ATOM 1821 C CB . THR B ? 245 ? -26.486 19.524 5.507 1.0 98.73 245 B 1 -ATOM 1822 O OG1 . THR B ? 245 ? -25.786 19.871 6.677 1.0 97.94 245 B 1 -ATOM 1823 C CG2 . THR B ? 245 ? -27.944 19.267 5.863 1.0 97.51 245 B 1 -ATOM 1824 N N . ALA B ? 246 ? -24.043 19.677 3.807 1.0 98.78 246 B 1 -ATOM 1825 C CA . ALA B ? 246 ? -22.669 20.137 3.616 1.0 98.73 246 B 1 -ATOM 1826 C C . ALA B ? 246 ? -21.979 20.597 4.918 1.0 98.76 246 B 1 -ATOM 1827 O O . ALA B ? 246 ? -20.756 20.626 4.973 1.0 98.45 246 B 1 -ATOM 1828 C CB . ALA B ? 246 ? -22.681 21.258 2.575 1.0 98.38 246 B 1 -ATOM 1829 N N . ALA B ? 247 ? -22.736 20.959 5.958 1.0 98.76 247 B 1 -ATOM 1830 C CA . ALA B ? 247 ? -22.184 21.437 7.228 1.0 98.75 247 B 1 -ATOM 1831 C C . ALA B ? 247 ? -22.003 20.338 8.292 1.0 98.81 247 B 1 -ATOM 1832 O O . ALA B ? 247 ? -21.189 20.508 9.192 1.0 98.57 247 B 1 -ATOM 1833 C CB . ALA B ? 247 ? -23.074 22.558 7.758 1.0 98.48 247 B 1 -ATOM 1834 N N . ASN B ? 248 ? -22.750 19.233 8.213 1.0 98.82 248 B 1 -ATOM 1835 C CA . ASN B ? 248 ? -22.656 18.104 9.148 1.0 98.85 248 B 1 -ATOM 1836 C C . ASN B ? 248 ? -22.002 16.848 8.534 1.0 98.9 248 B 1 -ATOM 1837 O O . ASN B ? 248 ? -21.946 15.792 9.171 1.0 98.79 248 B 1 -ATOM 1838 C CB . ASN B ? 248 ? -24.027 17.869 9.812 1.0 98.74 248 B 1 -ATOM 1839 C CG . ASN B ? 248 ? -25.093 17.299 8.888 1.0 98.82 248 B 1 -ATOM 1840 O OD1 . ASN B ? 248 ? -24.832 16.612 7.919 1.0 95.28 248 B 1 -ATOM 1841 N ND2 . ASN B ? 248 ? -26.351 17.541 9.190 1.0 94.85 248 B 1 -ATOM 1842 N N . ALA B ? 249 ? -21.487 16.974 7.313 1.0 98.91 249 B 1 -ATOM 1843 C CA . ALA B ? 249 ? -20.600 16.027 6.658 1.0 98.9 249 B 1 -ATOM 1844 C C . ALA B ? 249 ? -19.162 16.563 6.645 1.0 98.9 249 B 1 -ATOM 1845 O O . ALA B ? 249 ? -18.942 17.770 6.659 1.0 98.75 249 B 1 -ATOM 1846 C CB . ALA B ? 249 ? -21.108 15.790 5.233 1.0 98.78 249 B 1 -ATOM 1847 N N . SER B ? 250 ? -18.187 15.671 6.555 1.0 98.89 250 B 1 -ATOM 1848 C CA . SER B ? 250 ? -16.823 16.062 6.202 1.0 98.86 250 B 1 -ATOM 1849 C C . SER B ? 250 ? -16.742 16.515 4.739 1.0 98.83 250 B 1 -ATOM 1850 O O . SER B ? 250 ? -17.575 16.158 3.905 1.0 98.59 250 B 1 -ATOM 1851 C CB . SER B ? 250 ? -15.838 14.927 6.494 1.0 98.72 250 B 1 -ATOM 1852 O OG . SER B ? 250 ? -16.127 13.776 5.730 1.0 98.29 250 B 1 -ATOM 1853 N N . THR B ? 251 ? -15.713 17.285 4.417 1.0 98.77 251 B 1 -ATOM 1854 C CA . THR B ? 251 ? -15.473 17.846 3.082 1.0 98.77 251 B 1 -ATOM 1855 C C . THR B ? 251 ? -14.500 16.998 2.256 1.0 98.79 251 B 1 -ATOM 1856 O O . THR B ? 251 ? -13.954 15.995 2.728 1.0 98.43 251 B 1 -ATOM 1857 C CB . THR B ? 251 ? -14.990 19.297 3.222 1.0 98.48 251 B 1 -ATOM 1858 O OG1 . THR B ? 251 ? -13.980 19.368 4.198 1.0 97.31 251 B 1 -ATOM 1859 C CG2 . THR B ? 251 ? -16.119 20.228 3.671 1.0 97.02 251 B 1 -ATOM 1860 N N . LEU B ? 252 ? -14.290 17.382 1.003 1.0 98.8 252 B 1 -ATOM 1861 C CA . LEU B ? 252 ? -13.216 16.857 0.157 1.0 98.78 252 B 1 -ATOM 1862 C C . LEU B ? 252 ? -11.929 17.615 0.486 1.0 98.78 252 B 1 -ATOM 1863 O O . LEU B ? 252 ? -11.929 18.848 0.439 1.0 98.38 252 B 1 -ATOM 1864 C CB . LEU B ? 252 ? -13.576 17.027 -1.325 1.0 98.55 252 B 1 -ATOM 1865 C CG . LEU B ? 252 ? -14.907 16.394 -1.763 1.0 97.38 252 B 1 -ATOM 1866 C CD1 . LEU B ? 252 ? -15.139 16.668 -3.250 1.0 95.53 252 B 1 -ATOM 1867 C CD2 . LEU B ? 252 ? -14.938 14.884 -1.547 1.0 95.07 252 B 1 -ATOM 1868 N N . ASN B ? 253 ? -10.845 16.905 0.811 1.0 98.85 253 B 1 -ATOM 1869 C CA . ASN B ? 253 ? -9.648 17.550 1.350 1.0 98.91 253 B 1 -ATOM 1870 C C . ASN B ? 253 ? -8.338 16.910 0.881 1.0 98.92 253 B 1 -ATOM 1871 O O . ASN B ? 253 ? -8.308 15.782 0.387 1.0 98.82 253 B 1 -ATOM 1872 C CB . ASN B ? 253 ? -9.742 17.559 2.885 1.0 98.85 253 B 1 -ATOM 1873 C CG . ASN B ? 253 ? -10.905 18.379 3.409 1.0 98.81 253 B 1 -ATOM 1874 O OD1 . ASN B ? 253 ? -11.926 17.848 3.813 1.0 89.11 253 B 1 -ATOM 1875 N ND2 . ASN B ? 253 ? -10.783 19.685 3.418 1.0 89.12 253 B 1 -ATOM 1876 N N . ASP B ? 254 ? -7.252 17.645 1.119 1.0 98.92 254 B 1 -ATOM 1877 C CA . ASP B ? 254 ? -5.879 17.245 0.834 1.0 98.92 254 B 1 -ATOM 1878 C C . ASP B ? 254 ? -5.044 17.280 2.120 1.0 98.94 254 B 1 -ATOM 1879 O O . ASP B ? 254 ? -5.182 18.190 2.938 1.0 98.84 254 B 1 -ATOM 1880 C CB . ASP B ? 254 ? -5.273 18.186 -0.218 1.0 98.84 254 B 1 -ATOM 1881 C CG . ASP B ? 254 ? -6.118 18.342 -1.481 1.0 98.72 254 B 1 -ATOM 1882 O OD1 . ASP B ? 254 ? -6.622 17.325 -2.005 1.0 97.94 254 B 1 -ATOM 1883 O OD2 . ASP B ? 254 ? -6.257 19.476 -1.982 1.0 97.72 254 B 1 -ATOM 1884 N N . GLY B ? 255 ? -4.152 16.309 2.300 1.0 98.92 255 B 1 -ATOM 1885 C CA . GLY B ? 255 ? -3.246 16.287 3.445 1.0 98.94 255 B 1 -ATOM 1886 C C . GLY B ? 255 ? -2.576 14.941 3.693 1.0 98.97 255 B 1 -ATOM 1887 O O . GLY B ? 255 ? -2.911 13.920 3.088 1.0 98.93 255 B 1 -ATOM 1888 N N . ALA B ? 256 ? -1.616 14.935 4.620 1.0 98.96 256 B 1 -ATOM 1889 C CA . ALA B ? 256 ? -0.921 13.727 5.048 1.0 98.97 256 B 1 -ATOM 1890 C C . ALA B ? 256 ? -0.577 13.766 6.541 1.0 98.97 256 B 1 -ATOM 1891 O O . ALA B ? 256 ? -0.296 14.825 7.101 1.0 98.93 256 B 1 -ATOM 1892 C CB . ALA B ? 256 ? 0.328 13.528 4.188 1.0 98.94 256 B 1 -ATOM 1893 N N . ALA B ? 257 ? -0.565 12.596 7.178 1.0 98.96 257 B 1 -ATOM 1894 C CA . ALA B ? 257 ? -0.155 12.408 8.564 1.0 98.97 257 B 1 -ATOM 1895 C C . ALA B ? 257 ? 0.737 11.170 8.683 1.0 98.97 257 B 1 -ATOM 1896 O O . ALA B ? 257 ? 0.423 10.118 8.123 1.0 98.93 257 B 1 -ATOM 1897 C CB . ALA B ? 257 ? -1.394 12.295 9.453 1.0 98.94 257 B 1 -ATOM 1898 N N . MET B ? 258 ? 1.837 11.282 9.426 1.0 98.98 258 B 1 -ATOM 1899 C CA . MET B ? 258 ? 2.811 10.206 9.596 1.0 98.98 258 B 1 -ATOM 1900 C C . MET B ? 258 ? 3.196 10.031 11.063 1.0 98.98 258 B 1 -ATOM 1901 O O . MET B ? 258 ? 3.196 10.983 11.845 1.0 98.92 258 B 1 -ATOM 1902 C CB . MET B ? 258 ? 4.058 10.470 8.744 1.0 98.94 258 B 1 -ATOM 1903 C CG . MET B ? 258 ? 3.778 10.548 7.244 1.0 98.48 258 B 1 -ATOM 1904 S SD . MET B ? 258 ? 3.278 8.998 6.462 1.0 98.26 258 B 1 -ATOM 1905 C CE . MET B ? 258 ? 2.738 9.639 4.867 1.0 94.97 258 B 1 -ATOM 1906 N N . VAL B ? 259 ? 3.560 8.800 11.417 1.0 98.97 259 B 1 -ATOM 1907 C CA . VAL B ? 259 ? 4.090 8.434 12.733 1.0 98.97 259 B 1 -ATOM 1908 C C . VAL B ? 259 ? 5.391 7.654 12.576 1.0 98.97 259 B 1 -ATOM 1909 O O . VAL B ? 259 ? 5.583 6.929 11.601 1.0 98.93 259 B 1 -ATOM 1910 C CB . VAL B ? 259 ? 3.070 7.654 13.588 1.0 98.92 259 B 1 -ATOM 1911 C CG1 . VAL B ? 259 ? 1.815 8.481 13.868 1.0 98.57 259 B 1 -ATOM 1912 C CG2 . VAL B ? 259 ? 2.637 6.323 12.958 1.0 98.09 259 B 1 -ATOM 1913 N N . VAL B ? 260 ? 6.279 7.792 13.557 1.0 98.95 260 B 1 -ATOM 1914 C CA . VAL B ? 260 ? 7.508 7.000 13.671 1.0 98.96 260 B 1 -ATOM 1915 C C . VAL B ? 260 ? 7.336 6.029 14.831 1.0 98.95 260 B 1 -ATOM 1916 O O . VAL B ? 260 ? 6.999 6.436 15.946 1.0 98.9 260 B 1 -ATOM 1917 C CB . VAL B ? 260 ? 8.753 7.883 13.855 1.0 98.92 260 B 1 -ATOM 1918 C CG1 . VAL B ? 260 ? 10.029 7.042 13.791 1.0 98.63 260 B 1 -ATOM 1919 C CG2 . VAL B ? 260 ? 8.846 8.974 12.780 1.0 98.62 260 B 1 -ATOM 1920 N N . MET B ? 261 ? 7.556 4.753 14.557 1.0 98.94 261 B 1 -ATOM 1921 C CA . MET B ? 261 ? 7.334 3.645 15.479 1.0 98.93 261 B 1 -ATOM 1922 C C . MET B ? 261 ? 8.600 2.800 15.631 1.0 98.93 261 B 1 -ATOM 1923 O O . MET B ? 261 ? 9.357 2.599 14.681 1.0 98.79 261 B 1 -ATOM 1924 C CB . MET B ? 261 ? 6.162 2.779 14.993 1.0 98.86 261 B 1 -ATOM 1925 C CG . MET B ? 261 ? 4.846 3.560 14.838 1.0 98.46 261 B 1 -ATOM 1926 S SD . MET B ? 261 ? 3.502 2.624 14.054 1.0 98.4 261 B 1 -ATOM 1927 C CE . MET B ? 261 ? 3.217 1.340 15.294 1.0 94.64 261 B 1 -ATOM 1928 N N . THR B ? 262 ? 8.813 2.290 16.840 1.0 98.83 262 B 1 -ATOM 1929 C CA . THR B ? 262 ? 9.913 1.376 17.159 1.0 98.83 262 B 1 -ATOM 1930 C C . THR B ? 262 ? 9.493 0.458 18.310 1.0 98.79 262 B 1 -ATOM 1931 O O . THR B ? 262 ? 8.337 0.479 18.748 1.0 98.57 262 B 1 -ATOM 1932 C CB . THR B ? 262 ? 11.202 2.178 17.438 1.0 98.73 262 B 1 -ATOM 1933 O OG1 . THR B ? 262 ? 12.313 1.328 17.581 1.0 97.59 262 B 1 -ATOM 1934 C CG2 . THR B ? 262 ? 11.128 3.039 18.701 1.0 97.62 262 B 1 -ATOM 1935 N N . THR B ? 263 ? 10.411 -0.364 18.801 1.0 98.65 263 B 1 -ATOM 1936 C CA . THR B ? 263 ? 10.230 -1.136 20.036 1.0 98.53 263 B 1 -ATOM 1937 C C . THR B ? 263 ? 10.793 -0.372 21.236 1.0 98.55 263 B 1 -ATOM 1938 O O . THR B ? 263 ? 11.587 0.562 21.087 1.0 98.3 263 B 1 -ATOM 1939 C CB . THR B ? 263 ? 10.870 -2.526 19.920 1.0 98.11 263 B 1 -ATOM 1940 O OG1 . THR B ? 263 ? 12.266 -2.415 19.763 1.0 96.51 263 B 1 -ATOM 1941 C CG2 . THR B ? 263 ? 10.317 -3.320 18.735 1.0 96.3 263 B 1 -ATOM 1942 N N . VAL B ? 264 ? 10.428 -0.792 22.449 1.0 98.33 264 B 1 -ATOM 1943 C CA . VAL B ? 264 ? 11.027 -0.258 23.691 1.0 98.18 264 B 1 -ATOM 1944 C C . VAL B ? 264 ? 12.557 -0.374 23.663 1.0 98.23 264 B 1 -ATOM 1945 O O . VAL B ? 264 ? 13.255 0.580 24.017 1.0 97.73 264 B 1 -ATOM 1946 C CB . VAL B ? 264 ? 10.445 -0.989 24.918 1.0 97.39 264 B 1 -ATOM 1947 C CG1 . VAL B ? 264 ? 11.165 -0.622 26.219 1.0 90.75 264 B 1 -ATOM 1948 C CG2 . VAL B ? 264 ? 8.963 -0.634 25.098 1.0 91.31 264 B 1 -ATOM 1949 N N . ASP B ? 265 ? 13.088 -1.498 23.176 1.0 98.04 265 B 1 -ATOM 1950 C CA . ASP B ? 265 ? 14.534 -1.702 23.031 1.0 97.82 265 B 1 -ATOM 1951 C C . ASP B ? 265 ? 15.144 -0.787 21.961 1.0 98.18 265 B 1 -ATOM 1952 O O . ASP B ? 265 ? 16.192 -0.183 22.192 1.0 97.74 265 B 1 -ATOM 1953 C CB . ASP B ? 265 ? 14.829 -3.163 22.673 1.0 96.84 265 B 1 -ATOM 1954 C CG . ASP B ? 265 ? 14.461 -4.148 23.778 1.0 94.4 265 B 1 -ATOM 1955 O OD1 . ASP B ? 265 ? 14.626 -3.792 24.968 1.0 90.59 265 B 1 -ATOM 1956 O OD2 . ASP B ? 265 ? 14.029 -5.260 23.398 1.0 89.36 265 B 1 -ATOM 1957 N N . GLY B ? 266 ? 14.471 -0.626 20.825 1.0 98.03 266 B 1 -ATOM 1958 C CA . GLY B ? 266 ? 14.895 0.276 19.753 1.0 98.22 266 B 1 -ATOM 1959 C C . GLY B ? 266 ? 14.954 1.735 20.212 1.0 98.47 266 B 1 -ATOM 1960 O O . GLY B ? 266 ? 15.931 2.437 19.940 1.0 98.29 266 B 1 -ATOM 1961 N N . ALA B ? 267 ? 13.962 2.175 20.993 1.0 98.48 267 B 1 -ATOM 1962 C CA . ALA B ? 267 ? 13.961 3.516 21.576 1.0 98.57 267 B 1 -ATOM 1963 C C . ALA B ? 267 ? 15.153 3.723 22.532 1.0 98.54 267 B 1 -ATOM 1964 O O . ALA B ? 267 ? 15.859 4.727 22.427 1.0 98.27 267 B 1 -ATOM 1965 C CB . ALA B ? 267 ? 12.619 3.755 22.276 1.0 98.52 267 B 1 -ATOM 1966 N N . LYS B ? 268 ? 15.435 2.751 23.409 1.0 98.45 268 B 1 -ATOM 1967 C CA . LYS B ? 268 ? 16.616 2.789 24.289 1.0 98.32 268 B 1 -ATOM 1968 C C . LYS B ? 268 ? 17.923 2.833 23.501 1.0 98.34 268 B 1 -ATOM 1969 O O . LYS B ? 268 ? 18.771 3.674 23.782 1.0 97.69 268 B 1 -ATOM 1970 C CB . LYS B ? 268 ? 16.625 1.575 25.230 1.0 97.75 268 B 1 -ATOM 1971 C CG . LYS B ? 268 ? 16.023 1.899 26.597 1.0 84.73 268 B 1 -ATOM 1972 C CD . LYS B ? 268 ? 16.106 0.669 27.499 1.0 81.55 268 B 1 -ATOM 1973 C CE . LYS B ? 268 ? 15.621 0.993 28.914 1.0 70.44 268 B 1 -ATOM 1974 N NZ . LYS B ? 268 ? 15.562 -0.230 29.748 1.0 61.84 268 B 1 -ATOM 1975 N N . LYS B ? 269 ? 18.076 1.946 22.524 1.0 98.15 269 B 1 -ATOM 1976 C CA . LYS B ? 269 ? 19.277 1.818 21.691 1.0 98.04 269 B 1 -ATOM 1977 C C . LYS B ? 269 ? 19.617 3.107 20.945 1.0 98.16 269 B 1 -ATOM 1978 O O . LYS B ? 269 ? 20.788 3.458 20.827 1.0 97.49 269 B 1 -ATOM 1979 C CB . LYS B ? 269 ? 19.027 0.659 20.720 1.0 97.31 269 B 1 -ATOM 1980 C CG . LYS B ? 269 ? 20.149 0.404 19.700 1.0 94.09 269 B 1 -ATOM 1981 C CD . LYS B ? 269 ? 19.672 -0.742 18.812 1.0 92.49 269 B 1 -ATOM 1982 C CE . LYS B ? 269 ? 20.537 -0.995 17.586 1.0 85.88 269 B 1 -ATOM 1983 N NZ . LYS B ? 269 ? 19.813 -1.929 16.695 1.0 81.71 269 B 1 -ATOM 1984 N N . HIS B ? 270 ? 18.603 3.816 20.466 1.0 98.24 270 B 1 -ATOM 1985 C CA . HIS B ? 270 ? 18.764 5.057 19.708 1.0 98.18 270 B 1 -ATOM 1986 C C . HIS B ? 270 ? 18.619 6.331 20.561 1.0 98.22 270 B 1 -ATOM 1987 O O . HIS B ? 270 ? 18.685 7.433 20.019 1.0 97.27 270 B 1 -ATOM 1988 C CB . HIS B ? 270 ? 17.820 5.026 18.501 1.0 97.99 270 B 1 -ATOM 1989 C CG . HIS B ? 270 ? 18.210 3.974 17.496 1.0 97.59 270 B 1 -ATOM 1990 N ND1 . HIS B ? 270 ? 19.356 3.987 16.723 1.0 88.62 270 B 1 -ATOM 1991 C CD2 . HIS B ? 270 ? 17.541 2.814 17.204 1.0 89.03 270 B 1 -ATOM 1992 C CE1 . HIS B ? 270 ? 19.367 2.870 15.984 1.0 89.68 270 B 1 -ATOM 1993 N NE2 . HIS B ? 270 ? 18.283 2.132 16.247 1.0 91.55 270 B 1 -ATOM 1994 N N . GLY B ? 271 ? 18.436 6.208 21.883 1.0 98.07 271 B 1 -ATOM 1995 C CA . GLY B ? 271 ? 18.279 7.349 22.791 1.0 97.94 271 B 1 -ATOM 1996 C C . GLY B ? 271 ? 17.012 8.170 22.540 1.0 98.1 271 B 1 -ATOM 1997 O O . GLY B ? 271 ? 16.998 9.378 22.777 1.0 96.95 271 B 1 -ATOM 1998 N N . LEU B ? 272 ? 15.956 7.527 22.050 1.0 98.21 272 B 1 -ATOM 1999 C CA . LEU B ? 272 ? 14.685 8.170 21.728 1.0 98.31 272 B 1 -ATOM 2000 C C . LEU B ? 272 ? 13.763 8.160 22.942 1.0 98.26 272 B 1 -ATOM 2001 O O . LEU B ? 272 ? 13.731 7.204 23.717 1.0 97.54 272 B 1 -ATOM 2002 C CB . LEU B ? 272 ? 14.019 7.466 20.535 1.0 98.25 272 B 1 -ATOM 2003 C CG . LEU B ? 272 ? 14.913 7.318 19.293 1.0 97.92 272 B 1 -ATOM 2004 C CD1 . LEU B ? 272 ? 14.180 6.513 18.228 1.0 97.21 272 B 1 -ATOM 2005 C CD2 . LEU B ? 272 ? 15.311 8.673 18.703 1.0 97.15 272 B 1 -ATOM 2006 N N . LYS B ? 273 ? 12.953 9.212 23.078 1.0 97.81 273 B 1 -ATOM 2007 C CA . LYS B ? 273 ? 11.936 9.292 24.121 1.0 97.45 273 B 1 -ATOM 2008 C C . LYS B ? 273 ? 10.601 8.782 23.578 1.0 98.04 273 B 1 -ATOM 2009 O O . LYS B ? 273 ? 10.009 9.469 22.743 1.0 97.32 273 B 1 -ATOM 2010 C CB . LYS B ? 273 ? 11.867 10.730 24.652 1.0 95.42 273 B 1 -ATOM 2011 C CG . LYS B ? 273 ? 11.045 10.789 25.944 1.0 87.28 273 B 1 -ATOM 2012 C CD . LYS B ? 273 ? 11.041 12.209 26.522 1.0 81.51 273 B 1 -ATOM 2013 C CE . LYS B ? 273 ? 10.262 12.198 27.840 1.0 71.11 273 B 1 -ATOM 2014 N NZ . LYS B ? 273 ? 10.203 13.540 28.459 1.0 61.93 273 B 1 -ATOM 2015 N N . PRO B ? 274 ? 10.086 7.626 24.048 1.0 98.34 274 B 1 -ATOM 2016 C CA . PRO B ? 274 ? 8.757 7.175 23.663 1.0 98.45 274 B 1 -ATOM 2017 C C . PRO B ? 274 ? 7.691 8.178 24.103 1.0 98.58 274 B 1 -ATOM 2018 O O . PRO B ? 274 ? 7.717 8.682 25.226 1.0 98.12 274 B 1 -ATOM 2019 C CB . PRO B ? 274 ? 8.568 5.800 24.307 1.0 97.8 274 B 1 -ATOM 2020 C CG . PRO B ? 274 ? 9.987 5.334 24.608 1.0 95.19 274 B 1 -ATOM 2021 C CD . PRO B ? 274 ? 10.717 6.638 24.904 1.0 97.75 274 B 1 -ATOM 2022 N N . LEU B ? 275 ? 6.739 8.465 23.223 1.0 98.75 275 B 1 -ATOM 2023 C CA . LEU B ? 275 ? 5.618 9.372 23.477 1.0 98.74 275 B 1 -ATOM 2024 C C . LEU B ? 275 ? 4.386 8.616 23.975 1.0 98.77 275 B 1 -ATOM 2025 O O . LEU B ? 275 ? 3.719 9.063 24.905 1.0 98.39 275 B 1 -ATOM 2026 C CB . LEU B ? 275 ? 5.297 10.161 22.194 1.0 98.61 275 B 1 -ATOM 2027 C CG . LEU B ? 275 ? 6.446 11.022 21.637 1.0 98.14 275 B 1 -ATOM 2028 C CD1 . LEU B ? 275 ? 5.994 11.693 20.345 1.0 97.28 275 B 1 -ATOM 2029 C CD2 . LEU B ? 275 ? 6.880 12.113 22.620 1.0 96.95 275 B 1 -ATOM 2030 N N . ALA B ? 276 ? 4.105 7.469 23.363 1.0 98.78 276 B 1 -ATOM 2031 C CA . ALA B ? 276 ? 3.015 6.574 23.733 1.0 98.86 276 B 1 -ATOM 2032 C C . ALA B ? 276 ? 3.359 5.126 23.359 1.0 98.89 276 B 1 -ATOM 2033 O O . ALA B ? 276 ? 4.172 4.889 22.465 1.0 98.78 276 B 1 -ATOM 2034 C CB . ALA B ? 276 ? 1.732 7.043 23.031 1.0 98.77 276 B 1 -ATOM 2035 N N . ARG B ? 277 ? 2.718 4.151 24.016 1.0 98.78 277 B 1 -ATOM 2036 C CA . ARG B ? 277 ? 2.776 2.728 23.653 1.0 98.72 277 B 1 -ATOM 2037 C C . ARG B ? 277 ? 1.460 2.260 23.041 1.0 98.82 277 B 1 -ATOM 2038 O O . ARG B ? 277 ? 0.395 2.780 23.380 1.0 98.7 277 B 1 -ATOM 2039 C CB . ARG B ? 277 ? 3.191 1.870 24.861 1.0 98.03 277 B 1 -ATOM 2040 C CG . ARG B ? 277 ? 2.166 1.898 26.005 1.0 95.02 277 B 1 -ATOM 2041 C CD . ARG B ? 277 ? 2.610 1.058 27.209 1.0 93.96 277 B 1 -ATOM 2042 N NE . ARG B ? 277 ? 3.854 1.593 27.806 1.0 88.5 277 B 1 -ATOM 2043 C CZ . ARG B ? 277 ? 4.472 1.131 28.873 1.0 87.53 277 B 1 -ATOM 2044 N NH1 . ARG B ? 277 ? 4.015 0.124 29.546 1.0 78.95 277 B 1 -ATOM 2045 N NH2 . ARG B ? 277 ? 5.576 1.688 29.278 1.0 79.18 277 B 1 -ATOM 2046 N N . MET B ? 278 ? 1.530 1.251 22.189 1.0 98.74 278 B 1 -ATOM 2047 C CA . MET B ? 278 ? 0.349 0.563 21.669 1.0 98.71 278 B 1 -ATOM 2048 C C . MET B ? 278 ? -0.224 -0.368 22.748 1.0 98.66 278 B 1 -ATOM 2049 O O . MET B ? 278 ? 0.524 -1.114 23.376 1.0 98.25 278 B 1 -ATOM 2050 C CB . MET B ? 278 ? 0.753 -0.208 20.405 1.0 98.46 278 B 1 -ATOM 2051 C CG . MET B ? 278 ? -0.443 -0.793 19.650 1.0 96.57 278 B 1 -ATOM 2052 S SD . MET B ? 278 ? -1.527 0.420 18.848 1.0 96.7 278 B 1 -ATOM 2053 C CE . MET B ? 278 ? -0.483 0.894 17.452 1.0 92.99 278 B 1 -ATOM 2054 N N . LEU B ? 279 ? -1.539 -0.344 22.958 1.0 98.67 279 B 1 -ATOM 2055 C CA . LEU B ? 279 ? -2.235 -1.298 23.834 1.0 98.6 279 B 1 -ATOM 2056 C C . LEU B ? 279 ? -3.082 -2.299 23.043 1.0 98.39 279 B 1 -ATOM 2057 O O . LEU B ? 279 ? -3.182 -3.459 23.427 1.0 97.81 279 B 1 -ATOM 2058 C CB . LEU B ? 279 ? -3.105 -0.560 24.863 1.0 98.62 279 B 1 -ATOM 2059 C CG . LEU B ? 279 ? -2.375 0.399 25.817 1.0 98.2 279 B 1 -ATOM 2060 C CD1 . LEU B ? 279 ? -3.378 0.934 26.840 1.0 97.64 279 B 1 -ATOM 2061 C CD2 . LEU B ? 279 ? -1.233 -0.267 26.578 1.0 97.43 279 B 1 -ATOM 2062 N N . ALA B ? 280 ? -3.694 -1.853 21.949 1.0 98.63 280 B 1 -ATOM 2063 C CA . ALA B ? 280 ? -4.446 -2.711 21.042 1.0 98.66 280 B 1 -ATOM 2064 C C . ALA B ? 280 ? -4.598 -2.066 19.664 1.0 98.75 280 B 1 -ATOM 2065 O O . ALA B ? 280 ? -4.659 -0.844 19.534 1.0 98.63 280 B 1 -ATOM 2066 C CB . ALA B ? 280 ? -5.830 -2.998 21.641 1.0 98.41 280 B 1 -ATOM 2067 N N . TYR B ? 281 ? -4.745 -2.900 18.647 1.0 98.72 281 B 1 -ATOM 2068 C CA . TYR B ? 281 ? -5.221 -2.518 17.321 1.0 98.64 281 B 1 -ATOM 2069 C C . TYR B ? 281 ? -6.147 -3.610 16.789 1.0 98.56 281 B 1 -ATOM 2070 O O . TYR B ? 281 ? -6.017 -4.781 17.155 1.0 98.12 281 B 1 -ATOM 2071 C CB . TYR B ? 281 ? -4.044 -2.237 16.374 1.0 98.49 281 B 1 -ATOM 2072 C CG . TYR B ? 281 ? -3.090 -3.401 16.176 1.0 98.53 281 B 1 -ATOM 2073 C CD1 . TYR B ? 281 ? -1.957 -3.534 17.007 1.0 98.1 281 B 1 -ATOM 2074 C CD2 . TYR B ? 281 ? -3.325 -4.355 15.169 1.0 98.06 281 B 1 -ATOM 2075 C CE1 . TYR B ? 281 ? -1.068 -4.605 16.836 1.0 97.72 281 B 1 -ATOM 2076 C CE2 . TYR B ? 281 ? -2.441 -5.436 14.988 1.0 97.69 281 B 1 -ATOM 2077 C CZ . TYR B ? 281 ? -1.312 -5.556 15.827 1.0 97.85 281 B 1 -ATOM 2078 O OH . TYR B ? 281 ? -0.449 -6.607 15.660 1.0 96.95 281 B 1 -ATOM 2079 N N . GLY B ? 282 ? -7.101 -3.239 15.952 1.0 98.68 282 B 1 -ATOM 2080 C CA . GLY B ? 282 ? -8.053 -4.192 15.403 1.0 98.66 282 B 1 -ATOM 2081 C C . GLY B ? 282 ? -8.959 -3.581 14.349 1.0 98.81 282 B 1 -ATOM 2082 O O . GLY B ? 282 ? -8.974 -2.371 14.124 1.0 98.62 282 B 1 -ATOM 2083 N N . ASP B ? 283 ? -9.735 -4.452 13.723 1.0 98.79 283 B 1 -ATOM 2084 C CA . ASP B ? 283 ? -10.682 -4.091 12.683 1.0 98.74 283 B 1 -ATOM 2085 C C . ASP B ? 283 ? -12.022 -4.794 12.933 1.0 98.75 283 B 1 -ATOM 2086 O O . ASP B ? 283 ? -12.090 -5.897 13.486 1.0 98.3 283 B 1 -ATOM 2087 C CB . ASP B ? 283 ? -10.111 -4.469 11.308 1.0 98.37 283 B 1 -ATOM 2088 C CG . ASP B ? 283 ? -8.840 -3.710 10.912 1.0 97.02 283 B 1 -ATOM 2089 O OD1 . ASP B ? 283 ? -8.974 -2.575 10.402 1.0 91.93 283 B 1 -ATOM 2090 O OD2 . ASP B ? 283 ? -7.737 -4.287 10.989 1.0 91.24 283 B 1 -ATOM 2091 N N . ALA B ? 284 ? -13.102 -4.157 12.499 1.0 98.76 284 B 1 -ATOM 2092 C CA . ALA B ? 284 ? -14.428 -4.747 12.401 1.0 98.75 284 B 1 -ATOM 2093 C C . ALA B ? 284 ? -15.034 -4.412 11.036 1.0 98.78 284 B 1 -ATOM 2094 O O . ALA B ? 284 ? -14.636 -3.443 10.391 1.0 98.37 284 B 1 -ATOM 2095 C CB . ALA B ? 284 ? -15.298 -4.258 13.562 1.0 98.41 284 B 1 -ATOM 2096 N N . ALA B ? 285 ? -15.999 -5.207 10.594 1.0 98.66 285 B 1 -ATOM 2097 C CA . ALA B ? 285 ? -16.739 -4.946 9.370 1.0 98.67 285 B 1 -ATOM 2098 C C . ALA B ? 285 ? -18.181 -5.451 9.475 1.0 98.66 285 B 1 -ATOM 2099 O O . ALA B ? 285 ? -18.490 -6.346 10.262 1.0 98.2 285 B 1 -ATOM 2100 C CB . ALA B ? 285 ? -15.984 -5.554 8.178 1.0 98.37 285 B 1 -ATOM 2101 N N . THR B ? 286 ? -19.061 -4.845 8.672 1.0 98.58 286 B 1 -ATOM 2102 C CA . THR B ? 286 ? -20.486 -5.167 8.555 1.0 98.56 286 B 1 -ATOM 2103 C C . THR B ? 286 ? -20.959 -4.914 7.117 1.0 98.59 286 B 1 -ATOM 2104 O O . THR B ? 286 ? -20.133 -4.787 6.203 1.0 98.13 286 B 1 -ATOM 2105 C CB . THR B ? 286 ? -21.279 -4.374 9.614 1.0 98.13 286 B 1 -ATOM 2106 O OG1 . THR B ? 286 ? -22.615 -4.829 9.636 1.0 96.31 286 B 1 -ATOM 2107 C CG2 . THR B ? 286 ? -21.298 -2.861 9.392 1.0 95.91 286 B 1 -ATOM 2108 N N . HIS B ? 287 ? -22.266 -4.852 6.888 1.0 98.44 287 B 1 -ATOM 2109 C CA . HIS B ? 287 ? -22.813 -4.534 5.570 1.0 98.39 287 B 1 -ATOM 2110 C C . HIS B ? 287 ? -22.276 -3.192 5.047 1.0 98.49 287 B 1 -ATOM 2111 O O . HIS B ? 287 ? -22.227 -2.222 5.802 1.0 98.19 287 B 1 -ATOM 2112 C CB . HIS B ? 287 ? -24.343 -4.519 5.623 1.0 98.12 287 B 1 -ATOM 2113 C CG . HIS B ? 287 ? -24.923 -5.885 5.847 1.0 95.81 287 B 1 -ATOM 2114 N ND1 . HIS B ? 287 ? -25.018 -6.887 4.905 1.0 84.5 287 B 1 -ATOM 2115 C CD2 . HIS B ? 287 ? -25.415 -6.395 7.025 1.0 84.81 287 B 1 -ATOM 2116 C CE1 . HIS B ? 287 ? -25.561 -7.963 5.498 1.0 87.12 287 B 1 -ATOM 2117 N NE2 . HIS B ? 287 ? -25.811 -7.704 6.789 1.0 88.21 287 B 1 -ATOM 2118 N N . PRO B ? 288 ? -21.907 -3.096 3.759 1.0 98.38 288 B 1 -ATOM 2119 C CA . PRO B ? 288 ? -21.284 -1.897 3.185 1.0 98.33 288 B 1 -ATOM 2120 C C . PRO B ? 288 ? -22.024 -0.587 3.479 1.0 98.39 288 B 1 -ATOM 2121 O O . PRO B ? 288 ? -21.409 0.396 3.896 1.0 98.24 288 B 1 -ATOM 2122 C CB . PRO B ? 288 ? -21.209 -2.183 1.685 1.0 98.2 288 B 1 -ATOM 2123 C CG . PRO B ? 288 ? -21.001 -3.694 1.637 1.0 97.73 288 B 1 -ATOM 2124 C CD . PRO B ? 288 ? -21.880 -4.186 2.784 1.0 98.39 288 B 1 -ATOM 2125 N N . ILE B ? 289 ? -23.350 -0.593 3.338 1.0 98.53 289 B 1 -ATOM 2126 C CA . ILE B ? 289 ? -24.201 0.583 3.579 1.0 98.61 289 B 1 -ATOM 2127 C C . ILE B ? 289 ? -24.182 1.052 5.044 1.0 98.67 289 B 1 -ATOM 2128 O O . ILE B ? 289 ? -24.491 2.206 5.335 1.0 98.4 289 B 1 -ATOM 2129 C CB . ILE B ? 289 ? -25.632 0.279 3.079 1.0 98.37 289 B 1 -ATOM 2130 C CG1 . ILE B ? 289 ? -26.424 1.586 2.881 1.0 96.85 289 B 1 -ATOM 2131 C CG2 . ILE B ? 289 ? -26.388 -0.697 4.015 1.0 96.49 289 B 1 -ATOM 2132 C CD1 . ILE B ? 289 ? -27.751 1.405 2.130 1.0 94.77 289 B 1 -ATOM 2133 N N . ASP B ? 290 ? -23.795 0.176 5.968 1.0 98.69 290 B 1 -ATOM 2134 C CA . ASP B ? 290 ? -23.791 0.423 7.407 1.0 98.7 290 B 1 -ATOM 2135 C C . ASP B ? 290 ? -22.402 0.792 7.955 1.0 98.74 290 B 1 -ATOM 2136 O O . ASP B ? 290 ? -22.174 0.700 9.163 1.0 98.41 290 B 1 -ATOM 2137 C CB . ASP B ? 290 ? -24.437 -0.774 8.132 1.0 98.54 290 B 1 -ATOM 2138 C CG . ASP B ? 290 ? -25.947 -0.835 7.896 1.0 98.36 290 B 1 -ATOM 2139 O OD1 . ASP B ? 290 ? -26.602 0.225 8.017 1.0 96.92 290 B 1 -ATOM 2140 O OD2 . ASP B ? 290 ? -26.499 -1.909 7.595 1.0 96.88 290 B 1 -ATOM 2141 N N . PHE B ? 291 ? -21.479 1.266 7.117 1.0 98.73 291 B 1 -ATOM 2142 C CA . PHE B ? 291 ? -20.139 1.662 7.585 1.0 98.73 291 B 1 -ATOM 2143 C C . PHE B ? 291 ? -20.178 2.632 8.783 1.0 98.79 291 B 1 -ATOM 2144 O O . PHE B ? 291 ? -19.289 2.597 9.635 1.0 98.6 291 B 1 -ATOM 2145 C CB . PHE B ? 291 ? -19.319 2.270 6.433 1.0 98.5 291 B 1 -ATOM 2146 C CG . PHE B ? 291 ? -19.728 3.671 6.016 1.0 98.56 291 B 1 -ATOM 2147 C CD1 . PHE B ? 291 ? -20.536 3.867 4.888 1.0 97.48 291 B 1 -ATOM 2148 C CD2 . PHE B ? 291 ? -19.349 4.788 6.791 1.0 97.43 291 B 1 -ATOM 2149 C CE1 . PHE B ? 291 ? -20.982 5.158 4.551 1.0 96.46 291 B 1 -ATOM 2150 C CE2 . PHE B ? 291 ? -19.799 6.080 6.466 1.0 96.15 291 B 1 -ATOM 2151 C CZ . PHE B ? 291 ? -20.624 6.259 5.346 1.0 97.13 291 B 1 -ATOM 2152 N N . GLY B ? 292 ? -21.207 3.463 8.872 1.0 98.67 292 B 1 -ATOM 2153 C CA . GLY B ? 292 ? -21.366 4.449 9.944 1.0 98.67 292 B 1 -ATOM 2154 C C . GLY B ? 292 ? -21.506 3.845 11.344 1.0 98.78 292 B 1 -ATOM 2155 O O . GLY B ? 292 ? -21.164 4.504 12.328 1.0 98.51 292 B 1 -ATOM 2156 N N . ILE B ? 293 ? -21.946 2.592 11.456 1.0 98.83 293 B 1 -ATOM 2157 C CA . ILE B ? 293 ? -22.085 1.879 12.740 1.0 98.79 293 B 1 -ATOM 2158 C C . ILE B ? 293 ? -20.841 1.056 13.106 1.0 98.82 293 B 1 -ATOM 2159 O O . ILE B ? 293 ? -20.689 0.643 14.255 1.0 98.46 293 B 1 -ATOM 2160 C CB . ILE B ? 293 ? -23.378 1.030 12.790 1.0 98.44 293 B 1 -ATOM 2161 C CG1 . ILE B ? 293 ? -23.281 -0.266 11.958 1.0 96.68 293 B 1 -ATOM 2162 C CG2 . ILE B ? 293 ? -24.598 1.878 12.363 1.0 95.54 293 B 1 -ATOM 2163 C CD1 . ILE B ? 293 ? -24.474 -1.216 12.120 1.0 94.37 293 B 1 -ATOM 2164 N N . ALA B ? 294 ? -19.934 0.822 12.155 1.0 98.84 294 B 1 -ATOM 2165 C CA . ALA B ? 294 ? -18.779 -0.051 12.353 1.0 98.86 294 B 1 -ATOM 2166 C C . ALA B ? 294 ? -17.792 0.417 13.452 1.0 98.89 294 B 1 -ATOM 2167 O O . ALA B ? 294 ? -17.239 -0.449 14.139 1.0 98.81 294 B 1 -ATOM 2168 C CB . ALA B ? 294 ? -18.100 -0.293 10.995 1.0 98.77 294 B 1 -ATOM 2169 N N . PRO B ? 295 ? -17.599 1.724 13.728 1.0 98.9 295 B 1 -ATOM 2170 C CA . PRO B ? 295 ? -16.820 2.169 14.891 1.0 98.91 295 B 1 -ATOM 2171 C C . PRO B ? 295 ? -17.356 1.636 16.224 1.0 98.92 295 B 1 -ATOM 2172 O O . PRO B ? 295 ? -16.571 1.212 17.074 1.0 98.87 295 B 1 -ATOM 2173 C CB . PRO B ? 295 ? -16.837 3.699 14.842 1.0 98.86 295 B 1 -ATOM 2174 C CG . PRO B ? 295 ? -16.987 3.986 13.351 1.0 98.47 295 B 1 -ATOM 2175 C CD . PRO B ? 295 ? -17.923 2.868 12.895 1.0 98.85 295 B 1 -ATOM 2176 N N . ALA B ? 296 ? -18.681 1.563 16.385 1.0 98.88 296 B 1 -ATOM 2177 C CA . ALA B ? 296 ? -19.302 0.994 17.584 1.0 98.86 296 B 1 -ATOM 2178 C C . ALA B ? 296 ? -19.043 -0.519 17.739 1.0 98.85 296 B 1 -ATOM 2179 O O . ALA B ? 296 ? -19.140 -1.048 18.845 1.0 98.57 296 B 1 -ATOM 2180 C CB . ALA B ? 296 ? -20.802 1.307 17.560 1.0 98.71 296 B 1 -ATOM 2181 N N . SER B ? 297 ? -18.668 -1.211 16.661 1.0 98.85 297 B 1 -ATOM 2182 C CA . SER B ? 297 ? -18.277 -2.627 16.681 1.0 98.78 297 B 1 -ATOM 2183 C C . SER B ? 297 ? -16.778 -2.828 16.930 1.0 98.85 297 B 1 -ATOM 2184 O O . SER B ? 297 ? -16.391 -3.783 17.601 1.0 98.58 297 B 1 -ATOM 2185 C CB . SER B ? 297 ? -18.663 -3.303 15.365 1.0 98.3 297 B 1 -ATOM 2186 O OG . SER B ? 297 ? -20.059 -3.229 15.163 1.0 90.84 297 B 1 -ATOM 2187 N N . VAL B ? 298 ? -15.921 -1.949 16.411 1.0 98.88 298 B 1 -ATOM 2188 C CA . VAL B ? 298 ? -14.465 -2.078 16.598 1.0 98.91 298 B 1 -ATOM 2189 C C . VAL B ? 298 ? -14.019 -1.675 18.003 1.0 98.92 298 B 1 -ATOM 2190 O O . VAL B ? 298 ? -13.132 -2.318 18.562 1.0 98.86 298 B 1 -ATOM 2191 C CB . VAL B ? 298 ? -13.672 -1.350 15.496 1.0 98.8 298 B 1 -ATOM 2192 C CG1 . VAL B ? 298 ? -13.547 0.159 15.700 1.0 98.09 298 B 1 -ATOM 2193 C CG2 . VAL B ? 298 ? -12.264 -1.943 15.367 1.0 97.21 298 B 1 -ATOM 2194 N N . ILE B ? 299 ? -14.654 -0.667 18.605 1.0 98.92 299 B 1 -ATOM 2195 C CA . ILE B ? 299 ? -14.295 -0.171 19.942 1.0 98.93 299 B 1 -ATOM 2196 C C . ILE B ? 299 ? -14.373 -1.281 21.008 1.0 98.91 299 B 1 -ATOM 2197 O O . ILE B ? 299 ? -13.368 -1.508 21.683 1.0 98.87 299 B 1 -ATOM 2198 C CB . ILE B ? 299 ? -15.098 1.102 20.296 1.0 98.92 299 B 1 -ATOM 2199 C CG1 . ILE B ? 299 ? -14.554 2.299 19.486 1.0 98.77 299 B 1 -ATOM 2200 C CG2 . ILE B ? 299 ? -15.041 1.408 21.808 1.0 98.78 299 B 1 -ATOM 2201 C CD1 . ILE B ? 299 ? -15.479 3.524 19.499 1.0 98.45 299 B 1 -ATOM 2202 N N . PRO B ? 300 ? -15.477 -2.045 21.147 1.0 98.9 300 B 1 -ATOM 2203 C CA . PRO B ? 300 ? -15.525 -3.175 22.085 1.0 98.84 300 B 1 -ATOM 2204 C C . PRO B ? 300 ? -14.455 -4.239 21.813 1.0 98.79 300 B 1 -ATOM 2205 O O . PRO B ? 300 ? -13.924 -4.844 22.747 1.0 98.55 300 B 1 -ATOM 2206 C CB . PRO B ? 300 ? -16.931 -3.763 21.951 1.0 98.67 300 B 1 -ATOM 2207 C CG . PRO B ? 300 ? -17.767 -2.588 21.457 1.0 97.75 300 B 1 -ATOM 2208 C CD . PRO B ? 300 ? -16.790 -1.840 20.556 1.0 98.72 300 B 1 -ATOM 2209 N N . LYS B ? 301 ? -14.105 -4.460 20.543 1.0 98.8 301 B 1 -ATOM 2210 C CA . LYS B ? 301 ? -13.065 -5.416 20.139 1.0 98.66 301 B 1 -ATOM 2211 C C . LYS B ? 301 ? -11.689 -5.007 20.665 1.0 98.65 301 B 1 -ATOM 2212 O O . LYS B ? 301 ? -11.017 -5.812 21.301 1.0 98.24 301 B 1 -ATOM 2213 C CB . LYS B ? 301 ? -13.052 -5.557 18.605 1.0 98.16 301 B 1 -ATOM 2214 C CG . LYS B ? 301 ? -13.332 -6.981 18.117 1.0 90.24 301 B 1 -ATOM 2215 C CD . LYS B ? 301 ? -13.280 -7.020 16.588 1.0 90.09 301 B 1 -ATOM 2216 C CE . LYS B ? 301 ? -13.540 -8.430 16.036 1.0 82.74 301 B 1 -ATOM 2217 N NZ . LYS B ? 301 ? -13.453 -8.445 14.551 1.0 75.72 301 B 1 -ATOM 2218 N N . VAL B ? 302 ? -11.287 -3.752 20.436 1.0 98.67 302 B 1 -ATOM 2219 C CA . VAL B ? 302 ? -9.970 -3.261 20.880 1.0 98.74 302 B 1 -ATOM 2220 C C . VAL B ? 302 ? -9.908 -3.051 22.396 1.0 98.71 302 B 1 -ATOM 2221 O O . VAL B ? 302 ? -8.881 -3.345 22.998 1.0 98.59 302 B 1 -ATOM 2222 C CB . VAL B ? 302 ? -9.498 -2.007 20.113 1.0 98.69 302 B 1 -ATOM 2223 C CG1 . VAL B ? 302 ? -9.282 -2.343 18.634 1.0 98.15 302 B 1 -ATOM 2224 C CG2 . VAL B ? 302 ? -10.439 -0.807 20.221 1.0 97.2 302 B 1 -ATOM 2225 N N . LEU B ? 303 ? -11.012 -2.654 23.040 1.0 98.8 303 B 1 -ATOM 2226 C CA . LEU B ? 303 ? -11.107 -2.618 24.507 1.0 98.77 303 B 1 -ATOM 2227 C C . LEU B ? 303 ? -10.850 -4.005 25.105 1.0 98.62 303 B 1 -ATOM 2228 O O . LEU B ? 303 ? -10.014 -4.149 25.998 1.0 98.41 303 B 1 -ATOM 2229 C CB . LEU B ? 303 ? -12.491 -2.102 24.937 1.0 98.81 303 B 1 -ATOM 2230 C CG . LEU B ? 303 ? -12.694 -0.583 24.804 1.0 98.57 303 B 1 -ATOM 2231 C CD1 . LEU B ? 303 ? -14.171 -0.251 25.023 1.0 98.23 303 B 1 -ATOM 2232 C CD2 . LEU B ? 303 ? -11.883 0.198 25.836 1.0 98.17 303 B 1 -ATOM 2233 N N . LYS B ? 304 ? -11.506 -5.042 24.570 1.0 98.62 304 B 1 -ATOM 2234 C CA . LYS B ? 304 ? -11.309 -6.423 25.022 1.0 98.43 304 B 1 -ATOM 2235 C C . LYS B ? 304 ? -9.869 -6.904 24.809 1.0 98.22 304 B 1 -ATOM 2236 O O . LYS B ? 304 ? -9.326 -7.572 25.684 1.0 97.7 304 B 1 -ATOM 2237 C CB . LYS B ? 304 ? -12.329 -7.330 24.320 1.0 98.27 304 B 1 -ATOM 2238 C CG . LYS B ? 304 ? -12.295 -8.761 24.879 1.0 94.54 304 B 1 -ATOM 2239 C CD . LYS B ? 304 ? -13.352 -9.636 24.199 1.0 90.03 304 B 1 -ATOM 2240 C CE . LYS B ? 304 ? -13.300 -11.048 24.794 1.0 80.42 304 B 1 -ATOM 2241 N NZ . LYS B ? 304 ? -14.288 -11.954 24.161 1.0 70.77 304 B 1 -ATOM 2242 N N . LEU B ? 305 ? -9.252 -6.563 23.680 1.0 98.18 305 B 1 -ATOM 2243 C CA . LEU B ? 305 ? -7.849 -6.898 23.396 1.0 97.75 305 B 1 -ATOM 2244 C C . LEU B ? 305 ? -6.880 -6.211 24.372 1.0 97.75 305 B 1 -ATOM 2245 O O . LEU B ? 305 ? -5.906 -6.828 24.794 1.0 97.06 305 B 1 -ATOM 2246 C CB . LEU B ? 305 ? -7.507 -6.511 21.945 1.0 97.25 305 B 1 -ATOM 2247 C CG . LEU B ? 305 ? -8.111 -7.435 20.870 1.0 95.77 305 B 1 -ATOM 2248 C CD1 . LEU B ? 305 ? -7.920 -6.804 19.490 1.0 94.15 305 B 1 -ATOM 2249 C CD2 . LEU B ? 305 ? -7.453 -8.815 20.862 1.0 93.98 305 B 1 -ATOM 2250 N N . ALA B ? 306 ? -7.170 -4.970 24.767 1.0 97.92 306 B 1 -ATOM 2251 C CA . ALA B ? 306 ? -6.374 -4.225 25.745 1.0 98.14 306 B 1 -ATOM 2252 C C . ALA B ? 306 ? -6.676 -4.607 27.210 1.0 98.18 306 B 1 -ATOM 2253 O O . ALA B ? 306 ? -5.959 -4.178 28.113 1.0 97.85 306 B 1 -ATOM 2254 C CB . ALA B ? 306 ? -6.595 -2.729 25.498 1.0 98.24 306 B 1 -ATOM 2255 N N . GLY B ? 307 ? -7.731 -5.386 27.464 1.0 98.11 307 B 1 -ATOM 2256 C CA . GLY B ? 307 ? -8.201 -5.699 28.821 1.0 98.12 307 B 1 -ATOM 2257 C C . GLY B ? 307 ? -8.794 -4.487 29.549 1.0 98.41 307 B 1 -ATOM 2258 O O . GLY B ? 307 ? -8.666 -4.383 30.768 1.0 97.94 307 B 1 -ATOM 2259 N N . LEU B ? 308 ? -9.415 -3.573 28.815 1.0 98.46 308 B 1 -ATOM 2260 C CA . LEU B ? 308 ? -9.944 -2.305 29.320 1.0 98.65 308 B 1 -ATOM 2261 C C . LEU B ? 308 ? -11.468 -2.220 29.189 1.0 98.73 308 B 1 -ATOM 2262 O O . LEU B ? 308 ? -12.109 -2.951 28.432 1.0 98.5 308 B 1 -ATOM 2263 C CB . LEU B ? 308 ? -9.252 -1.135 28.593 1.0 98.58 308 B 1 -ATOM 2264 C CG . LEU B ? 308 ? -7.735 -1.020 28.818 1.0 98.24 308 B 1 -ATOM 2265 C CD1 . LEU B ? 308 ? -7.197 0.132 27.971 1.0 97.58 308 B 1 -ATOM 2266 C CD2 . LEU B ? 308 ? -7.369 -0.756 30.277 1.0 97.49 308 B 1 -ATOM 2267 N N . GLN B ? 309 ? -12.052 -1.265 29.910 1.0 98.73 309 B 1 -ATOM 2268 C CA . GLN B ? 309 ? -13.448 -0.850 29.792 1.0 98.71 309 B 1 -ATOM 2269 C C . GLN B ? 309 ? -13.529 0.589 29.273 1.0 98.82 309 B 1 -ATOM 2270 O O . GLN B ? 309 ? -12.548 1.330 29.296 1.0 98.57 309 B 1 -ATOM 2271 C CB . GLN B ? 309 ? -14.151 -0.990 31.152 1.0 98.31 309 B 1 -ATOM 2272 C CG . GLN B ? 309 ? -14.156 -2.437 31.664 1.0 94.79 309 B 1 -ATOM 2273 C CD . GLN B ? 309 ? -14.987 -2.631 32.935 1.0 87.65 309 B 1 -ATOM 2274 O OE1 . GLN B ? 309 ? -15.460 -1.712 33.591 1.0 76.56 309 B 1 -ATOM 2275 N NE2 . GLN B ? 309 ? -15.211 -3.864 33.336 1.0 73.44 309 B 1 -ATOM 2276 N N . ILE B ? 310 ? -14.725 1.011 28.856 1.0 98.77 310 B 1 -ATOM 2277 C CA . ILE B ? 310 ? -14.976 2.384 28.370 1.0 98.78 310 B 1 -ATOM 2278 C C . ILE B ? 310 ? -14.479 3.447 29.366 1.0 98.78 310 B 1 -ATOM 2279 O O . ILE B ? 310 ? -13.845 4.419 28.967 1.0 98.5 310 B 1 -ATOM 2280 C CB . ILE B ? 310 ? -16.485 2.550 28.064 1.0 98.58 310 B 1 -ATOM 2281 C CG1 . ILE B ? 310 ? -16.841 1.742 26.793 1.0 97.34 310 B 1 -ATOM 2282 C CG2 . ILE B ? 310 ? -16.891 4.027 27.896 1.0 97.75 310 B 1 -ATOM 2283 C CD1 . ILE B ? 310 ? -18.343 1.559 26.565 1.0 93.28 310 B 1 -ATOM 2284 N N . LYS B ? 311 ? -14.711 3.235 30.667 1.0 98.65 311 B 1 -ATOM 2285 C CA . LYS B ? 311 ? -14.309 4.163 31.742 1.0 98.49 311 B 1 -ATOM 2286 C C . LYS B ? 311 ? -12.796 4.374 31.864 1.0 98.6 311 B 1 -ATOM 2287 O O . LYS B ? 311 ? -12.383 5.358 32.463 1.0 98.1 311 B 1 -ATOM 2288 C CB . LYS B ? 311 ? -14.900 3.677 33.077 1.0 97.92 311 B 1 -ATOM 2289 C CG . LYS B ? 311 ? -14.266 2.353 33.540 1.0 92.43 311 B 1 -ATOM 2290 C CD . LYS B ? 311 ? -14.811 1.885 34.892 1.0 88.28 311 B 1 -ATOM 2291 C CE . LYS B ? 311 ? -14.013 0.634 35.259 1.0 76.4 311 B 1 -ATOM 2292 N NZ . LYS B ? 311 ? -14.449 0.037 36.541 1.0 67.86 311 B 1 -ATOM 2293 N N . ASP B ? 312 ? -11.989 3.452 31.324 1.0 98.7 312 B 1 -ATOM 2294 C CA . ASP B ? 312 ? -10.525 3.509 31.402 1.0 98.73 312 B 1 -ATOM 2295 C C . ASP B ? 312 ? -9.912 4.388 30.297 1.0 98.8 312 B 1 -ATOM 2296 O O . ASP B ? 312 ? -8.705 4.657 30.322 1.0 98.61 312 B 1 -ATOM 2297 C CB . ASP B ? 312 ? -9.947 2.084 31.346 1.0 98.62 312 B 1 -ATOM 2298 C CG . ASP B ? 312 ? -10.508 1.147 32.424 1.0 98.4 312 B 1 -ATOM 2299 O OD1 . ASP B ? 312 ? -10.567 1.558 33.607 1.0 97.04 312 B 1 -ATOM 2300 O OD2 . ASP B ? 312 ? -10.903 0.013 32.066 1.0 96.98 312 B 1 -ATOM 2301 N N . ILE B ? 313 ? -10.729 4.828 29.339 1.0 98.83 313 B 1 -ATOM 2302 C CA . ILE B ? 313 ? -10.319 5.720 28.253 1.0 98.89 313 B 1 -ATOM 2303 C C . ILE B ? 313 ? -10.541 7.179 28.666 1.0 98.88 313 B 1 -ATOM 2304 O O . ILE B ? 313 ? -11.654 7.590 28.997 1.0 98.77 313 B 1 -ATOM 2305 C CB . ILE B ? 313 ? -11.055 5.370 26.942 1.0 98.87 313 B 1 -ATOM 2306 C CG1 . ILE B ? 313 ? -10.882 3.889 26.522 1.0 98.55 313 B 1 -ATOM 2307 C CG2 . ILE B ? 313 ? -10.611 6.301 25.800 1.0 98.7 313 B 1 -ATOM 2308 C CD1 . ILE B ? 313 ? -9.427 3.419 26.318 1.0 98.25 313 B 1 -ATOM 2309 N N . ASP B ? 314 ? -9.477 7.966 28.608 1.0 98.86 314 B 1 -ATOM 2310 C CA . ASP B ? 314 ? -9.498 9.391 28.952 1.0 98.82 314 B 1 -ATOM 2311 C C . ASP B ? 314 ? -9.982 10.264 27.788 1.0 98.83 314 B 1 -ATOM 2312 O O . ASP B ? 314 ? -10.712 11.234 28.009 1.0 98.52 314 B 1 -ATOM 2313 C CB . ASP B ? 314 ? -8.092 9.821 29.373 1.0 98.72 314 B 1 -ATOM 2314 C CG . ASP B ? 314 ? -7.636 9.102 30.642 1.0 98.27 314 B 1 -ATOM 2315 O OD1 . ASP B ? 314 ? -8.042 9.568 31.738 1.0 95.05 314 B 1 -ATOM 2316 O OD2 . ASP B ? 314 ? -6.860 8.128 30.518 1.0 95.36 314 B 1 -ATOM 2317 N N . LEU B ? 315 ? -9.566 9.931 26.558 1.0 98.91 315 B 1 -ATOM 2318 C CA . LEU B ? 315 ? -9.903 10.649 25.328 1.0 98.92 315 B 1 -ATOM 2319 C C . LEU B ? 315 ? -10.242 9.686 24.188 1.0 98.95 315 B 1 -ATOM 2320 O O . LEU B ? 315 ? -9.593 8.655 23.996 1.0 98.88 315 B 1 -ATOM 2321 C CB . LEU B ? 315 ? -8.746 11.577 24.905 1.0 98.78 315 B 1 -ATOM 2322 C CG . LEU B ? 315 ? -8.424 12.738 25.864 1.0 97.82 315 B 1 -ATOM 2323 C CD1 . LEU B ? 315 ? -7.250 13.540 25.300 1.0 96.46 315 B 1 -ATOM 2324 C CD2 . LEU B ? 315 ? -9.602 13.697 26.048 1.0 96.57 315 B 1 -ATOM 2325 N N . TRP B ? 316 ? -11.222 10.082 23.394 1.0 98.95 316 B 1 -ATOM 2326 C CA . TRP B ? 316 ? -11.684 9.375 22.206 1.0 98.96 316 B 1 -ATOM 2327 C C . TRP B ? 316 ? -11.495 10.250 20.970 1.0 98.95 316 B 1 -ATOM 2328 O O . TRP B ? 316 ? -11.901 11.413 20.957 1.0 98.85 316 B 1 -ATOM 2329 C CB . TRP B ? 316 ? -13.158 9.002 22.365 1.0 98.93 316 B 1 -ATOM 2330 C CG . TRP B ? 316 ? -13.494 8.175 23.563 1.0 98.94 316 B 1 -ATOM 2331 C CD1 . TRP B ? 316 ? -13.750 8.658 24.801 1.0 98.74 316 B 1 -ATOM 2332 C CD2 . TRP B ? 316 ? -13.599 6.720 23.652 1.0 98.91 316 B 1 -ATOM 2333 N NE1 . TRP B ? 316 ? -14.013 7.594 25.662 1.0 98.77 316 B 1 -ATOM 2334 C CE2 . TRP B ? 316 ? -13.933 6.390 24.996 1.0 98.85 316 B 1 -ATOM 2335 C CE3 . TRP B ? 316 ? -13.448 5.664 22.732 1.0 98.83 316 B 1 -ATOM 2336 C CZ2 . TRP B ? 316 ? -14.109 5.051 25.414 1.0 98.69 316 B 1 -ATOM 2337 C CZ3 . TRP B ? 316 ? -13.626 4.328 23.144 1.0 98.55 316 B 1 -ATOM 2338 C CH2 . TRP B ? 316 ? -13.950 4.028 24.474 1.0 98.51 316 B 1 -ATOM 2339 N N . GLU B ? 317 ? -10.951 9.667 19.915 1.0 98.97 317 B 1 -ATOM 2340 C CA . GLU B ? 317 ? -10.942 10.226 18.567 1.0 98.97 317 B 1 -ATOM 2341 C C . GLU B ? 317 ? -11.770 9.305 17.666 1.0 98.97 317 B 1 -ATOM 2342 O O . GLU B ? 317 ? -11.327 8.226 17.274 1.0 98.91 317 B 1 -ATOM 2343 C CB . GLU B ? 317 ? -9.499 10.379 18.070 1.0 98.91 317 B 1 -ATOM 2344 C CG . GLU B ? 317 ? -8.820 11.662 18.578 1.0 97.61 317 B 1 -ATOM 2345 C CD . GLU B ? 317 ? -9.355 12.936 17.909 1.0 98.47 317 B 1 -ATOM 2346 O OE1 . GLU B ? 317 ? -9.304 14.008 18.547 1.0 96.31 317 B 1 -ATOM 2347 O OE2 . GLU B ? 317 ? -9.801 12.865 16.735 1.0 96.79 317 B 1 -ATOM 2348 N N . ILE B ? 318 ? -12.990 9.711 17.356 1.0 98.96 318 B 1 -ATOM 2349 C CA . ILE B ? 318 ? -13.891 8.992 16.445 1.0 98.95 318 B 1 -ATOM 2350 C C . ILE B ? 318 ? -14.020 9.838 15.183 1.0 98.95 318 B 1 -ATOM 2351 O O . ILE B ? 318 ? -14.610 10.917 15.222 1.0 98.84 318 B 1 -ATOM 2352 C CB . ILE B ? 318 ? -15.258 8.701 17.101 1.0 98.87 318 B 1 -ATOM 2353 C CG1 . ILE B ? 318 ? -15.083 7.887 18.410 1.0 98.0 318 B 1 -ATOM 2354 C CG2 . ILE B ? 318 ? -16.159 7.936 16.105 1.0 98.57 318 B 1 -ATOM 2355 C CD1 . ILE B ? 318 ? -16.374 7.739 19.218 1.0 94.6 318 B 1 -ATOM 2356 N N . ASN B ? 319 ? -13.457 9.377 14.073 1.0 98.91 319 B 1 -ATOM 2357 C CA . ASN B ? 319 ? -13.388 10.194 12.866 1.0 98.91 319 B 1 -ATOM 2358 C C . ASN B ? 319 ? -14.783 10.593 12.364 1.0 98.91 319 B 1 -ATOM 2359 O O . ASN B ? 319 ? -15.614 9.744 12.047 1.0 98.83 319 B 1 -ATOM 2360 C CB . ASN B ? 319 ? -12.569 9.483 11.785 1.0 98.89 319 B 1 -ATOM 2361 C CG . ASN B ? 319 ? -12.348 10.402 10.593 1.0 98.83 319 B 1 -ATOM 2362 O OD1 . ASN B ? 319 ? -11.702 11.430 10.690 1.0 93.07 319 B 1 -ATOM 2363 N ND2 . ASN B ? 319 ? -12.899 10.078 9.446 1.0 92.77 319 B 1 -ATOM 2364 N N . GLU B ? 320 ? -15.010 11.891 12.234 1.0 98.92 320 B 1 -ATOM 2365 C CA . GLU B ? 320 ? -16.286 12.511 11.870 1.0 98.9 320 B 1 -ATOM 2366 C C . GLU B ? 320 ? -16.534 12.479 10.350 1.0 98.9 320 B 1 -ATOM 2367 O O . GLU B ? 320 ? -16.766 13.521 9.729 1.0 98.71 320 B 1 -ATOM 2368 C CB . GLU B ? 320 ? -16.331 13.958 12.410 1.0 98.81 320 B 1 -ATOM 2369 C CG . GLU B ? 320 ? -16.166 14.061 13.933 1.0 98.74 320 B 1 -ATOM 2370 C CD . GLU B ? 320 ? -16.069 15.512 14.436 1.0 98.86 320 B 1 -ATOM 2371 O OE1 . GLU B ? 320 ? -16.077 15.703 15.671 1.0 98.14 320 B 1 -ATOM 2372 O OE2 . GLU B ? 320 ? -15.949 16.459 13.620 1.0 98.43 320 B 1 -ATOM 2373 N N . ALA B ? 321 ? -16.494 11.303 9.730 1.0 98.92 321 B 1 -ATOM 2374 C CA . ALA B ? 321 ? -16.833 11.177 8.308 1.0 98.89 321 B 1 -ATOM 2375 C C . ALA B ? 321 ? -18.168 11.870 7.984 1.0 98.9 321 B 1 -ATOM 2376 O O . ALA B ? 321 ? -18.299 12.583 6.990 1.0 98.7 321 B 1 -ATOM 2377 C CB . ALA B ? 321 ? -16.881 9.687 7.961 1.0 98.69 321 B 1 -ATOM 2378 N N . PHE B ? 322 ? -19.117 11.691 8.876 1.0 98.95 322 B 1 -ATOM 2379 C CA . PHE B ? 322 ? -20.364 12.445 8.993 1.0 98.95 322 B 1 -ATOM 2380 C C . PHE B ? 322 ? -20.681 12.572 10.486 1.0 98.94 322 B 1 -ATOM 2381 O O . PHE B ? 322 ? -20.347 11.661 11.245 1.0 98.83 322 B 1 -ATOM 2382 C CB . PHE B ? 322 ? -21.491 11.706 8.255 1.0 98.9 322 B 1 -ATOM 2383 C CG . PHE B ? 322 ? -21.191 11.412 6.798 1.0 98.92 322 B 1 -ATOM 2384 C CD1 . PHE B ? 322 ? -21.448 12.386 5.821 1.0 98.63 322 B 1 -ATOM 2385 C CD2 . PHE B ? 322 ? -20.584 10.201 6.419 1.0 98.65 322 B 1 -ATOM 2386 C CE1 . PHE B ? 322 ? -21.088 12.165 4.483 1.0 98.56 322 B 1 -ATOM 2387 C CE2 . PHE B ? 322 ? -20.217 9.972 5.080 1.0 98.51 322 B 1 -ATOM 2388 C CZ . PHE B ? 322 ? -20.463 10.962 4.115 1.0 98.68 322 B 1 -ATOM 2389 N N . ALA B ? 323 ? -21.355 13.653 10.915 1.0 98.92 323 B 1 -ATOM 2390 C CA . ALA B ? 323 ? -21.723 13.844 12.327 1.0 98.92 323 B 1 -ATOM 2391 C C . ALA B ? 323 ? -22.509 12.655 12.912 1.0 98.92 323 B 1 -ATOM 2392 O O . ALA B ? 323 ? -22.364 12.327 14.090 1.0 98.83 323 B 1 -ATOM 2393 C CB . ALA B ? 323 ? -22.529 15.142 12.447 1.0 98.87 323 B 1 -ATOM 2394 N N . VAL B ? 324 ? -23.278 11.956 12.085 1.0 98.87 324 B 1 -ATOM 2395 C CA . VAL B ? 324 ? -24.025 10.753 12.489 1.0 98.8 324 B 1 -ATOM 2396 C C . VAL B ? 324 ? -23.122 9.644 13.049 1.0 98.87 324 B 1 -ATOM 2397 O O . VAL B ? 324 ? -23.556 8.898 13.922 1.0 98.65 324 B 1 -ATOM 2398 C CB . VAL B ? 324 ? -24.892 10.244 11.314 1.0 97.68 324 B 1 -ATOM 2399 C CG1 . VAL B ? 324 ? -24.099 9.524 10.215 1.0 90.87 324 B 1 -ATOM 2400 C CG2 . VAL B ? 324 ? -26.000 9.307 11.788 1.0 92.36 324 B 1 -ATOM 2401 N N . VAL B ? 325 ? -21.871 9.543 12.598 1.0 98.9 325 B 1 -ATOM 2402 C CA . VAL B ? 325 ? -20.947 8.461 12.991 1.0 98.91 325 B 1 -ATOM 2403 C C . VAL B ? 325 ? -20.548 8.555 14.472 1.0 98.93 325 B 1 -ATOM 2404 O O . VAL B ? 325 ? -20.808 7.604 15.212 1.0 98.87 325 B 1 -ATOM 2405 C CB . VAL B ? 325 ? -19.717 8.395 12.059 1.0 98.85 325 B 1 -ATOM 2406 C CG1 . VAL B ? 325 ? -18.746 7.286 12.484 1.0 98.52 325 B 1 -ATOM 2407 C CG2 . VAL B ? 325 ? -20.127 8.135 10.604 1.0 98.5 325 B 1 -ATOM 2408 N N . PRO B ? 326 ? -19.965 9.659 14.964 1.0 98.95 326 B 1 -ATOM 2409 C CA . PRO B ? 326 ? -19.687 9.803 16.395 1.0 98.94 326 B 1 -ATOM 2410 C C . PRO B ? 326 ? -20.971 9.830 17.231 1.0 98.94 326 B 1 -ATOM 2411 O O . PRO B ? 326 ? -20.988 9.220 18.294 1.0 98.87 326 B 1 -ATOM 2412 C CB . PRO B ? 326 ? -18.864 11.086 16.536 1.0 98.83 326 B 1 -ATOM 2413 C CG . PRO B ? 326 ? -19.256 11.896 15.302 1.0 98.16 326 B 1 -ATOM 2414 C CD . PRO B ? 326 ? -19.471 10.821 14.246 1.0 98.82 326 B 1 -ATOM 2415 N N . LEU B ? 327 ? -22.065 10.437 16.743 1.0 98.92 327 B 1 -ATOM 2416 C CA . LEU B ? 327 ? -23.347 10.459 17.461 1.0 98.9 327 B 1 -ATOM 2417 C C . LEU B ? 327 ? -23.896 9.052 17.712 1.0 98.87 327 B 1 -ATOM 2418 O O . LEU B ? 327 ? -24.245 8.720 18.848 1.0 98.74 327 B 1 -ATOM 2419 C CB . LEU B ? 327 ? -24.377 11.286 16.676 1.0 98.88 327 B 1 -ATOM 2420 C CG . LEU B ? 327 ? -24.162 12.807 16.749 1.0 98.61 327 B 1 -ATOM 2421 C CD1 . LEU B ? 327 ? -25.084 13.492 15.742 1.0 98.14 327 B 1 -ATOM 2422 C CD2 . LEU B ? 327 ? -24.477 13.362 18.139 1.0 98.12 327 B 1 -ATOM 2423 N N . TYR B ? 328 ? -23.946 8.206 16.673 1.0 98.9 328 B 1 -ATOM 2424 C CA . TYR B ? 328 ? -24.358 6.808 16.817 1.0 98.89 328 B 1 -ATOM 2425 C C . TYR B ? 328 ? -23.445 6.058 17.791 1.0 98.88 328 B 1 -ATOM 2426 O O . TYR B ? 328 ? -23.924 5.350 18.677 1.0 98.78 328 B 1 -ATOM 2427 C CB . TYR B ? 328 ? -24.358 6.124 15.446 1.0 98.86 328 B 1 -ATOM 2428 C CG . TYR B ? 328 ? -24.682 4.647 15.540 1.0 98.78 328 B 1 -ATOM 2429 C CD1 . TYR B ? 328 ? -23.651 3.697 15.693 1.0 98.42 328 B 1 -ATOM 2430 C CD2 . TYR B ? 328 ? -26.023 4.218 15.560 1.0 98.44 328 B 1 -ATOM 2431 C CE1 . TYR B ? 328 ? -23.955 2.335 15.862 1.0 98.05 328 B 1 -ATOM 2432 C CE2 . TYR B ? 328 ? -26.339 2.858 15.724 1.0 98.05 328 B 1 -ATOM 2433 C CZ . TYR B ? 328 ? -25.299 1.921 15.879 1.0 98.14 328 B 1 -ATOM 2434 O OH . TYR B ? 328 ? -25.604 0.593 16.051 1.0 97.29 328 B 1 -ATOM 2435 N N . THR B ? 329 ? -22.137 6.249 17.660 1.0 98.91 329 B 1 -ATOM 2436 C CA . THR B ? 329 ? -21.140 5.566 18.491 1.0 98.9 329 B 1 -ATOM 2437 C C . THR B ? 329 ? -21.280 5.955 19.964 1.0 98.89 329 B 1 -ATOM 2438 O O . THR B ? 329 ? -21.339 5.082 20.826 1.0 98.79 329 B 1 -ATOM 2439 C CB . THR B ? 329 ? -19.719 5.855 17.992 1.0 98.86 329 B 1 -ATOM 2440 O OG1 . THR B ? 329 ? -19.604 5.578 16.615 1.0 97.93 329 B 1 -ATOM 2441 C CG2 . THR B ? 329 ? -18.689 4.980 18.701 1.0 98.01 329 B 1 -ATOM 2442 N N . MET B ? 330 ? -21.408 7.247 20.262 1.0 98.89 330 B 1 -ATOM 2443 C CA . MET B ? 330 ? -21.617 7.752 21.624 1.0 98.82 330 B 1 -ATOM 2444 C C . MET B ? 330 ? -22.917 7.224 22.240 1.0 98.77 330 B 1 -ATOM 2445 O O . MET B ? 330 ? -22.892 6.718 23.359 1.0 98.48 330 B 1 -ATOM 2446 C CB . MET B ? 330 ? -21.633 9.285 21.629 1.0 98.64 330 B 1 -ATOM 2447 C CG . MET B ? 330 ? -20.251 9.896 21.371 1.0 97.34 330 B 1 -ATOM 2448 S SD . MET B ? 330 ? -20.174 11.697 21.594 1.0 96.81 330 B 1 -ATOM 2449 C CE . MET B ? 330 ? -21.283 12.274 20.297 1.0 90.08 330 B 1 -ATOM 2450 N N . LYS B ? 331 ? -24.043 7.284 21.508 1.0 98.72 331 B 1 -ATOM 2451 C CA . LYS B ? 331 ? -25.338 6.764 21.978 1.0 98.47 331 B 1 -ATOM 2452 C C . LYS B ? 331 ? -25.293 5.260 22.245 1.0 98.54 331 B 1 -ATOM 2453 O O . LYS B ? 331 ? -25.802 4.802 23.262 1.0 97.97 331 B 1 -ATOM 2454 C CB . LYS B ? 331 ? -26.450 7.077 20.956 1.0 97.56 331 B 1 -ATOM 2455 C CG . LYS B ? 331 ? -26.985 8.517 21.064 1.0 83.34 331 B 1 -ATOM 2456 C CD . LYS B ? 331 ? -28.151 8.737 20.085 1.0 81.61 331 B 1 -ATOM 2457 C CE . LYS B ? 331 ? -28.793 10.111 20.301 1.0 70.95 331 B 1 -ATOM 2458 N NZ . LYS B ? 331 ? -29.937 10.366 19.385 1.0 64.17 331 B 1 -ATOM 2459 N N . THR B ? 332 ? -24.688 4.501 21.343 1.0 98.68 332 B 1 -ATOM 2460 C CA . THR B ? 332 ? -24.671 3.032 21.407 1.0 98.68 332 B 1 -ATOM 2461 C C . THR B ? 332 ? -23.769 2.510 22.521 1.0 98.72 332 B 1 -ATOM 2462 O O . THR B ? 332 ? -24.110 1.533 23.183 1.0 98.29 332 B 1 -ATOM 2463 C CB . THR B ? 332 ? -24.231 2.440 20.060 1.0 98.39 332 B 1 -ATOM 2464 O OG1 . THR B ? 332 ? -25.097 2.899 19.046 1.0 95.19 332 B 1 -ATOM 2465 C CG2 . THR B ? 332 ? -24.297 0.914 20.025 1.0 94.84 332 B 1 -ATOM 2466 N N . LEU B ? 333 ? -22.633 3.152 22.751 1.0 98.77 333 B 1 -ATOM 2467 C CA . LEU B ? 333 ? -21.643 2.724 23.748 1.0 98.79 333 B 1 -ATOM 2468 C C . LEU B ? 333 ? -21.729 3.496 25.074 1.0 98.74 333 B 1 -ATOM 2469 O O . LEU B ? 333 ? -21.058 3.121 26.034 1.0 98.25 333 B 1 -ATOM 2470 C CB . LEU B ? 333 ? -20.237 2.814 23.137 1.0 98.77 333 B 1 -ATOM 2471 C CG . LEU B ? 333 ? -20.007 1.952 21.878 1.0 98.45 333 B 1 -ATOM 2472 C CD1 . LEU B ? 333 ? -18.558 2.126 21.422 1.0 97.99 333 B 1 -ATOM 2473 C CD2 . LEU B ? 333 ? -20.243 0.462 22.124 1.0 97.82 333 B 1 -ATOM 2474 N N . GLY B ? 334 ? -22.539 4.562 25.141 1.0 98.58 334 B 1 -ATOM 2475 C CA . GLY B ? 334 ? -22.627 5.429 26.319 1.0 98.46 334 B 1 -ATOM 2476 C C . GLY B ? 334 ? -21.336 6.211 26.574 1.0 98.56 334 B 1 -ATOM 2477 O O . GLY B ? 334 ? -20.864 6.269 27.707 1.0 97.63 334 B 1 -ATOM 2478 N N . LEU B ? 335 ? -20.742 6.781 25.524 1.0 98.63 335 B 1 -ATOM 2479 C CA . LEU B ? 335 ? -19.516 7.578 25.649 1.0 98.65 335 B 1 -ATOM 2480 C C . LEU B ? 335 ? -19.832 8.993 26.136 1.0 98.53 335 B 1 -ATOM 2481 O O . LEU B ? 335 ? -20.821 9.601 25.732 1.0 98.0 335 B 1 -ATOM 2482 C CB . LEU B ? 335 ? -18.734 7.615 24.326 1.0 98.63 335 B 1 -ATOM 2483 C CG . LEU B ? 335 ? -18.424 6.244 23.696 1.0 98.24 335 B 1 -ATOM 2484 C CD1 . LEU B ? 335 ? -17.571 6.443 22.445 1.0 97.8 335 B 1 -ATOM 2485 C CD2 . LEU B ? 335 ? -17.681 5.306 24.641 1.0 97.77 335 B 1 -ATOM 2486 N N . ASP B ? 336 ? -18.949 9.541 26.962 1.0 98.31 336 B 1 -ATOM 2487 C CA . ASP B ? 336 ? -19.020 10.929 27.419 1.0 98.27 336 B 1 -ATOM 2488 C C . ASP B ? 336 ? -18.565 11.881 26.304 1.0 98.47 336 B 1 -ATOM 2489 O O . ASP B ? 336 ? -17.384 11.919 25.946 1.0 98.03 336 B 1 -ATOM 2490 C CB . ASP B ? 336 ? -18.169 11.064 28.691 1.0 97.67 336 B 1 -ATOM 2491 C CG . ASP B ? 336 ? -18.113 12.481 29.268 1.0 97.08 336 B 1 -ATOM 2492 O OD1 . ASP B ? 336 ? -18.750 13.408 28.714 1.0 95.46 336 B 1 -ATOM 2493 O OD2 . ASP B ? 336 ? -17.378 12.651 30.263 1.0 93.96 336 B 1 -ATOM 2494 N N . GLU B ? 337 ? -19.492 12.690 25.781 1.0 98.26 337 B 1 -ATOM 2495 C CA . GLU B ? 337 ? -19.225 13.662 24.710 1.0 98.23 337 B 1 -ATOM 2496 C C . GLU B ? 337 ? -18.105 14.658 25.071 1.0 98.48 337 B 1 -ATOM 2497 O O . GLU B ? 337 ? -17.397 15.142 24.193 1.0 98.11 337 B 1 -ATOM 2498 C CB . GLU B ? 337 ? -20.526 14.408 24.372 1.0 97.25 337 B 1 -ATOM 2499 C CG . GLU B ? 337 ? -20.389 15.295 23.119 1.0 91.41 337 B 1 -ATOM 2500 C CD . GLU B ? 337 ? -21.687 16.035 22.757 1.0 88.29 337 B 1 -ATOM 2501 O OE1 . GLU B ? 337 ? -22.109 15.945 21.584 1.0 81.01 337 B 1 -ATOM 2502 O OE2 . GLU B ? 337 ? -22.241 16.722 23.646 1.0 81.92 337 B 1 -ATOM 2503 N N . SER B ? 338 ? -17.903 14.945 26.368 1.0 98.55 338 B 1 -ATOM 2504 C CA . SER B ? 338 ? -16.825 15.836 26.818 1.0 98.55 338 B 1 -ATOM 2505 C C . SER B ? 338 ? -15.418 15.254 26.612 1.0 98.69 338 B 1 -ATOM 2506 O O . SER B ? 338 ? -14.438 15.995 26.666 1.0 98.32 338 B 1 -ATOM 2507 C CB . SER B ? 338 ? -17.036 16.231 28.282 1.0 98.18 338 B 1 -ATOM 2508 O OG . SER B ? 338 ? -16.674 15.200 29.176 1.0 93.63 338 B 1 -ATOM 2509 N N . LYS B ? 339 ? -15.324 13.949 26.338 1.0 98.73 339 B 1 -ATOM 2510 C CA . LYS B ? 339 ? -14.073 13.228 26.062 1.0 98.81 339 B 1 -ATOM 2511 C C . LYS B ? 339 ? -13.897 12.843 24.595 1.0 98.88 339 B 1 -ATOM 2512 O O . LYS B ? 339 ? -12.826 12.373 24.219 1.0 98.7 339 B 1 -ATOM 2513 C CB . LYS B ? 339 ? -14.012 11.973 26.935 1.0 98.61 339 B 1 -ATOM 2514 C CG . LYS B ? 339 ? -14.022 12.292 28.437 1.0 97.66 339 B 1 -ATOM 2515 C CD . LYS B ? 339 ? -13.841 10.989 29.215 1.0 95.55 339 B 1 -ATOM 2516 C CE . LYS B ? 339 ? -13.798 11.260 30.714 1.0 89.48 339 B 1 -ATOM 2517 N NZ . LYS B ? 339 ? -13.475 10.010 31.435 1.0 81.25 339 B 1 -ATOM 2518 N N . VAL B ? 340 ? -14.929 13.001 23.772 1.0 98.87 340 B 1 -ATOM 2519 C CA . VAL B ? 340 ? -14.922 12.607 22.358 1.0 98.9 340 B 1 -ATOM 2520 C C . VAL B ? 340 ? -14.587 13.810 21.488 1.0 98.91 340 B 1 -ATOM 2521 O O . VAL B ? 340 ? -15.279 14.820 21.556 1.0 98.78 340 B 1 -ATOM 2522 C CB . VAL B ? 340 ? -16.266 11.981 21.941 1.0 98.83 340 B 1 -ATOM 2523 C CG1 . VAL B ? 340 ? -16.256 11.556 20.469 1.0 98.39 340 B 1 -ATOM 2524 C CG2 . VAL B ? 340 ? -16.589 10.738 22.780 1.0 98.33 340 B 1 -ATOM 2525 N N . ASN B ? 341 ? -13.569 13.680 20.650 1.0 98.89 341 B 1 -ATOM 2526 C CA . ASN B ? 341 ? -13.143 14.695 19.673 1.0 98.9 341 B 1 -ATOM 2527 C C . ASN B ? 341 ? -13.029 16.099 20.290 1.0 98.88 341 B 1 -ATOM 2528 O O . ASN B ? 341 ? -13.586 17.071 19.778 1.0 98.57 341 B 1 -ATOM 2529 C CB . ASN B ? 341 ? -14.061 14.656 18.435 1.0 98.85 341 B 1 -ATOM 2530 C CG . ASN B ? 341 ? -14.094 13.316 17.720 1.0 98.86 341 B 1 -ATOM 2531 O OD1 . ASN B ? 341 ? -13.348 12.393 17.985 1.0 95.37 341 B 1 -ATOM 2532 N ND2 . ASN B ? 341 ? -14.988 13.174 16.771 1.0 94.48 341 B 1 -ATOM 2533 N N . ILE B ? 342 ? -12.311 16.216 21.405 1.0 98.92 342 B 1 -ATOM 2534 C CA . ILE B ? 342 ? -12.268 17.450 22.210 1.0 98.88 342 B 1 -ATOM 2535 C C . ILE B ? 342 ? -11.702 18.669 21.465 1.0 98.9 342 B 1 -ATOM 2536 O O . ILE B ? 342 ? -11.992 19.803 21.833 1.0 98.65 342 B 1 -ATOM 2537 C CB . ILE B ? 342 ? -11.502 17.232 23.530 1.0 98.69 342 B 1 -ATOM 2538 C CG1 . ILE B ? 342 ? -10.027 16.825 23.306 1.0 96.96 342 B 1 -ATOM 2539 C CG2 . ILE B ? 342 ? -12.251 16.203 24.406 1.0 95.57 342 B 1 -ATOM 2540 C CD1 . ILE B ? 342 ? -9.175 16.955 24.575 1.0 94.48 342 B 1 -ATOM 2541 N N . HIS B ? 343 ? -10.940 18.433 20.407 1.0 98.84 343 B 1 -ATOM 2542 C CA . HIS B ? 343 ? -10.358 19.471 19.545 1.0 98.85 343 B 1 -ATOM 2543 C C . HIS B ? 343 ? -11.016 19.536 18.156 1.0 98.84 343 B 1 -ATOM 2544 O O . HIS B ? 343 ? -10.420 20.034 17.198 1.0 98.48 343 B 1 -ATOM 2545 C CB . HIS B ? 343 ? -8.837 19.274 19.479 1.0 98.74 343 B 1 -ATOM 2546 C CG . HIS B ? 343 ? -8.155 19.291 20.821 1.0 98.79 343 B 1 -ATOM 2547 N ND1 . HIS B ? 343 ? -7.147 18.446 21.219 1.0 92.1 343 B 1 -ATOM 2548 C CD2 . HIS B ? 343 ? -8.399 20.126 21.883 1.0 92.8 343 B 1 -ATOM 2549 C CE1 . HIS B ? 343 ? -6.793 18.764 22.471 1.0 94.65 343 B 1 -ATOM 2550 N NE2 . HIS B ? 343 ? -7.538 19.785 22.920 1.0 95.77 343 B 1 -ATOM 2551 N N . GLY B ? 344 ? -12.267 19.066 18.052 1.0 98.78 344 B 1 -ATOM 2552 C CA . GLY B ? 344 ? -12.977 18.927 16.783 1.0 98.77 344 B 1 -ATOM 2553 C C . GLY B ? 344 ? -12.596 17.644 16.049 1.0 98.83 344 B 1 -ATOM 2554 O O . GLY B ? 344 ? -11.898 16.776 16.573 1.0 98.33 344 B 1 -ATOM 2555 N N . GLY B ? 345 ? -13.075 17.514 14.818 1.0 98.87 345 B 1 -ATOM 2556 C CA . GLY B ? 345 ? -12.838 16.343 13.989 1.0 98.88 345 B 1 -ATOM 2557 C C . GLY B ? 345 ? -13.072 16.633 12.511 1.0 98.93 345 B 1 -ATOM 2558 O O . GLY B ? 345 ? -13.115 17.788 12.082 1.0 98.78 345 B 1 -ATOM 2559 N N . ALA B ? 346 ? -13.233 15.583 11.715 1.0 98.93 346 B 1 -ATOM 2560 C CA . ALA B ? 346 ? -13.261 15.685 10.256 1.0 98.94 346 B 1 -ATOM 2561 C C . ALA B ? 346 ? -14.374 16.586 9.691 1.0 98.93 346 B 1 -ATOM 2562 O O . ALA B ? 346 ? -14.192 17.148 8.617 1.0 98.75 346 B 1 -ATOM 2563 C CB . ALA B ? 346 ? -13.345 14.272 9.675 1.0 98.87 346 B 1 -ATOM 2564 N N . VAL B ? 347 ? -15.492 16.775 10.393 1.0 98.94 347 B 1 -ATOM 2565 C CA . VAL B ? 347 ? -16.551 17.719 9.975 1.0 98.94 347 B 1 -ATOM 2566 C C . VAL B ? 347 ? -16.015 19.151 9.883 1.0 98.93 347 B 1 -ATOM 2567 O O . VAL B ? 347 ? -16.345 19.872 8.945 1.0 98.74 347 B 1 -ATOM 2568 C CB . VAL B ? 347 ? -17.763 17.641 10.925 1.0 98.83 347 B 1 -ATOM 2569 C CG1 . VAL B ? 347 ? -18.752 18.803 10.751 1.0 97.61 347 B 1 -ATOM 2570 C CG2 . VAL B ? 347 ? -18.559 16.352 10.677 1.0 97.39 347 B 1 -ATOM 2571 N N . SER B ? 348 ? -15.180 19.571 10.829 1.0 98.92 348 B 1 -ATOM 2572 C CA . SER B ? 348 ? -14.662 20.944 10.919 1.0 98.89 348 B 1 -ATOM 2573 C C . SER B ? 348 ? -13.203 21.099 10.491 1.0 98.84 348 B 1 -ATOM 2574 O O . SER B ? 348 ? -12.807 22.182 10.066 1.0 98.52 348 B 1 -ATOM 2575 C CB . SER B ? 348 ? -14.850 21.478 12.337 1.0 98.79 348 B 1 -ATOM 2576 O OG . SER B ? 348 ? -14.130 20.715 13.284 1.0 98.48 348 B 1 -ATOM 2577 N N . LEU B ? 349 ? -12.403 20.043 10.579 1.0 98.91 349 B 1 -ATOM 2578 C CA . LEU B ? 349 ? -10.996 20.040 10.154 1.0 98.88 349 B 1 -ATOM 2579 C C . LEU B ? 349 ? -10.821 19.593 8.696 1.0 98.86 349 B 1 -ATOM 2580 O O . LEU B ? 349 ? -9.857 19.984 8.044 1.0 98.52 349 B 1 -ATOM 2581 C CB . LEU B ? 349 ? -10.174 19.146 11.099 1.0 98.8 349 B 1 -ATOM 2582 C CG . LEU B ? 349 ? -10.092 19.635 12.557 1.0 98.54 349 B 1 -ATOM 2583 C CD1 . LEU B ? 349 ? -9.388 18.579 13.414 1.0 98.0 349 B 1 -ATOM 2584 C CD2 . LEU B ? 349 ? -9.306 20.945 12.677 1.0 97.81 349 B 1 -ATOM 2585 N N . GLY B ? 350 ? -11.747 18.779 8.185 1.0 98.88 350 B 1 -ATOM 2586 C CA . GLY B ? 350 ? -11.660 18.138 6.877 1.0 98.89 350 B 1 -ATOM 2587 C C . GLY B ? 350 ? -11.238 16.670 6.949 1.0 98.93 350 B 1 -ATOM 2588 O O . GLY B ? 350 ? -10.781 16.164 7.980 1.0 98.81 350 B 1 -ATOM 2589 N N . HIS B ? 351 ? -11.404 15.969 5.822 1.0 98.89 351 B 1 -ATOM 2590 C CA . HIS B ? 351 ? -11.176 14.530 5.721 1.0 98.92 351 B 1 -ATOM 2591 C C . HIS B ? 351 ? -10.463 14.121 4.418 1.0 98.94 351 B 1 -ATOM 2592 O O . HIS B ? 351 ? -11.103 13.616 3.489 1.0 98.83 351 B 1 -ATOM 2593 C CB . HIS B ? 351 ? -12.513 13.804 5.935 1.0 98.82 351 B 1 -ATOM 2594 C CG . HIS B ? 351 ? -12.400 12.300 5.965 1.0 98.82 351 B 1 -ATOM 2595 N ND1 . HIS B ? 351 ? -11.281 11.560 6.293 1.0 96.65 351 B 1 -ATOM 2596 C CD2 . HIS B ? 351 ? -13.404 11.402 5.705 1.0 96.47 351 B 1 -ATOM 2597 C CE1 . HIS B ? 351 ? -11.605 10.257 6.218 1.0 97.34 351 B 1 -ATOM 2598 N NE2 . HIS B ? 351 ? -12.885 10.125 5.874 1.0 97.57 351 B 1 -ATOM 2599 N N . PRO B ? 352 ? -9.141 14.280 4.324 1.0 98.94 352 B 1 -ATOM 2600 C CA . PRO B ? 352 ? -8.346 13.576 3.324 1.0 98.94 352 B 1 -ATOM 2601 C C . PRO B ? 352 ? -8.414 12.080 3.666 1.0 98.94 352 B 1 -ATOM 2602 O O . PRO B ? 352 ? -7.895 11.650 4.696 1.0 98.84 352 B 1 -ATOM 2603 C CB . PRO B ? 352 ? -6.926 14.149 3.412 1.0 98.91 352 B 1 -ATOM 2604 C CG . PRO B ? 352 ? -7.045 15.364 4.346 1.0 98.56 352 B 1 -ATOM 2605 C CD . PRO B ? 352 ? -8.280 15.056 5.189 1.0 98.91 352 B 1 -ATOM 2606 N N . ILE B ? 353 ? -9.114 11.282 2.856 1.0 98.94 353 B 1 -ATOM 2607 C CA . ILE B ? 353 ? -9.637 9.972 3.280 1.0 98.92 353 B 1 -ATOM 2608 C C . ILE B ? 353 ? -8.553 8.965 3.694 1.0 98.93 353 B 1 -ATOM 2609 O O . ILE B ? 353 ? -8.705 8.286 4.707 1.0 98.79 353 B 1 -ATOM 2610 C CB . ILE B ? 353 ? -10.636 9.399 2.239 1.0 98.79 353 B 1 -ATOM 2611 C CG1 . ILE B ? 353 ? -10.053 9.360 0.810 1.0 98.29 353 B 1 -ATOM 2612 C CG2 . ILE B ? 353 ? -11.949 10.215 2.288 1.0 98.08 353 B 1 -ATOM 2613 C CD1 . ILE B ? 353 ? -11.001 8.757 -0.246 1.0 97.72 353 B 1 -ATOM 2614 N N . GLY B ? 354 ? -7.425 8.915 2.990 1.0 98.92 354 B 1 -ATOM 2615 C CA . GLY B ? 354 ? -6.285 8.073 3.372 1.0 98.92 354 B 1 -ATOM 2616 C C . GLY B ? 354 ? -5.520 8.581 4.602 1.0 98.94 354 B 1 -ATOM 2617 O O . GLY B ? 354 ? -4.958 7.783 5.351 1.0 98.83 354 B 1 -ATOM 2618 N N . MET B ? 355 ? -5.537 9.889 4.853 1.0 98.93 355 B 1 -ATOM 2619 C CA . MET B ? 355 ? -4.812 10.534 5.960 1.0 98.94 355 B 1 -ATOM 2620 C C . MET B ? 355 ? -5.470 10.312 7.324 1.0 98.95 355 B 1 -ATOM 2621 O O . MET B ? 355 ? -4.786 10.076 8.318 1.0 98.85 355 B 1 -ATOM 2622 C CB . MET B ? 355 ? -4.708 12.043 5.674 1.0 98.8 355 B 1 -ATOM 2623 C CG . MET B ? 355 ? -4.134 12.891 6.821 1.0 98.53 355 B 1 -ATOM 2624 S SD . MET B ? 355 ? -4.313 14.669 6.539 1.0 98.21 355 B 1 -ATOM 2625 C CE . MET B ? 355 ? -3.598 15.362 8.039 1.0 95.88 355 B 1 -ATOM 2626 N N . SER B ? 356 ? -6.791 10.445 7.399 1.0 98.95 356 B 1 -ATOM 2627 C CA . SER B ? 356 ? -7.510 10.683 8.659 1.0 98.95 356 B 1 -ATOM 2628 C C . SER B ? 356 ? -7.267 9.628 9.743 1.0 98.95 356 B 1 -ATOM 2629 O O . SER B ? 356 ? -7.124 9.982 10.908 1.0 98.9 356 B 1 -ATOM 2630 C CB . SER B ? 356 ? -9.005 10.815 8.386 1.0 98.9 356 B 1 -ATOM 2631 O OG . SER B ? 356 ? -9.238 12.011 7.659 1.0 98.51 356 B 1 -ATOM 2632 N N . GLY B ? 357 ? -7.156 8.355 9.375 1.0 98.95 357 B 1 -ATOM 2633 C CA . GLY B ? 357 ? -6.864 7.276 10.323 1.0 98.94 357 B 1 -ATOM 2634 C C . GLY B ? 357 ? -5.514 7.418 11.034 1.0 98.96 357 B 1 -ATOM 2635 O O . GLY B ? 357 ? -5.393 7.037 12.195 1.0 98.88 357 B 1 -ATOM 2636 N N . ALA B ? 358 ? -4.516 8.009 10.377 1.0 98.96 358 B 1 -ATOM 2637 C CA . ALA B ? 358 ? -3.232 8.320 11.006 1.0 98.97 358 B 1 -ATOM 2638 C C . ALA B ? 358 ? -3.276 9.650 11.774 1.0 98.97 358 B 1 -ATOM 2639 O O . ALA B ? 358 ? -2.691 9.747 12.849 1.0 98.93 358 B 1 -ATOM 2640 C CB . ALA B ? 358 ? -2.140 8.321 9.935 1.0 98.94 358 B 1 -ATOM 2641 N N . ARG B ? 359 ? -4.007 10.660 11.265 1.0 98.98 359 B 1 -ATOM 2642 C CA . ARG B ? 359 ? -4.168 11.967 11.917 1.0 98.97 359 B 1 -ATOM 2643 C C . ARG B ? 359 ? -4.695 11.834 13.346 1.0 98.97 359 B 1 -ATOM 2644 O O . ARG B ? 359 ? -4.113 12.401 14.258 1.0 98.94 359 B 1 -ATOM 2645 C CB . ARG B ? 359 ? -5.101 12.863 11.084 1.0 98.92 359 B 1 -ATOM 2646 C CG . ARG B ? 359 ? -5.206 14.279 11.680 1.0 98.47 359 B 1 -ATOM 2647 C CD . ARG B ? 359 ? -6.272 15.144 10.984 1.0 97.43 359 B 1 -ATOM 2648 N NE . ARG B ? 359 ? -7.646 14.661 11.173 1.0 95.45 359 B 1 -ATOM 2649 C CZ . ARG B ? 359 ? -8.388 14.759 12.273 1.0 96.04 359 B 1 -ATOM 2650 N NH1 . ARG B ? 359 ? -7.962 15.318 13.368 1.0 90.64 359 B 1 -ATOM 2651 N NH2 . ARG B ? 359 ? -9.602 14.298 12.277 1.0 92.45 359 B 1 -ATOM 2652 N N . ILE B ? 360 ? -5.769 11.066 13.528 1.0 98.97 360 B 1 -ATOM 2653 C CA . ILE B ? 360 ? -6.411 10.929 14.845 1.0 98.97 360 B 1 -ATOM 2654 C C . ILE B ? 360 ? -5.526 10.177 15.852 1.0 98.97 360 B 1 -ATOM 2655 O O . ILE B ? 360 ? -5.508 10.524 17.025 1.0 98.92 360 B 1 -ATOM 2656 C CB . ILE B ? 360 ? -7.821 10.303 14.722 1.0 98.93 360 B 1 -ATOM 2657 C CG1 . ILE B ? 360 ? -7.788 8.860 14.181 1.0 98.63 360 B 1 -ATOM 2658 C CG2 . ILE B ? 360 ? -8.737 11.213 13.875 1.0 98.38 360 B 1 -ATOM 2659 C CD1 . ILE B ? 360 ? -9.164 8.177 14.116 1.0 98.31 360 B 1 -ATOM 2660 N N . VAL B ? 361 ? -4.738 9.199 15.401 1.0 98.97 361 B 1 -ATOM 2661 C CA . VAL B ? 361 ? -3.763 8.507 16.265 1.0 98.97 361 B 1 -ATOM 2662 C C . VAL B ? 361 ? -2.622 9.453 16.649 1.0 98.96 361 B 1 -ATOM 2663 O O . VAL B ? 361 ? -2.291 9.562 17.824 1.0 98.9 361 B 1 -ATOM 2664 C CB . VAL B ? 361 ? -3.224 7.225 15.597 1.0 98.93 361 B 1 -ATOM 2665 C CG1 . VAL B ? 361 ? -2.146 6.540 16.448 1.0 98.59 361 B 1 -ATOM 2666 C CG2 . VAL B ? 361 ? -4.350 6.202 15.383 1.0 98.56 361 B 1 -ATOM 2667 N N . GLY B ? 362 ? -2.067 10.176 15.684 1.0 98.95 362 B 1 -ATOM 2668 C CA . GLY B ? 362 ? -1.020 11.173 15.935 1.0 98.93 362 B 1 -ATOM 2669 C C . GLY B ? 362 ? -1.478 12.284 16.886 1.0 98.92 362 B 1 -ATOM 2670 O O . GLY B ? 362 ? -0.725 12.691 17.770 1.0 98.75 362 B 1 -ATOM 2671 N N . HIS B ? 363 ? -2.737 12.707 16.765 1.0 98.92 363 B 1 -ATOM 2672 C CA . HIS B ? 363 ? -3.328 13.698 17.663 1.0 98.9 363 B 1 -ATOM 2673 C C . HIS B ? 363 ? -3.390 13.195 19.115 1.0 98.88 363 B 1 -ATOM 2674 O O . HIS B ? 363 ? -2.968 13.902 20.031 1.0 98.71 363 B 1 -ATOM 2675 C CB . HIS B ? 363 ? -4.713 14.100 17.150 1.0 98.84 363 B 1 -ATOM 2676 C CG . HIS B ? 363 ? -5.257 15.273 17.913 1.0 98.74 363 B 1 -ATOM 2677 N ND1 . HIS B ? 363 ? -4.654 16.516 17.983 1.0 95.83 363 B 1 -ATOM 2678 C CD2 . HIS B ? 363 ? -6.371 15.305 18.707 1.0 96.4 363 B 1 -ATOM 2679 C CE1 . HIS B ? 363 ? -5.394 17.270 18.802 1.0 97.04 363 B 1 -ATOM 2680 N NE2 . HIS B ? 363 ? -6.445 16.576 19.258 1.0 97.11 363 B 1 -ATOM 2681 N N . LEU B ? 364 ? -3.829 11.947 19.329 1.0 98.93 364 B 1 -ATOM 2682 C CA . LEU B ? 364 ? -3.799 11.328 20.661 1.0 98.92 364 B 1 -ATOM 2683 C C . LEU B ? 364 ? -2.370 11.210 21.213 1.0 98.91 364 B 1 -ATOM 2684 O O . LEU B ? 364 ? -2.143 11.525 22.378 1.0 98.78 364 B 1 -ATOM 2685 C CB . LEU B ? 364 ? -4.469 9.946 20.624 1.0 98.89 364 B 1 -ATOM 2686 C CG . LEU B ? 364 ? -5.999 9.969 20.467 1.0 98.63 364 B 1 -ATOM 2687 C CD1 . LEU B ? 364 ? -6.496 8.528 20.331 1.0 98.36 364 B 1 -ATOM 2688 C CD2 . LEU B ? 364 ? -6.705 10.604 21.664 1.0 98.31 364 B 1 -ATOM 2689 N N . VAL B ? 365 ? -1.389 10.821 20.386 1.0 98.92 365 B 1 -ATOM 2690 C CA . VAL B ? 365 ? 0.032 10.729 20.787 1.0 98.88 365 B 1 -ATOM 2691 C C . VAL B ? 365 ? 0.553 12.056 21.359 1.0 98.81 365 B 1 -ATOM 2692 O O . VAL B ? 365 ? 1.350 12.052 22.303 1.0 98.43 365 B 1 -ATOM 2693 C CB . VAL B ? 365 ? 0.902 10.265 19.596 1.0 98.76 365 B 1 -ATOM 2694 C CG1 . VAL B ? 365 ? 2.409 10.420 19.834 1.0 98.03 365 B 1 -ATOM 2695 C CG2 . VAL B ? 365 ? 0.658 8.780 19.287 1.0 98.16 365 B 1 -ATOM 2696 N N . HIS B ? 366 ? 0.091 13.199 20.838 1.0 98.77 366 B 1 -ATOM 2697 C CA . HIS B ? 366 ? 0.499 14.526 21.311 1.0 98.63 366 B 1 -ATOM 2698 C C . HIS B ? 366 ? -0.385 15.091 22.431 1.0 98.47 366 B 1 -ATOM 2699 O O . HIS B ? 366 ? 0.115 15.825 23.290 1.0 97.72 366 B 1 -ATOM 2700 C CB . HIS B ? 366 ? 0.574 15.482 20.118 1.0 98.39 366 B 1 -ATOM 2701 C CG . HIS B ? 366 ? 1.796 15.238 19.275 1.0 98.37 366 B 1 -ATOM 2702 N ND1 . HIS B ? 366 ? 3.111 15.333 19.713 1.0 92.74 366 B 1 -ATOM 2703 C CD2 . HIS B ? 366 ? 1.825 14.871 17.951 1.0 92.79 366 B 1 -ATOM 2704 C CE1 . HIS B ? 366 ? 3.902 15.039 18.674 1.0 95.02 366 B 1 -ATOM 2705 N NE2 . HIS B ? 366 ? 3.162 14.754 17.588 1.0 95.56 366 B 1 -ATOM 2706 N N . THR B ? 367 ? -1.673 14.742 22.437 1.0 98.71 367 B 1 -ATOM 2707 C CA . THR B ? 367 ? -2.688 15.371 23.302 1.0 98.59 367 B 1 -ATOM 2708 C C . THR B ? 367 ? -2.834 14.701 24.668 1.0 98.64 367 B 1 -ATOM 2709 O O . THR B ? 367 ? -3.035 15.391 25.672 1.0 97.94 367 B 1 -ATOM 2710 C CB . THR B ? 367 ? -4.041 15.394 22.574 1.0 97.7 367 B 1 -ATOM 2711 O OG1 . THR B ? 367 ? -3.893 16.151 21.394 1.0 86.88 367 B 1 -ATOM 2712 C CG2 . THR B ? 367 ? -5.142 16.068 23.391 1.0 84.79 367 B 1 -ATOM 2713 N N . LEU B ? 368 ? -2.725 13.371 24.732 1.0 98.73 368 B 1 -ATOM 2714 C CA . LEU B ? 368 ? -2.817 12.640 25.995 1.0 98.75 368 B 1 -ATOM 2715 C C . LEU B ? 368 ? -1.749 13.122 26.990 1.0 98.67 368 B 1 -ATOM 2716 O O . LEU B ? 368 ? -0.615 13.445 26.622 1.0 98.39 368 B 1 -ATOM 2717 C CB . LEU B ? 368 ? -2.678 11.129 25.746 1.0 98.74 368 B 1 -ATOM 2718 C CG . LEU B ? 368 ? -3.872 10.468 25.036 1.0 98.5 368 B 1 -ATOM 2719 C CD1 . LEU B ? 368 ? -3.465 9.063 24.586 1.0 98.25 368 B 1 -ATOM 2720 C CD2 . LEU B ? 368 ? -5.091 10.346 25.944 1.0 98.23 368 B 1 -ATOM 2721 N N . LYS B ? 369 ? -2.102 13.119 28.280 1.0 98.71 369 B 1 -ATOM 2722 C CA . LYS B ? 369 ? -1.162 13.349 29.381 1.0 98.66 369 B 1 -ATOM 2723 C C . LYS B ? 369 ? -0.530 12.020 29.815 1.0 98.77 369 B 1 -ATOM 2724 O O . LYS B ? 369 ? -1.157 10.975 29.631 1.0 98.46 369 B 1 -ATOM 2725 C CB . LYS B ? 369 ? -1.873 14.043 30.547 1.0 98.27 369 B 1 -ATOM 2726 C CG . LYS B ? 369 ? -2.396 15.433 30.154 1.0 96.01 369 B 1 -ATOM 2727 C CD . LYS B ? 369 ? -3.111 16.084 31.338 1.0 89.83 369 B 1 -ATOM 2728 C CE . LYS B ? 369 ? -3.695 17.428 30.896 1.0 82.62 369 B 1 -ATOM 2729 N NZ . LYS B ? 369 ? -4.512 18.043 31.972 1.0 70.97 369 B 1 -ATOM 2730 N N . PRO B ? 370 ? 0.668 12.029 30.420 1.0 98.53 370 B 1 -ATOM 2731 C CA . PRO B ? 370 ? 1.311 10.811 30.912 1.0 98.53 370 B 1 -ATOM 2732 C C . PRO B ? 370 ? 0.368 9.946 31.760 1.0 98.57 370 B 1 -ATOM 2733 O O . PRO B ? 370 ? -0.312 10.459 32.647 1.0 97.94 370 B 1 -ATOM 2734 C CB . PRO B ? 370 ? 2.523 11.292 31.712 1.0 98.2 370 B 1 -ATOM 2735 C CG . PRO B ? 370 ? 2.898 12.602 31.022 1.0 97.16 370 B 1 -ATOM 2736 C CD . PRO B ? 370 ? 1.539 13.185 30.646 1.0 98.29 370 B 1 -ATOM 2737 N N . GLY B ? 371 ? 0.319 8.644 31.462 1.0 98.23 371 B 1 -ATOM 2738 C CA . GLY B ? 371 ? -0.560 7.663 32.109 1.0 98.14 371 B 1 -ATOM 2739 C C . GLY B ? 371 ? -1.991 7.602 31.559 1.0 98.46 371 B 1 -ATOM 2740 O O . GLY B ? 371 ? -2.696 6.635 31.846 1.0 97.51 371 B 1 -ATOM 2741 N N . GLN B ? 372 ? -2.426 8.582 30.764 1.0 98.69 372 B 1 -ATOM 2742 C CA . GLN B ? 372 ? -3.748 8.547 30.134 1.0 98.76 372 B 1 -ATOM 2743 C C . GLN B ? 372 ? -3.799 7.560 28.965 1.0 98.83 372 B 1 -ATOM 2744 O O . GLN B ? 372 ? -2.814 7.351 28.253 1.0 98.67 372 B 1 -ATOM 2745 C CB . GLN B ? 372 ? -4.185 9.942 29.661 1.0 98.61 372 B 1 -ATOM 2746 C CG . GLN B ? 372 ? -4.454 10.898 30.829 1.0 98.07 372 B 1 -ATOM 2747 C CD . GLN B ? 372 ? -5.130 12.187 30.361 1.0 98.01 372 B 1 -ATOM 2748 O OE1 . GLN B ? 372 ? -4.743 12.832 29.395 1.0 94.64 372 B 1 -ATOM 2749 N NE2 . GLN B ? 372 ? -6.178 12.608 31.030 1.0 94.22 372 B 1 -ATOM 2750 N N . LYS B ? 373 ? -4.994 7.001 28.728 1.0 98.88 373 B 1 -ATOM 2751 C CA . LYS B ? 373 ? -5.291 6.122 27.598 1.0 98.92 373 B 1 -ATOM 2752 C C . LYS B ? 373 ? -6.196 6.821 26.593 1.0 98.94 373 B 1 -ATOM 2753 O O . LYS B ? 373 ? -7.154 7.495 26.971 1.0 98.84 373 B 1 -ATOM 2754 C CB . LYS B ? 373 ? -5.907 4.811 28.094 1.0 98.79 373 B 1 -ATOM 2755 C CG . LYS B ? 373 ? -4.980 4.063 29.068 1.0 97.88 373 B 1 -ATOM 2756 C CD . LYS B ? 373 ? -5.624 2.769 29.550 1.0 96.25 373 B 1 -ATOM 2757 C CE . LYS B ? 373 ? -4.810 2.133 30.684 1.0 91.69 373 B 1 -ATOM 2758 N NZ . LYS B ? 373 ? -4.986 2.868 31.961 1.0 86.32 373 B 1 -ATOM 2759 N N . GLY B ? 374 ? -5.911 6.641 25.319 1.0 98.94 374 B 1 -ATOM 2760 C CA . GLY B ? 374 ? -6.719 7.161 24.223 1.0 98.95 374 B 1 -ATOM 2761 C C . GLY B ? 374 ? -7.188 6.049 23.298 1.0 98.96 374 B 1 -ATOM 2762 O O . GLY B ? 374 ? -6.438 5.116 23.016 1.0 98.88 374 B 1 -ATOM 2763 N N . CYS B ? 375 ? -8.411 6.155 22.809 1.0 98.95 375 B 1 -ATOM 2764 C CA . CYS B ? 375 ? -8.946 5.253 21.790 1.0 98.96 375 B 1 -ATOM 2765 C C . CYS B ? 375 ? -9.265 6.029 20.512 1.0 98.96 375 B 1 -ATOM 2766 O O . CYS B ? 375 ? -10.024 6.998 20.541 1.0 98.92 375 B 1 -ATOM 2767 C CB . CYS B ? 375 ? -10.169 4.515 22.351 1.0 98.93 375 B 1 -ATOM 2768 S SG . CYS B ? 375 ? -10.815 3.325 21.133 1.0 98.76 375 B 1 -ATOM 2769 N N . ALA B ? 376 ? -8.714 5.587 19.395 1.0 98.97 376 B 1 -ATOM 2770 C CA . ALA B ? 376 ? -9.029 6.097 18.070 1.0 98.97 376 B 1 -ATOM 2771 C C . ALA B ? 376 ? -9.868 5.075 17.299 1.0 98.97 376 B 1 -ATOM 2772 O O . ALA B ? 376 ? -9.541 3.887 17.287 1.0 98.91 376 B 1 -ATOM 2773 C CB . ALA B ? 376 ? -7.729 6.446 17.339 1.0 98.91 376 B 1 -ATOM 2774 N N . ALA B ? 377 ? -10.930 5.518 16.631 1.0 98.96 377 B 1 -ATOM 2775 C CA . ALA B ? 377 ? -11.740 4.680 15.755 1.0 98.97 377 B 1 -ATOM 2776 C C . ALA B ? 377 ? -12.136 5.436 14.481 1.0 98.97 377 B 1 -ATOM 2777 O O . ALA B ? 377 ? -12.430 6.628 14.506 1.0 98.91 377 B 1 -ATOM 2778 C CB . ALA B ? 377 ? -12.965 4.168 16.522 1.0 98.93 377 B 1 -ATOM 2779 N N . ILE B ? 378 ? -12.157 4.730 13.352 1.0 98.95 378 B 1 -ATOM 2780 C CA . ILE B ? 378 ? -12.477 5.319 12.052 1.0 98.96 378 B 1 -ATOM 2781 C C . ILE B ? 378 ? -13.263 4.326 11.197 1.0 98.95 378 B 1 -ATOM 2782 O O . ILE B ? 378 ? -12.817 3.205 10.971 1.0 98.82 378 B 1 -ATOM 2783 C CB . ILE B ? 378 ? -11.196 5.851 11.367 1.0 98.92 378 B 1 -ATOM 2784 C CG1 . ILE B ? 378 ? -11.532 6.533 10.024 1.0 98.77 378 B 1 -ATOM 2785 C CG2 . ILE B ? 378 ? -10.111 4.769 11.180 1.0 98.74 378 B 1 -ATOM 2786 C CD1 . ILE B ? 378 ? -10.403 7.415 9.480 1.0 98.34 378 B 1 -ATOM 2787 N N . CYS B ? 379 ? -14.434 4.741 10.708 1.0 98.9 379 B 1 -ATOM 2788 C CA . CYS B ? 379 ? -15.189 3.964 9.731 1.0 98.86 379 B 1 -ATOM 2789 C C . CYS B ? 379 ? -14.516 4.008 8.354 1.0 98.87 379 B 1 -ATOM 2790 O O . CYS B ? 379 ? -13.765 4.934 8.034 1.0 98.7 379 B 1 -ATOM 2791 C CB . CYS B ? 379 ? -16.646 4.451 9.679 1.0 98.52 379 B 1 -ATOM 2792 S SG . CYS B ? 379 ? -16.756 6.190 9.177 1.0 97.85 379 B 1 -ATOM 2793 N N . ASN B ? 380 ? -14.821 3.022 7.515 1.0 98.77 380 B 1 -ATOM 2794 C CA . ASN B ? 380 ? -14.377 3.009 6.127 1.0 98.73 380 B 1 -ATOM 2795 C C . ASN B ? 380 ? -15.453 2.468 5.188 1.0 98.72 380 B 1 -ATOM 2796 O O . ASN B ? 380 ? -16.245 1.609 5.579 1.0 98.18 380 B 1 -ATOM 2797 C CB . ASN B ? 380 ? -13.040 2.261 6.017 1.0 98.36 380 B 1 -ATOM 2798 C CG . ASN B ? 380 ? -13.079 0.791 6.406 1.0 98.43 380 B 1 -ATOM 2799 O OD1 . ASN B ? 380 ? -12.578 0.391 7.446 1.0 93.48 380 B 1 -ATOM 2800 N ND2 . ASN B ? 380 ? -13.578 -0.069 5.555 1.0 92.4 380 B 1 -ATOM 2801 N N . GLY B ? 381 ? -15.467 2.937 3.938 1.0 98.36 381 B 1 -ATOM 2802 C CA . GLY B ? 381 ? -16.345 2.405 2.902 1.0 98.1 381 B 1 -ATOM 2803 C C . GLY B ? 381 ? -16.234 0.876 2.777 1.0 98.16 381 B 1 -ATOM 2804 O O . GLY B ? 381 ? -15.228 0.273 3.159 1.0 97.33 381 B 1 -ATOM 2805 N N . GLY B ? 382 ? -17.290 0.235 2.288 1.0 97.95 382 B 1 -ATOM 2806 C CA . GLY B ? 382 ? -17.391 -1.228 2.307 1.0 98.03 382 B 1 -ATOM 2807 C C . GLY B ? 382 ? -17.782 -1.811 3.674 1.0 98.38 382 B 1 -ATOM 2808 O O . GLY B ? 382 ? -17.681 -3.021 3.866 1.0 97.38 382 B 1 -ATOM 2809 N N . GLY B ? 383 ? -18.227 -0.978 4.618 1.0 98.44 383 B 1 -ATOM 2810 C CA . GLY B ? 383 ? -18.818 -1.414 5.891 1.0 98.54 383 B 1 -ATOM 2811 C C . GLY B ? 383 ? -17.825 -1.698 7.016 1.0 98.65 383 B 1 -ATOM 2812 O O . GLY B ? 383 ? -18.185 -2.356 7.992 1.0 97.92 383 B 1 -ATOM 2813 N N . GLY B ? 384 ? -16.586 -1.229 6.919 1.0 98.62 384 B 1 -ATOM 2814 C CA . GLY B ? 384 ? -15.549 -1.505 7.906 1.0 98.67 384 B 1 -ATOM 2815 C C . GLY B ? 384 ? -15.269 -0.370 8.894 1.0 98.81 384 B 1 -ATOM 2816 O O . GLY B ? 384 ? -15.726 0.761 8.744 1.0 98.61 384 B 1 -ATOM 2817 N N . ALA B ? 385 ? -14.450 -0.689 9.894 1.0 98.86 385 B 1 -ATOM 2818 C CA . ALA B ? 385 ? -13.791 0.285 10.752 1.0 98.9 385 B 1 -ATOM 2819 C C . ALA B ? 385 ? -12.433 -0.237 11.233 1.0 98.9 385 B 1 -ATOM 2820 O O . ALA B ? 385 ? -12.230 -1.443 11.373 1.0 98.78 385 B 1 -ATOM 2821 C CB . ALA B ? 385 ? -14.690 0.635 11.940 1.0 98.8 385 B 1 -ATOM 2822 N N . GLY B ? 386 ? -11.514 0.683 11.517 1.0 98.91 386 B 1 -ATOM 2823 C CA . GLY B ? 386 ? -10.295 0.425 12.277 1.0 98.92 386 B 1 -ATOM 2824 C C . GLY B ? 386 ? -10.394 1.021 13.679 1.0 98.95 386 B 1 -ATOM 2825 O O . GLY B ? 386 ? -11.069 2.035 13.880 1.0 98.89 386 B 1 -ATOM 2826 N N . GLY B ? 387 ? -9.708 0.412 14.637 1.0 98.94 387 B 1 -ATOM 2827 C CA . GLY B ? 387 ? -9.621 0.899 16.009 1.0 98.93 387 B 1 -ATOM 2828 C C . GLY B ? 387 ? -8.238 0.679 16.612 1.0 98.93 387 B 1 -ATOM 2829 O O . GLY B ? 387 ? -7.569 -0.310 16.318 1.0 98.76 387 B 1 -ATOM 2830 N N . MET B ? 388 ? -7.813 1.612 17.469 1.0 98.9 388 B 1 -ATOM 2831 C CA . MET B ? 388 ? -6.560 1.529 18.221 1.0 98.87 388 B 1 -ATOM 2832 C C . MET B ? 388 ? -6.735 2.079 19.628 1.0 98.94 388 B 1 -ATOM 2833 O O . MET B ? 388 ? -7.469 3.037 19.837 1.0 98.81 388 B 1 -ATOM 2834 C CB . MET B ? 388 ? -5.440 2.305 17.510 1.0 97.89 388 B 1 -ATOM 2835 C CG . MET B ? 388 ? -4.870 1.513 16.344 1.0 88.54 388 B 1 -ATOM 2836 S SD . MET B ? 388 ? -3.469 2.291 15.516 1.0 93.81 388 B 1 -ATOM 2837 C CE . MET B ? 388 ? -2.995 0.894 14.486 1.0 89.99 388 B 1 -ATOM 2838 N N . ILE B ? 389 ? -6.014 1.496 20.581 1.0 98.88 389 B 1 -ATOM 2839 C CA . ILE B ? 389 ? -5.866 2.043 21.931 1.0 98.89 389 B 1 -ATOM 2840 C C . ILE B ? 389 ? -4.381 2.241 22.201 1.0 98.87 389 B 1 -ATOM 2841 O O . ILE B ? 389 ? -3.574 1.341 21.978 1.0 98.77 389 B 1 -ATOM 2842 C CB . ILE B ? 389 ? -6.551 1.167 23.002 1.0 98.87 389 B 1 -ATOM 2843 C CG1 . ILE B ? 389 ? -8.048 0.974 22.668 1.0 98.48 389 B 1 -ATOM 2844 C CG2 . ILE B ? 389 ? -6.393 1.811 24.397 1.0 98.66 389 B 1 -ATOM 2845 C CD1 . ILE B ? 389 ? -8.789 0.038 23.622 1.0 97.84 389 B 1 -ATOM 2846 N N . ILE B ? 390 ? -4.033 3.422 22.690 1.0 98.9 390 B 1 -ATOM 2847 C CA . ILE B ? 390 ? -2.671 3.788 23.081 1.0 98.91 390 B 1 -ATOM 2848 C C . ILE B ? 390 ? -2.652 4.323 24.511 1.0 98.91 390 B 1 -ATOM 2849 O O . ILE B ? 390 ? -3.656 4.815 25.022 1.0 98.83 390 B 1 -ATOM 2850 C CB . ILE B ? 390 ? -2.032 4.782 22.081 1.0 98.83 390 B 1 -ATOM 2851 C CG1 . ILE B ? 390 ? -2.718 6.164 22.101 1.0 98.17 390 B 1 -ATOM 2852 C CG2 . ILE B ? 390 ? -2.027 4.182 20.663 1.0 97.89 390 B 1 -ATOM 2853 C CD1 . ILE B ? 390 ? -1.985 7.225 21.273 1.0 97.64 390 B 1 -ATOM 2854 N N . GLU B ? 391 ? -1.498 4.256 25.157 1.0 98.87 391 B 1 -ATOM 2855 C CA . GLU B ? 391 ? -1.241 4.850 26.472 1.0 98.85 391 B 1 -ATOM 2856 C C . GLU B ? 391 ? -0.090 5.845 26.362 1.0 98.86 391 B 1 -ATOM 2857 O O . GLU B ? 391 ? 0.974 5.518 25.833 1.0 98.7 391 B 1 -ATOM 2858 C CB . GLU B ? 391 ? -0.941 3.734 27.480 1.0 98.66 391 B 1 -ATOM 2859 C CG . GLU B ? 391 ? -0.611 4.242 28.889 1.0 97.96 391 B 1 -ATOM 2860 C CD . GLU B ? 391 ? -0.349 3.091 29.872 1.0 97.55 391 B 1 -ATOM 2861 O OE1 . GLU B ? 391 ? -0.729 3.228 31.052 1.0 93.81 391 B 1 -ATOM 2862 O OE2 . GLU B ? 391 ? 0.237 2.065 29.454 1.0 94.05 391 B 1 -ATOM 2863 N N . LYS B ? 392 ? -0.298 7.059 26.874 1.0 98.81 392 B 1 -ATOM 2864 C CA . LYS B ? 392 ? 0.733 8.100 26.910 1.0 98.78 392 B 1 -ATOM 2865 C C . LYS B ? 392 ? 1.810 7.737 27.924 1.0 98.75 392 B 1 -ATOM 2866 O O . LYS B ? 392 ? 1.502 7.342 29.046 1.0 98.12 392 B 1 -ATOM 2867 C CB . LYS B ? 392 ? 0.092 9.456 27.227 1.0 98.46 392 B 1 -ATOM 2868 C CG . LYS B ? 392 ? 1.061 10.640 27.119 1.0 96.48 392 B 1 -ATOM 2869 C CD . LYS B ? 392 ? 1.406 10.962 25.666 1.0 94.37 392 B 1 -ATOM 2870 C CE . LYS B ? 392 ? 2.232 12.247 25.578 1.0 92.19 392 B 1 -ATOM 2871 N NZ . LYS B ? 392 ? 2.229 12.793 24.201 1.0 89.79 392 B 1 -ATOM 2872 N N . LEU B ? 393 ? 3.066 7.910 27.529 1.0 97.89 393 B 1 -ATOM 2873 C CA . LEU B ? 393 ? 4.243 7.681 28.361 1.0 97.53 393 B 1 -ATOM 2874 C C . LEU B ? 393 ? 4.796 8.984 28.954 1.0 95.78 393 B 1 -ATOM 2875 O O . LEU B ? 393 ? 4.595 10.063 28.369 1.0 89.72 393 B 1 -ATOM 2876 C CB . LEU B ? 393 ? 5.289 6.898 27.557 1.0 96.59 393 B 1 -ATOM 2877 C CG . LEU B ? 393 ? 4.839 5.484 27.130 1.0 96.66 393 B 1 -ATOM 2878 C CD1 . LEU B ? 393 ? 5.907 4.835 26.257 1.0 94.6 393 B 1 -ATOM 2879 C CD2 . LEU B ? 393 ? 4.596 4.576 28.339 1.0 94.35 393 B 1 -ATOM 2880 O OXT . LEU B ? 393 ? 5.439 8.890 30.038 1.0 91.93 393 B 1 -ATOM 2881 N N . GLY A ? 1 ? -3.189 -18.010 22.096 1.0 34.03 1 A 1 -ATOM 2882 C CA . GLY A ? 1 ? -2.047 -18.148 23.028 1.0 34.48 1 A 1 -ATOM 2883 C C . GLY A ? 1 ? -1.344 -16.817 23.158 1.0 36.73 1 A 1 -ATOM 2884 O O . GLY A ? 1 ? -1.497 -15.976 22.291 1.0 34.54 1 A 1 -ATOM 2885 N N . THR A ? 2 ? -0.593 -16.621 24.250 1.0 41.54 2 A 1 -ATOM 2886 C CA . THR A ? 2 ? 0.079 -15.335 24.530 1.0 41.55 2 A 1 -ATOM 2887 C C . THR A ? 2 ? 1.374 -15.109 23.741 1.0 43.63 2 A 1 -ATOM 2888 O O . THR A ? 2 ? 1.932 -14.017 23.787 1.0 40.57 2 A 1 -ATOM 2889 C CB . THR A ? 2 ? 0.398 -15.225 26.030 1.0 37.29 2 A 1 -ATOM 2890 O OG1 . THR A ? 2 ? 0.980 -16.438 26.482 1.0 34.86 2 A 1 -ATOM 2891 C CG2 . THR A ? 2 ? -0.857 -14.995 26.876 1.0 33.89 2 A 1 -ATOM 2892 N N . GLY A ? 3 ? 1.884 -16.131 23.059 1.0 56.15 3 A 1 -ATOM 2893 C CA . GLY A ? 3 ? 3.089 -16.048 22.236 1.0 58.46 3 A 1 -ATOM 2894 C C . GLY A ? 3 ? 2.765 -16.065 20.746 1.0 63.8 3 A 1 -ATOM 2895 O O . GLY A ? 3 ? 1.715 -16.568 20.343 1.0 59.43 3 A 1 -ATOM 2896 N N . SER A ? 4 ? 3.688 -15.573 19.927 1.0 76.4 4 A 1 -ATOM 2897 C CA . SER A ? 4 ? 3.600 -15.762 18.478 1.0 82.26 4 A 1 -ATOM 2898 C C . SER A ? 4 ? 3.821 -17.216 18.114 1.0 87.63 4 A 1 -ATOM 2899 O O . SER A ? 4 ? 4.668 -17.900 18.693 1.0 83.61 4 A 1 -ATOM 2900 C CB . SER A ? 4 ? 4.628 -14.943 17.705 1.0 72.49 4 A 1 -ATOM 2901 O OG . SER A ? 4 ? 5.930 -15.174 18.206 1.0 63.85 4 A 1 -ATOM 2902 N N . ARG A ? 5 ? 3.144 -17.643 17.071 1.0 89.58 5 A 1 -ATOM 2903 C CA . ARG A ? 5 ? 3.431 -18.919 16.421 1.0 92.16 5 A 1 -ATOM 2904 C C . ARG A ? 5 ? 4.751 -18.834 15.655 1.0 94.13 5 A 1 -ATOM 2905 O O . ARG A ? 5 ? 5.066 -17.785 15.080 1.0 92.93 5 A 1 -ATOM 2906 C CB . ARG A ? 5 ? 2.270 -19.291 15.502 1.0 90.55 5 A 1 -ATOM 2907 C CG . ARG A ? 5 ? 0.992 -19.555 16.306 1.0 88.06 5 A 1 -ATOM 2908 C CD . ARG A ? 5 ? -0.171 -19.831 15.370 1.0 85.23 5 A 1 -ATOM 2909 N NE . ARG A ? 5 ? -1.392 -20.104 16.137 1.0 85.67 5 A 1 -ATOM 2910 C CZ . ARG A ? 5 ? -1.835 -21.284 16.532 1.0 87.0 5 A 1 -ATOM 2911 N NH1 . ARG A ? 5 ? -1.264 -22.402 16.186 1.0 79.23 5 A 1 -ATOM 2912 N NH2 . ARG A ? 5 ? -2.878 -21.344 17.293 1.0 82.13 5 A 1 -ATOM 2913 N N . PRO A ? 6 ? 5.529 -19.930 15.604 1.0 93.57 6 A 1 -ATOM 2914 C CA . PRO A ? 6 ? 6.645 -19.998 14.675 1.0 94.73 6 A 1 -ATOM 2915 C C . PRO A ? 6 ? 6.125 -19.871 13.237 1.0 96.14 6 A 1 -ATOM 2916 O O . PRO A ? 6 ? 4.998 -20.265 12.926 1.0 95.47 6 A 1 -ATOM 2917 C CB . PRO A ? 6 ? 7.317 -21.346 14.941 1.0 92.86 6 A 1 -ATOM 2918 C CG . PRO A ? 6 ? 6.167 -22.216 15.465 1.0 91.36 6 A 1 -ATOM 2919 C CD . PRO A ? 6 ? 5.305 -21.221 16.241 1.0 93.57 6 A 1 -ATOM 2920 N N . ILE A ? 7 ? 6.960 -19.371 12.337 1.0 95.88 7 A 1 -ATOM 2921 C CA . ILE A ? 7 ? 6.599 -19.210 10.919 1.0 96.98 7 A 1 -ATOM 2922 C C . ILE A ? 7 ? 6.100 -20.522 10.285 1.0 97.66 7 A 1 -ATOM 2923 O O . ILE A ? 7 ? 5.215 -20.509 9.434 1.0 97.04 7 A 1 -ATOM 2924 C CB . ILE A ? 7 ? 7.799 -18.617 10.153 1.0 96.11 7 A 1 -ATOM 2925 C CG1 . ILE A ? 7 ? 7.473 -18.236 8.690 1.0 90.85 7 A 1 -ATOM 2926 C CG2 . ILE A ? 7 ? 9.028 -19.562 10.146 1.0 90.21 7 A 1 -ATOM 2927 C CD1 . ILE A ? 7 ? 6.417 -17.161 8.549 1.0 84.49 7 A 1 -ATOM 2928 N N . THR A ? 8 ? 6.611 -21.666 10.762 1.0 95.41 8 A 1 -ATOM 2929 C CA . THR A ? 8 ? 6.250 -23.012 10.287 1.0 95.84 8 A 1 -ATOM 2930 C C . THR A ? 8 ? 4.831 -23.453 10.662 1.0 97.08 8 A 1 -ATOM 2931 O O . THR A ? 8 ? 4.352 -24.446 10.115 1.0 96.26 8 A 1 -ATOM 2932 C CB . THR A ? 8 ? 7.250 -24.047 10.820 1.0 94.26 8 A 1 -ATOM 2933 O OG1 . THR A ? 8 ? 7.394 -23.920 12.221 1.0 91.28 8 A 1 -ATOM 2934 C CG2 . THR A ? 8 ? 8.635 -23.860 10.201 1.0 90.28 8 A 1 -ATOM 2935 N N . ASP A ? 9 ? 4.140 -22.733 11.548 1.0 96.65 9 A 1 -ATOM 2936 C CA . ASP A ? 9 ? 2.719 -22.954 11.838 1.0 97.38 9 A 1 -ATOM 2937 C C . ASP A ? 9 ? 1.800 -22.342 10.773 1.0 98.12 9 A 1 -ATOM 2938 O O . ASP A ? 9 ? 0.623 -22.696 10.705 1.0 97.64 9 A 1 -ATOM 2939 C CB . ASP A ? 9 ? 2.356 -22.386 13.217 1.0 96.14 9 A 1 -ATOM 2940 C CG . ASP A ? 9 ? 2.625 -23.328 14.388 1.0 91.51 9 A 1 -ATOM 2941 O OD1 . ASP A ? 9 ? 3.300 -24.365 14.201 1.0 87.29 9 A 1 -ATOM 2942 O OD2 . ASP A ? 9 ? 2.110 -23.004 15.485 1.0 87.05 9 A 1 -ATOM 2943 N N . VAL A ? 10 ? 2.324 -21.449 9.934 1.0 98.33 10 A 1 -ATOM 2944 C CA . VAL A ? 10 ? 1.585 -20.878 8.803 1.0 98.59 10 A 1 -ATOM 2945 C C . VAL A ? 10 ? 1.593 -21.872 7.644 1.0 98.73 10 A 1 -ATOM 2946 O O . VAL A ? 10 ? 2.647 -22.229 7.120 1.0 98.65 10 A 1 -ATOM 2947 C CB . VAL A ? 10 ? 2.161 -19.517 8.368 1.0 98.44 10 A 1 -ATOM 2948 C CG1 . VAL A ? 10 ? 1.389 -18.940 7.176 1.0 97.85 10 A 1 -ATOM 2949 C CG2 . VAL A ? 10 ? 2.096 -18.496 9.511 1.0 97.87 10 A 1 -ATOM 2950 N N . VAL A ? 11 ? 0.408 -22.291 7.220 1.0 98.78 11 A 1 -ATOM 2951 C CA . VAL A ? 11 ? 0.230 -23.267 6.142 1.0 98.84 11 A 1 -ATOM 2952 C C . VAL A ? 11 ? -0.670 -22.738 5.027 1.0 98.9 11 A 1 -ATOM 2953 O O . VAL A ? 11 ? -1.643 -22.026 5.268 1.0 98.86 11 A 1 -ATOM 2954 C CB . VAL A ? 11 ? -0.271 -24.629 6.663 1.0 98.67 11 A 1 -ATOM 2955 C CG1 . VAL A ? 11 ? 0.766 -25.290 7.576 1.0 97.83 11 A 1 -ATOM 2956 C CG2 . VAL A ? 11 ? -1.604 -24.552 7.420 1.0 97.44 11 A 1 -ATOM 2957 N N . PHE A ? 12 ? -0.356 -23.131 3.801 1.0 98.91 12 A 1 -ATOM 2958 C CA . PHE A ? 12 ? -1.226 -22.987 2.640 1.0 98.93 12 A 1 -ATOM 2959 C C . PHE A ? 12 ? -2.134 -24.215 2.553 1.0 98.91 12 A 1 -ATOM 2960 O O . PHE A ? 12 ? -1.651 -25.348 2.586 1.0 98.77 12 A 1 -ATOM 2961 C CB . PHE A ? 12 ? -0.390 -22.838 1.368 1.0 98.91 12 A 1 -ATOM 2962 C CG . PHE A ? 12 ? 0.533 -21.637 1.374 1.0 98.91 12 A 1 -ATOM 2963 C CD1 . PHE A ? 12 ? 0.076 -20.398 0.898 1.0 98.7 12 A 1 -ATOM 2964 C CD2 . PHE A ? 12 ? 1.845 -21.747 1.873 1.0 98.66 12 A 1 -ATOM 2965 C CE1 . PHE A ? 12 ? 0.921 -19.279 0.911 1.0 98.54 12 A 1 -ATOM 2966 C CE2 . PHE A ? 12 ? 2.694 -20.627 1.893 1.0 98.52 12 A 1 -ATOM 2967 C CZ . PHE A ? 12 ? 2.230 -19.394 1.409 1.0 98.72 12 A 1 -ATOM 2968 N N . VAL A ? 13 ? -3.434 -23.990 2.432 1.0 98.91 13 A 1 -ATOM 2969 C CA . VAL A ? 13 ? -4.436 -25.058 2.278 1.0 98.88 13 A 1 -ATOM 2970 C C . VAL A ? 13 ? -5.111 -25.044 0.907 1.0 98.85 13 A 1 -ATOM 2971 O O . VAL A ? 13 ? -5.748 -26.021 0.529 1.0 98.5 13 A 1 -ATOM 2972 C CB . VAL A ? 13 ? -5.475 -25.032 3.414 1.0 98.75 13 A 1 -ATOM 2973 C CG1 . VAL A ? 13 ? -4.826 -25.374 4.760 1.0 98.03 13 A 1 -ATOM 2974 C CG2 . VAL A ? 13 ? -6.195 -23.681 3.547 1.0 97.66 13 A 1 -ATOM 2975 N N . GLY A ? 14 ? -4.939 -23.974 0.140 1.0 98.81 14 A 1 -ATOM 2976 C CA . GLY A ? 14 ? -5.429 -23.869 -1.231 1.0 98.83 14 A 1 -ATOM 2977 C C . GLY A ? 14 ? -4.732 -22.763 -2.007 1.0 98.92 14 A 1 -ATOM 2978 O O . GLY A ? 14 ? -4.271 -21.779 -1.433 1.0 98.83 14 A 1 -ATOM 2979 N N . ALA A ? 15 ? -4.669 -22.933 -3.321 1.0 98.88 15 A 1 -ATOM 2980 C CA . ALA A ? 15 ? -4.192 -21.923 -4.247 1.0 98.89 15 A 1 -ATOM 2981 C C . ALA A ? 15 ? -4.881 -22.102 -5.603 1.0 98.89 15 A 1 -ATOM 2982 O O . ALA A ? 15 ? -5.074 -23.230 -6.060 1.0 98.69 15 A 1 -ATOM 2983 C CB . ALA A ? 15 ? -2.666 -22.022 -4.373 1.0 98.77 15 A 1 -ATOM 2984 N N . ALA A ? 16 ? -5.240 -20.999 -6.246 1.0 98.91 16 A 1 -ATOM 2985 C CA . ALA A ? 16 ? -5.779 -21.001 -7.600 1.0 98.93 16 A 1 -ATOM 2986 C C . ALA A ? 16 ? -5.506 -19.665 -8.293 1.0 98.95 16 A 1 -ATOM 2987 O O . ALA A ? 16 ? -5.292 -18.639 -7.642 1.0 98.88 16 A 1 -ATOM 2988 C CB . ALA A ? 16 ? -7.280 -21.303 -7.561 1.0 98.79 16 A 1 -ATOM 2989 N N . ARG A ? 17 ? -5.564 -19.666 -9.611 1.0 98.93 17 A 1 -ATOM 2990 C CA . ARG A ? 17 ? -5.447 -18.468 -10.438 1.0 98.92 17 A 1 -ATOM 2991 C C . ARG A ? 17 ? -6.385 -18.515 -11.638 1.0 98.91 17 A 1 -ATOM 2992 O O . ARG A ? 17 ? -6.781 -19.590 -12.081 1.0 98.74 17 A 1 -ATOM 2993 C CB . ARG A ? 17 ? -3.986 -18.264 -10.860 1.0 98.7 17 A 1 -ATOM 2994 C CG . ARG A ? 17 ? -3.465 -19.311 -11.861 1.0 98.34 17 A 1 -ATOM 2995 C CD . ARG A ? 17 ? -2.041 -18.953 -12.268 1.0 98.28 17 A 1 -ATOM 2996 N NE . ARG A ? 17 ? -1.466 -19.847 -13.267 1.0 98.1 17 A 1 -ATOM 2997 C CZ . ARG A ? 17 ? -1.543 -19.731 -14.587 1.0 98.46 17 A 1 -ATOM 2998 N NH1 . ARG A ? 17 ? -2.310 -18.870 -15.177 1.0 95.92 17 A 1 -ATOM 2999 N NH2 . ARG A ? 17 ? -0.812 -20.492 -15.351 1.0 96.3 17 A 1 -ATOM 3000 N N . THR A ? 18 ? -6.678 -17.362 -12.198 1.0 98.92 18 A 1 -ATOM 3001 C CA . THR A ? 18 ? -7.260 -17.281 -13.543 1.0 98.91 18 A 1 -ATOM 3002 C C . THR A ? 18 ? -6.201 -17.652 -14.591 1.0 98.9 18 A 1 -ATOM 3003 O O . THR A ? 18 ? -4.998 -17.606 -14.293 1.0 98.81 18 A 1 -ATOM 3004 C CB . THR A ? 18 ? -7.797 -15.874 -13.837 1.0 98.82 18 A 1 -ATOM 3005 O OG1 . THR A ? 18 ? -6.760 -14.930 -13.944 1.0 98.32 18 A 1 -ATOM 3006 C CG2 . THR A ? 18 ? -8.758 -15.384 -12.758 1.0 97.93 18 A 1 -ATOM 3007 N N . PRO A ? 19 ? -6.594 -17.961 -15.829 1.0 98.89 19 A 1 -ATOM 3008 C CA . PRO A ? 19 ? -5.691 -17.788 -16.960 1.0 98.86 19 A 1 -ATOM 3009 C C . PRO A ? 19 ? -5.145 -16.356 -16.994 1.0 98.89 19 A 1 -ATOM 3010 O O . PRO A ? 19 ? -5.752 -15.429 -16.441 1.0 98.79 19 A 1 -ATOM 3011 C CB . PRO A ? 19 ? -6.512 -18.114 -18.209 1.0 98.63 19 A 1 -ATOM 3012 C CG . PRO A ? 19 ? -7.673 -18.947 -17.670 1.0 97.42 19 A 1 -ATOM 3013 C CD . PRO A ? 19 ? -7.903 -18.366 -16.282 1.0 98.58 19 A 1 -ATOM 3014 N N . ILE A ? 20 ? -4.006 -16.178 -17.643 1.0 98.9 20 A 1 -ATOM 3015 C CA . ILE A ? 20 ? -3.442 -14.857 -17.920 1.0 98.91 20 A 1 -ATOM 3016 C C . ILE A ? 20 ? -3.876 -14.446 -19.325 1.0 98.87 20 A 1 -ATOM 3017 O O . ILE A ? 20 ? -3.476 -15.062 -20.316 1.0 98.72 20 A 1 -ATOM 3018 C CB . ILE A ? 20 ? -1.914 -14.846 -17.725 1.0 98.9 20 A 1 -ATOM 3019 C CG1 . ILE A ? 20 ? -1.553 -15.171 -16.253 1.0 98.7 20 A 1 -ATOM 3020 C CG2 . ILE A ? 20 ? -1.343 -13.473 -18.125 1.0 98.74 20 A 1 -ATOM 3021 C CD1 . ILE A ? 20 ? -0.054 -15.374 -16.004 1.0 97.93 20 A 1 -ATOM 3022 N N . GLY A ? 21 ? -4.695 -13.405 -19.410 1.0 98.74 21 A 1 -ATOM 3023 C CA . GLY A ? 21 ? -5.115 -12.817 -20.674 1.0 98.71 21 A 1 -ATOM 3024 C C . GLY A ? 21 ? -4.035 -11.916 -21.263 1.0 98.81 21 A 1 -ATOM 3025 O O . GLY A ? 21 ? -3.338 -11.200 -20.538 1.0 98.68 21 A 1 -ATOM 3026 N N . SER A ? 22 ? -3.919 -11.914 -22.584 1.0 98.65 22 A 1 -ATOM 3027 C CA . SER A ? 22 ? -3.137 -10.900 -23.292 1.0 98.57 22 A 1 -ATOM 3028 C C . SER A ? 22 ? -3.824 -9.535 -23.223 1.0 98.46 22 A 1 -ATOM 3029 O O . SER A ? 22 ? -5.041 -9.441 -23.081 1.0 98.0 22 A 1 -ATOM 3030 C CB . SER A ? 22 ? -2.932 -11.291 -24.749 1.0 98.37 22 A 1 -ATOM 3031 O OG . SER A ? 22 ? -2.142 -12.454 -24.853 1.0 96.64 22 A 1 -ATOM 3032 N N . PHE A ? 23 ? -3.051 -8.462 -23.369 1.0 98.35 23 A 1 -ATOM 3033 C CA . PHE A ? 23 ? -3.569 -7.096 -23.305 1.0 98.16 23 A 1 -ATOM 3034 C C . PHE A ? 23 ? -4.698 -6.861 -24.316 1.0 97.84 23 A 1 -ATOM 3035 O O . PHE A ? 23 ? -4.524 -7.086 -25.513 1.0 97.1 23 A 1 -ATOM 3036 C CB . PHE A ? 23 ? -2.425 -6.106 -23.522 1.0 97.97 23 A 1 -ATOM 3037 C CG . PHE A ? 23 ? -2.824 -4.649 -23.358 1.0 98.28 23 A 1 -ATOM 3038 C CD1 . PHE A ? 23 ? -2.643 -3.736 -24.416 1.0 97.76 23 A 1 -ATOM 3039 C CD2 . PHE A ? 23 ? -3.366 -4.199 -22.143 1.0 97.59 23 A 1 -ATOM 3040 C CE1 . PHE A ? 23 ? -2.982 -2.381 -24.250 1.0 96.91 23 A 1 -ATOM 3041 C CE2 . PHE A ? 23 ? -3.714 -2.843 -21.976 1.0 96.85 23 A 1 -ATOM 3042 C CZ . PHE A ? 23 ? -3.514 -1.935 -23.029 1.0 97.63 23 A 1 -ATOM 3043 N N . ARG A ? 24 ? -5.846 -6.392 -23.818 1.0 97.78 24 A 1 -ATOM 3044 C CA . ARG A ? 24 ? -7.058 -6.106 -24.607 1.0 97.18 24 A 1 -ATOM 3045 C C . ARG A ? 24 ? -7.536 -7.301 -25.446 1.0 96.61 24 A 1 -ATOM 3046 O O . ARG A ? 24 ? -8.025 -7.125 -26.556 1.0 94.53 24 A 1 -ATOM 3047 C CB . ARG A ? 24 ? -6.891 -4.826 -25.438 1.0 96.54 24 A 1 -ATOM 3048 C CG . ARG A ? 24 ? -6.517 -3.597 -24.591 1.0 93.77 24 A 1 -ATOM 3049 C CD . ARG A ? 24 ? -6.507 -2.329 -25.445 1.0 88.64 24 A 1 -ATOM 3050 N NE . ARG A ? 24 ? -7.874 -1.950 -25.848 1.0 82.67 24 A 1 -ATOM 3051 C CZ . ARG A ? 24 ? -8.220 -1.075 -26.785 1.0 76.48 24 A 1 -ATOM 3052 N NH1 . ARG A ? 24 ? -7.333 -0.422 -27.475 1.0 71.58 24 A 1 -ATOM 3053 N NH2 . ARG A ? 24 ? -9.480 -0.841 -27.026 1.0 70.82 24 A 1 -ATOM 3054 N N . SER A ? 25 ? -7.409 -8.511 -24.906 1.0 97.28 25 A 1 -ATOM 3055 C CA . SER A ? 25 ? -7.821 -9.763 -25.540 1.0 96.93 25 A 1 -ATOM 3056 C C . SER A ? 25 ? -8.985 -10.412 -24.779 1.0 96.66 25 A 1 -ATOM 3057 O O . SER A ? 25 ? -10.022 -9.761 -24.602 1.0 95.37 25 A 1 -ATOM 3058 C CB . SER A ? 25 ? -6.589 -10.653 -25.711 1.0 96.6 25 A 1 -ATOM 3059 O OG . SER A ? 25 ? -6.888 -11.776 -26.492 1.0 93.86 25 A 1 -ATOM 3060 N N . ALA A ? 26 ? -8.846 -11.644 -24.333 1.0 96.89 26 A 1 -ATOM 3061 C CA . ALA A ? 26 ? -9.917 -12.415 -23.693 1.0 96.71 26 A 1 -ATOM 3062 C C . ALA A ? 26 ? -10.579 -11.689 -22.508 1.0 97.08 26 A 1 -ATOM 3063 O O . ALA A ? 26 ? -11.799 -11.724 -22.361 1.0 96.22 26 A 1 -ATOM 3064 C CB . ALA A ? 26 ? -9.337 -13.755 -23.243 1.0 95.79 26 A 1 -ATOM 3065 N N . PHE A ? 27 ? -9.790 -10.980 -21.694 1.0 97.75 27 A 1 -ATOM 3066 C CA . PHE A ? 27 ? -10.269 -10.266 -20.508 1.0 97.91 27 A 1 -ATOM 3067 C C . PHE A ? 27 ? -10.394 -8.747 -20.699 1.0 97.58 27 A 1 -ATOM 3068 O O . PHE A ? 27 ? -10.513 -8.017 -19.721 1.0 96.8 27 A 1 -ATOM 3069 C CB . PHE A ? 27 ? -9.412 -10.648 -19.293 1.0 98.07 27 A 1 -ATOM 3070 C CG . PHE A ? 27 ? -9.346 -12.131 -18.959 1.0 98.37 27 A 1 -ATOM 3071 C CD1 . PHE A ? 27 ? -10.434 -12.991 -19.206 1.0 97.94 27 A 1 -ATOM 3072 C CD2 . PHE A ? 27 ? -8.186 -12.654 -18.356 1.0 97.92 27 A 1 -ATOM 3073 C CE1 . PHE A ? 27 ? -10.359 -14.357 -18.883 1.0 97.68 27 A 1 -ATOM 3074 C CE2 . PHE A ? 27 ? -8.107 -14.017 -18.023 1.0 97.63 27 A 1 -ATOM 3075 C CZ . PHE A ? 27 ? -9.190 -14.869 -18.296 1.0 98.09 27 A 1 -ATOM 3076 N N . ASN A ? 28 ? -10.424 -8.259 -21.934 1.0 97.16 28 A 1 -ATOM 3077 C CA . ASN A ? 28 ? -10.458 -6.826 -22.263 1.0 95.98 28 A 1 -ATOM 3078 C C . ASN A ? 28 ? -11.528 -6.015 -21.508 1.0 95.4 28 A 1 -ATOM 3079 O O . ASN A ? 28 ? -11.303 -4.860 -21.156 1.0 91.89 28 A 1 -ATOM 3080 C CB . ASN A ? 28 ? -10.696 -6.714 -23.774 1.0 93.77 28 A 1 -ATOM 3081 C CG . ASN A ? 28 ? -10.687 -5.277 -24.272 1.0 89.87 28 A 1 -ATOM 3082 O OD1 . ASN A ? 28 ? -9.850 -4.473 -23.924 1.0 81.94 28 A 1 -ATOM 3083 N ND2 . ASN A ? 28 ? -11.608 -4.926 -25.138 1.0 80.22 28 A 1 -ATOM 3084 N N . ASN A ? 29 ? -12.691 -6.625 -21.269 1.0 95.51 29 A 1 -ATOM 3085 C CA . ASN A ? 29 ? -13.827 -5.991 -20.595 1.0 94.56 29 A 1 -ATOM 3086 C C . ASN A ? 29 ? -14.145 -6.632 -19.237 1.0 95.74 29 A 1 -ATOM 3087 O O . ASN A ? 29 ? -15.229 -6.419 -18.697 1.0 93.91 29 A 1 -ATOM 3088 C CB . ASN A ? 29 ? -15.035 -6.008 -21.544 1.0 91.02 29 A 1 -ATOM 3089 C CG . ASN A ? 29 ? -14.816 -5.188 -22.803 1.0 81.29 29 A 1 -ATOM 3090 O OD1 . ASN A ? 29 ? -14.165 -4.164 -22.822 1.0 69.55 29 A 1 -ATOM 3091 N ND2 . ASN A ? 29 ? -15.382 -5.617 -23.906 1.0 70.91 29 A 1 -ATOM 3092 N N . VAL A ? 30 ? -13.238 -7.430 -18.687 1.0 97.0 30 A 1 -ATOM 3093 C CA . VAL A ? 30 ? -13.427 -8.093 -17.391 1.0 97.81 30 A 1 -ATOM 3094 C C . VAL A ? 30 ? -12.797 -7.232 -16.298 1.0 98.22 30 A 1 -ATOM 3095 O O . VAL A ? 30 ? -11.571 -7.132 -16.241 1.0 98.19 30 A 1 -ATOM 3096 C CB . VAL A ? 30 ? -12.856 -9.522 -17.387 1.0 97.84 30 A 1 -ATOM 3097 C CG1 . VAL A ? 30 ? -13.192 -10.226 -16.068 1.0 97.39 30 A 1 -ATOM 3098 C CG2 . VAL A ? 30 ? -13.439 -10.360 -18.530 1.0 97.3 30 A 1 -ATOM 3099 N N . PRO A ? 31 ? -13.593 -6.620 -15.400 1.0 98.27 31 A 1 -ATOM 3100 C CA . PRO A ? 31 ? -13.048 -5.828 -14.303 1.0 98.42 31 A 1 -ATOM 3101 C C . PRO A ? 31 ? -12.084 -6.644 -13.439 1.0 98.72 31 A 1 -ATOM 3102 O O . PRO A ? 31 ? -12.326 -7.826 -13.174 1.0 98.69 31 A 1 -ATOM 3103 C CB . PRO A ? 31 ? -14.257 -5.352 -13.495 1.0 97.81 31 A 1 -ATOM 3104 C CG . PRO A ? 31 ? -15.402 -5.385 -14.508 1.0 96.15 31 A 1 -ATOM 3105 C CD . PRO A ? 31 ? -15.044 -6.581 -15.385 1.0 97.85 31 A 1 -ATOM 3106 N N . VAL A ? 32 ? -11.039 -5.997 -12.913 1.0 98.71 32 A 1 -ATOM 3107 C CA . VAL A ? 32 ? -10.061 -6.647 -12.021 1.0 98.86 32 A 1 -ATOM 3108 C C . VAL A ? 32 ? -10.731 -7.327 -10.820 1.0 98.9 32 A 1 -ATOM 3109 O O . VAL A ? 32 ? -10.321 -8.405 -10.399 1.0 98.85 32 A 1 -ATOM 3110 C CB . VAL A ? 32 ? -8.994 -5.631 -11.572 1.0 98.73 32 A 1 -ATOM 3111 C CG1 . VAL A ? 32 ? -9.531 -4.531 -10.642 1.0 97.91 32 A 1 -ATOM 3112 C CG2 . VAL A ? 32 ? -7.819 -6.337 -10.892 1.0 97.56 32 A 1 -ATOM 3113 N N . THR A ? 33 ? -11.829 -6.752 -10.323 1.0 98.81 33 A 1 -ATOM 3114 C CA . THR A ? 33 ? -12.617 -7.311 -9.218 1.0 98.83 33 A 1 -ATOM 3115 C C . THR A ? 33 ? -13.316 -8.621 -9.585 1.0 98.86 33 A 1 -ATOM 3116 O O . THR A ? 33 ? -13.537 -9.453 -8.710 1.0 98.73 33 A 1 -ATOM 3117 C CB . THR A ? 33 ? -13.669 -6.303 -8.748 1.0 98.67 33 A 1 -ATOM 3118 O OG1 . THR A ? 33 ? -14.465 -5.874 -9.834 1.0 97.16 33 A 1 -ATOM 3119 C CG2 . THR A ? 33 ? -13.020 -5.059 -8.137 1.0 96.69 33 A 1 -ATOM 3120 N N . VAL A ? 34 ? -13.640 -8.846 -10.857 1.0 98.69 34 A 1 -ATOM 3121 C CA . VAL A ? 34 ? -14.190 -10.119 -11.346 1.0 98.59 34 A 1 -ATOM 3122 C C . VAL A ? 34 ? -13.087 -11.169 -11.434 1.0 98.73 34 A 1 -ATOM 3123 O O . VAL A ? 34 ? -13.275 -12.273 -10.931 1.0 98.67 34 A 1 -ATOM 3124 C CB . VAL A ? 34 ? -14.915 -9.950 -12.694 1.0 98.23 34 A 1 -ATOM 3125 C CG1 . VAL A ? 34 ? -15.385 -11.291 -13.271 1.0 97.34 34 A 1 -ATOM 3126 C CG2 . VAL A ? 34 ? -16.147 -9.049 -12.534 1.0 97.47 34 A 1 -ATOM 3127 N N . LEU A ? 35 ? -11.924 -10.821 -11.978 1.0 98.73 35 A 1 -ATOM 3128 C CA . LEU A ? 35 ? -10.752 -11.705 -12.017 1.0 98.84 35 A 1 -ATOM 3129 C C . LEU A ? 35 ? -10.372 -12.167 -10.599 1.0 98.9 35 A 1 -ATOM 3130 O O . LEU A ? 35 ? -10.280 -13.365 -10.335 1.0 98.88 35 A 1 -ATOM 3131 C CB . LEU A ? 35 ? -9.572 -10.979 -12.691 1.0 98.8 35 A 1 -ATOM 3132 C CG . LEU A ? 35 ? -9.795 -10.560 -14.160 1.0 98.6 35 A 1 -ATOM 3133 C CD1 . LEU A ? 35 ? -8.626 -9.702 -14.635 1.0 98.35 35 A 1 -ATOM 3134 C CD2 . LEU A ? 35 ? -9.913 -11.773 -15.080 1.0 98.17 35 A 1 -ATOM 3135 N N . GLY A ? 36 ? -10.238 -11.219 -9.671 1.0 98.89 36 A 1 -ATOM 3136 C CA . GLY A ? 36 ? -9.921 -11.516 -8.275 1.0 98.93 36 A 1 -ATOM 3137 C C . GLY A ? 36 ? -10.984 -12.374 -7.583 1.0 98.95 36 A 1 -ATOM 3138 O O . GLY A ? 36 ? -10.649 -13.332 -6.890 1.0 98.92 36 A 1 -ATOM 3139 N N . ARG A ? 37 ? -12.267 -12.070 -7.795 1.0 98.9 37 A 1 -ATOM 3140 C CA . ARG A ? 37 ? -13.403 -12.832 -7.253 1.0 98.86 37 A 1 -ATOM 3141 C C . ARG A ? 37 ? -13.366 -14.300 -7.679 1.0 98.9 37 A 1 -ATOM 3142 O O . ARG A ? 37 ? -13.526 -15.182 -6.841 1.0 98.78 37 A 1 -ATOM 3143 C CB . ARG A ? 37 ? -14.708 -12.169 -7.718 1.0 98.45 37 A 1 -ATOM 3144 C CG . ARG A ? 37 ? -15.966 -12.888 -7.214 1.0 97.13 37 A 1 -ATOM 3145 C CD . ARG A ? 37 ? -17.219 -12.309 -7.879 1.0 94.95 37 A 1 -ATOM 3146 N NE . ARG A ? 37 ? -17.352 -12.779 -9.258 1.0 91.48 37 A 1 -ATOM 3147 C CZ . ARG A ? 37 ? -18.050 -12.235 -10.234 1.0 91.76 37 A 1 -ATOM 3148 N NH1 . ARG A ? 37 ? -18.738 -11.137 -10.069 1.0 84.25 37 A 1 -ATOM 3149 N NH2 . ARG A ? 37 ? -18.066 -12.802 -11.395 1.0 87.38 37 A 1 -ATOM 3150 N N . GLU A ? 38 ? -13.166 -14.548 -8.967 1.0 98.81 38 A 1 -ATOM 3151 C CA . GLU A ? 38 ? -13.153 -15.915 -9.490 1.0 98.77 38 A 1 -ATOM 3152 C C . GLU A ? 38 ? -11.903 -16.681 -9.031 1.0 98.84 38 A 1 -ATOM 3153 O O . GLU A ? 38 ? -12.026 -17.823 -8.589 1.0 98.74 38 A 1 -ATOM 3154 C CB . GLU A ? 38 ? -13.313 -15.908 -11.015 1.0 98.57 38 A 1 -ATOM 3155 C CG . GLU A ? 38 ? -14.681 -15.376 -11.506 1.0 97.67 38 A 1 -ATOM 3156 C CD . GLU A ? 38 ? -15.885 -15.998 -10.779 1.0 97.05 38 A 1 -ATOM 3157 O OE1 . GLU A ? 38 ? -16.780 -15.230 -10.342 1.0 93.72 38 A 1 -ATOM 3158 O OE2 . GLU A ? 38 ? -15.915 -17.227 -10.593 1.0 93.94 38 A 1 -ATOM 3159 N N . ALA A ? 39 ? -10.729 -16.038 -9.010 1.0 98.86 39 A 1 -ATOM 3160 C CA . ALA A ? 39 ? -9.522 -16.647 -8.448 1.0 98.92 39 A 1 -ATOM 3161 C C . ALA A ? 39 ? -9.698 -17.011 -6.964 1.0 98.94 39 A 1 -ATOM 3162 O O . ALA A ? 39 ? -9.311 -18.103 -6.546 1.0 98.92 39 A 1 -ATOM 3163 C CB . ALA A ? 39 ? -8.340 -15.696 -8.651 1.0 98.91 39 A 1 -ATOM 3164 N N . LEU A ? 40 ? -10.341 -16.146 -6.169 1.0 98.94 40 A 1 -ATOM 3165 C CA . LEU A ? 40 ? -10.608 -16.415 -4.755 1.0 98.95 40 A 1 -ATOM 3166 C C . LEU A ? 40 ? -11.602 -17.565 -4.571 1.0 98.94 40 A 1 -ATOM 3167 O O . LEU A ? 40 ? -11.350 -18.459 -3.760 1.0 98.91 40 A 1 -ATOM 3168 C CB . LEU A ? 40 ? -11.070 -15.124 -4.058 1.0 98.95 40 A 1 -ATOM 3169 C CG . LEU A ? 40 ? -11.358 -15.307 -2.553 1.0 98.82 40 A 1 -ATOM 3170 C CD1 . LEU A ? 40 ? -10.176 -15.892 -1.780 1.0 98.54 40 A 1 -ATOM 3171 C CD2 . LEU A ? 40 ? -11.700 -13.960 -1.921 1.0 98.54 40 A 1 -ATOM 3172 N N . LYS A ? 41 ? -12.692 -17.605 -5.335 1.0 98.91 41 A 1 -ATOM 3173 C CA . LYS A ? 41 ? -13.613 -18.754 -5.335 1.0 98.87 41 A 1 -ATOM 3174 C C . LYS A ? 41 ? -12.884 -20.055 -5.678 1.0 98.87 41 A 1 -ATOM 3175 O O . LYS A ? 41 ? -13.098 -21.069 -5.017 1.0 98.73 41 A 1 -ATOM 3176 C CB . LYS A ? 41 ? -14.739 -18.534 -6.349 1.0 98.75 41 A 1 -ATOM 3177 C CG . LYS A ? 41 ? -15.804 -17.521 -5.891 1.0 97.57 41 A 1 -ATOM 3178 C CD . LYS A ? 41 ? -16.786 -17.360 -7.051 1.0 95.86 41 A 1 -ATOM 3179 C CE . LYS A ? 41 ? -17.923 -16.393 -6.751 1.0 89.67 41 A 1 -ATOM 3180 N NZ . LYS A ? 41 ? -18.682 -16.159 -8.002 1.0 84.04 41 A 1 -ATOM 3181 N N . GLY A ? 42 ? -12.006 -20.010 -6.679 1.0 98.84 42 A 1 -ATOM 3182 C CA . GLY A ? 42 ? -11.186 -21.148 -7.076 1.0 98.82 42 A 1 -ATOM 3183 C C . GLY A ? 42 ? -10.256 -21.622 -5.960 1.0 98.87 42 A 1 -ATOM 3184 O O . GLY A ? 42 ? -10.232 -22.814 -5.656 1.0 98.74 42 A 1 -ATOM 3185 N N . ALA A ? 43 ? -9.558 -20.709 -5.293 1.0 98.86 43 A 1 -ATOM 3186 C CA . ALA A ? 43 ? -8.666 -21.035 -4.179 1.0 98.9 43 A 1 -ATOM 3187 C C . ALA A ? 43 ? -9.425 -21.622 -2.974 1.0 98.89 43 A 1 -ATOM 3188 O O . ALA A ? 43 ? -8.992 -22.618 -2.394 1.0 98.8 43 A 1 -ATOM 3189 C CB . ALA A ? 43 ? -7.879 -19.778 -3.798 1.0 98.9 43 A 1 -ATOM 3190 N N . LEU A ? 44 ? -10.590 -21.058 -2.630 1.0 98.9 44 A 1 -ATOM 3191 C CA . LEU A ? 44 ? -11.457 -21.577 -1.565 1.0 98.88 44 A 1 -ATOM 3192 C C . LEU A ? 44 ? -11.984 -22.979 -1.897 1.0 98.77 44 A 1 -ATOM 3193 O O . LEU A ? 44 ? -11.972 -23.861 -1.038 1.0 98.56 44 A 1 -ATOM 3194 C CB . LEU A ? 44 ? -12.622 -20.598 -1.335 1.0 98.89 44 A 1 -ATOM 3195 C CG . LEU A ? 44 ? -12.215 -19.274 -0.658 1.0 98.79 44 A 1 -ATOM 3196 C CD1 . LEU A ? 44 ? -13.380 -18.287 -0.723 1.0 98.61 44 A 1 -ATOM 3197 C CD2 . LEU A ? 44 ? -11.841 -19.472 0.813 1.0 98.57 44 A 1 -ATOM 3198 N N . LYS A ? 45 ? -12.377 -23.213 -3.151 1.0 98.77 45 A 1 -ATOM 3199 C CA . LYS A ? 45 ? -12.808 -24.532 -3.629 1.0 98.63 45 A 1 -ATOM 3200 C C . LYS A ? 45 ? -11.658 -25.544 -3.606 1.0 98.61 45 A 1 -ATOM 3201 O O . LYS A ? 45 ? -11.864 -26.676 -3.180 1.0 98.14 45 A 1 -ATOM 3202 C CB . LYS A ? 45 ? -13.418 -24.373 -5.030 1.0 98.26 45 A 1 -ATOM 3203 C CG . LYS A ? 45 ? -14.131 -25.649 -5.510 1.0 88.72 45 A 1 -ATOM 3204 C CD . LYS A ? 45 ? -14.738 -25.418 -6.899 1.0 83.28 45 A 1 -ATOM 3205 C CE . LYS A ? 45 ? -15.494 -26.665 -7.382 1.0 70.78 45 A 1 -ATOM 3206 N NZ . LYS A ? 45 ? -16.028 -26.478 -8.755 1.0 62.28 45 A 1 -ATOM 3207 N N . ASN A ? 46 ? -10.450 -25.130 -4.007 1.0 98.48 46 A 1 -ATOM 3208 C CA . ASN A ? 46 ? -9.240 -25.959 -3.943 1.0 98.36 46 A 1 -ATOM 3209 C C . ASN A ? 46 ? -8.885 -26.348 -2.501 1.0 98.38 46 A 1 -ATOM 3210 O O . ASN A ? 46 ? -8.496 -27.487 -2.252 1.0 98.01 46 A 1 -ATOM 3211 C CB . ASN A ? 46 ? -8.088 -25.195 -4.621 1.0 98.08 46 A 1 -ATOM 3212 C CG . ASN A ? 46 ? -6.795 -25.997 -4.643 1.0 97.42 46 A 1 -ATOM 3213 O OD1 . ASN A ? 46 ? -5.865 -25.759 -3.892 1.0 91.21 46 A 1 -ATOM 3214 N ND2 . ASN A ? 46 ? -6.711 -26.985 -5.504 1.0 89.91 46 A 1 -ATOM 3215 N N . ALA A ? 47 ? -9.090 -25.435 -1.555 1.0 98.59 47 A 1 -ATOM 3216 C CA . ALA A ? 47 ? -8.862 -25.663 -0.132 1.0 98.6 47 A 1 -ATOM 3217 C C . ALA A ? 47 ? -9.972 -26.470 0.567 1.0 98.51 47 A 1 -ATOM 3218 O O . ALA A ? 47 ? -9.782 -26.887 1.708 1.0 97.83 47 A 1 -ATOM 3219 C CB . ALA A ? 47 ? -8.703 -24.292 0.535 1.0 98.52 47 A 1 -ATOM 3220 N N . ASN A ? 48 ? -11.137 -26.664 -0.065 1.0 98.38 48 A 1 -ATOM 3221 C CA . ASN A ? 48 ? -12.362 -27.133 0.600 1.0 98.19 48 A 1 -ATOM 3222 C C . ASN A ? 48 ? -12.791 -26.246 1.789 1.0 98.42 48 A 1 -ATOM 3223 O O . ASN A ? 48 ? -13.362 -26.729 2.766 1.0 97.45 48 A 1 -ATOM 3224 C CB . ASN A ? 48 ? -12.259 -28.637 0.924 1.0 97.16 48 A 1 -ATOM 3225 C CG . ASN A ? 48 ? -12.991 -29.535 -0.047 1.0 87.7 48 A 1 -ATOM 3226 O OD1 . ASN A ? 48 ? -13.913 -29.155 -0.742 1.0 78.97 48 A 1 -ATOM 3227 N ND2 . ASN A ? 48 ? -12.620 -30.797 -0.089 1.0 75.1 48 A 1 -ATOM 3228 N N . VAL A ? 49 ? -12.524 -24.947 1.712 1.0 98.56 49 A 1 -ATOM 3229 C CA . VAL A ? 49 ? -12.887 -23.958 2.734 1.0 98.72 49 A 1 -ATOM 3230 C C . VAL A ? 49 ? -14.160 -23.227 2.320 1.0 98.78 49 A 1 -ATOM 3231 O O . VAL A ? 49 ? -14.252 -22.668 1.229 1.0 98.65 49 A 1 -ATOM 3232 C CB . VAL A ? 49 ? -11.718 -22.990 2.999 1.0 98.63 49 A 1 -ATOM 3233 C CG1 . VAL A ? 49 ? -12.101 -21.808 3.899 1.0 98.09 49 A 1 -ATOM 3234 C CG2 . VAL A ? 49 ? -10.574 -23.730 3.703 1.0 97.92 49 A 1 -ATOM 3235 N N . LYS A ? 50 ? -15.153 -23.196 3.218 1.0 98.64 50 A 1 -ATOM 3236 C CA . LYS A ? 50 ? -16.340 -22.361 3.002 1.0 98.61 50 A 1 -ATOM 3237 C C . LYS A ? 50 ? -15.951 -20.882 3.072 1.0 98.78 50 A 1 -ATOM 3238 O O . LYS A ? 50 ? -15.257 -20.502 4.017 1.0 98.59 50 A 1 -ATOM 3239 C CB . LYS A ? 50 ? -17.432 -22.666 4.035 1.0 97.95 50 A 1 -ATOM 3240 C CG . LYS A ? 50 ? -18.131 -24.005 3.761 1.0 85.26 50 A 1 -ATOM 3241 C CD . LYS A ? 50 ? -19.288 -24.196 4.751 1.0 79.73 50 A 1 -ATOM 3242 C CE . LYS A ? 50 ? -20.031 -25.500 4.454 1.0 68.41 50 A 1 -ATOM 3243 N NZ . LYS A ? 50 ? -21.169 -25.699 5.387 1.0 58.69 50 A 1 -ATOM 3244 N N . PRO A ? 51 ? -16.458 -20.036 2.169 1.0 98.74 51 A 1 -ATOM 3245 C CA . PRO A ? 51 ? -16.147 -18.598 2.177 1.0 98.75 51 A 1 -ATOM 3246 C C . PRO A ? 51 ? -16.410 -17.908 3.523 1.0 98.78 51 A 1 -ATOM 3247 O O . PRO A ? 51 ? -15.657 -17.030 3.929 1.0 98.62 51 A 1 -ATOM 3248 C CB . PRO A ? 51 ? -17.014 -18.000 1.067 1.0 98.59 51 A 1 -ATOM 3249 C CG . PRO A ? 51 ? -17.198 -19.156 0.086 1.0 97.47 51 A 1 -ATOM 3250 C CD . PRO A ? 51 ? -17.260 -20.375 1.006 1.0 98.62 51 A 1 -ATOM 3251 N N . SER A ? 52 ? -17.426 -18.362 4.260 1.0 98.73 52 A 1 -ATOM 3252 C CA . SER A ? 52 ? -17.789 -17.827 5.580 1.0 98.58 52 A 1 -ATOM 3253 C C . SER A ? 52 ? -16.761 -18.081 6.692 1.0 98.63 52 A 1 -ATOM 3254 O O . SER A ? 52 ? -16.898 -17.515 7.771 1.0 98.0 52 A 1 -ATOM 3255 C CB . SER A ? 52 ? -19.138 -18.409 6.007 1.0 97.98 52 A 1 -ATOM 3256 O OG . SER A ? 52 ? -19.085 -19.827 6.052 1.0 93.53 52 A 1 -ATOM 3257 N N . LEU A ? 53 ? -15.755 -18.930 6.477 1.0 98.72 53 A 1 -ATOM 3258 C CA . LEU A ? 53 ? -14.663 -19.147 7.435 1.0 98.68 53 A 1 -ATOM 3259 C C . LEU A ? 53 ? -13.556 -18.093 7.324 1.0 98.76 53 A 1 -ATOM 3260 O O . LEU A ? 53 ? -12.754 -17.955 8.246 1.0 98.42 53 A 1 -ATOM 3261 C CB . LEU A ? 53 ? -14.070 -20.556 7.249 1.0 98.28 53 A 1 -ATOM 3262 C CG . LEU A ? 53 ? -15.012 -21.712 7.621 1.0 93.69 53 A 1 -ATOM 3263 C CD1 . LEU A ? 53 ? -14.314 -23.042 7.337 1.0 88.91 53 A 1 -ATOM 3264 C CD2 . LEU A ? 53 ? -15.401 -21.692 9.104 1.0 88.99 53 A 1 -ATOM 3265 N N . VAL A ? 54 ? -13.499 -17.367 6.218 1.0 98.81 54 A 1 -ATOM 3266 C CA . VAL A ? 54 ? -12.490 -16.325 5.994 1.0 98.87 54 A 1 -ATOM 3267 C C . VAL A ? 54 ? -12.742 -15.164 6.952 1.0 98.86 54 A 1 -ATOM 3268 O O . VAL A ? 54 ? -13.849 -14.638 7.024 1.0 98.76 54 A 1 -ATOM 3269 C CB . VAL A ? 54 ? -12.488 -15.850 4.531 1.0 98.84 54 A 1 -ATOM 3270 C CG1 . VAL A ? 54 ? -11.417 -14.782 4.290 1.0 98.55 54 A 1 -ATOM 3271 C CG2 . VAL A ? 54 ? -12.214 -17.014 3.570 1.0 98.47 54 A 1 -ATOM 3272 N N . GLN A ? 55 ? -11.703 -14.746 7.667 1.0 98.86 55 A 1 -ATOM 3273 C CA . GLN A ? 55 ? -11.767 -13.673 8.670 1.0 98.81 55 A 1 -ATOM 3274 C C . GLN A ? 55 ? -11.098 -12.379 8.199 1.0 98.82 55 A 1 -ATOM 3275 O O . GLN A ? 55 ? -11.554 -11.287 8.526 1.0 98.58 55 A 1 -ATOM 3276 C CB . GLN A ? 55 ? -11.110 -14.180 9.957 1.0 98.64 55 A 1 -ATOM 3277 C CG . GLN A ? 55 ? -11.878 -15.336 10.611 1.0 98.27 55 A 1 -ATOM 3278 C CD . GLN A ? 55 ? -11.076 -16.000 11.728 1.0 97.88 55 A 1 -ATOM 3279 O OE1 . GLN A ? 55 ? -9.874 -16.184 11.640 1.0 93.54 55 A 1 -ATOM 3280 N NE2 . GLN A ? 55 ? -11.711 -16.404 12.801 1.0 92.7 55 A 1 -ATOM 3281 N N . GLU A ? 56 ? -10.019 -12.508 7.426 1.0 98.83 56 A 1 -ATOM 3282 C CA . GLU A ? 56 ? -9.272 -11.363 6.891 1.0 98.86 56 A 1 -ATOM 3283 C C . GLU A ? 56 ? -8.690 -11.684 5.508 1.0 98.91 56 A 1 -ATOM 3284 O O . GLU A ? 56 ? -8.440 -12.846 5.165 1.0 98.87 56 A 1 -ATOM 3285 C CB . GLU A ? 56 ? -8.209 -10.918 7.916 1.0 98.74 56 A 1 -ATOM 3286 C CG . GLU A ? 56 ? -7.542 -9.580 7.561 1.0 98.37 56 A 1 -ATOM 3287 C CD . GLU A ? 56 ? -6.881 -8.842 8.737 1.0 98.56 56 A 1 -ATOM 3288 O OE1 . GLU A ? 56 ? -6.357 -7.723 8.494 1.0 97.24 56 A 1 -ATOM 3289 O OE2 . GLU A ? 56 ? -6.923 -9.328 9.884 1.0 97.46 56 A 1 -ATOM 3290 N N . ALA A ? 57 ? -8.494 -10.654 4.694 1.0 98.93 57 A 1 -ATOM 3291 C CA . ALA A ? 57 ? -7.925 -10.757 3.359 1.0 98.94 57 A 1 -ATOM 3292 C C . ALA A ? 57 ? -6.934 -9.625 3.073 1.0 98.94 57 A 1 -ATOM 3293 O O . ALA A ? 57 ? -7.201 -8.460 3.368 1.0 98.85 57 A 1 -ATOM 3294 C CB . ALA A ? 57 ? -9.058 -10.759 2.329 1.0 98.89 57 A 1 -ATOM 3295 N N . PHE A ? 58 ? -5.825 -9.967 2.424 1.0 98.97 58 A 1 -ATOM 3296 C CA . PHE A ? 58 ? -4.888 -9.010 1.832 1.0 98.96 58 A 1 -ATOM 3297 C C . PHE A ? 58 ? -4.764 -9.299 0.337 1.0 98.96 58 A 1 -ATOM 3298 O O . PHE A ? 58 ? -4.436 -10.421 -0.052 1.0 98.89 58 A 1 -ATOM 3299 C CB . PHE A ? 58 ? -3.522 -9.099 2.514 1.0 98.92 58 A 1 -ATOM 3300 C CG . PHE A ? 58 ? -3.514 -8.645 3.957 1.0 98.88 58 A 1 -ATOM 3301 C CD1 . PHE A ? 58 ? -3.276 -7.295 4.272 1.0 98.39 58 A 1 -ATOM 3302 C CD2 . PHE A ? 58 ? -3.754 -9.568 4.993 1.0 98.41 58 A 1 -ATOM 3303 C CE1 . PHE A ? 58 ? -3.274 -6.866 5.606 1.0 98.12 58 A 1 -ATOM 3304 C CE2 . PHE A ? 58 ? -3.760 -9.145 6.332 1.0 98.04 58 A 1 -ATOM 3305 C CZ . PHE A ? 58 ? -3.519 -7.794 6.640 1.0 98.26 58 A 1 -ATOM 3306 N N . ILE A ? 59 ? -5.004 -8.305 -0.510 1.0 98.95 59 A 1 -ATOM 3307 C CA . ILE A ? 59 ? -4.950 -8.476 -1.967 1.0 98.95 59 A 1 -ATOM 3308 C C . ILE A ? 59 ? -4.080 -7.384 -2.585 1.0 98.93 59 A 1 -ATOM 3309 O O . ILE A ? 59 ? -4.329 -6.194 -2.406 1.0 98.83 59 A 1 -ATOM 3310 C CB . ILE A ? 59 ? -6.363 -8.537 -2.591 1.0 98.94 59 A 1 -ATOM 3311 C CG1 . ILE A ? 59 ? -7.199 -9.669 -1.940 1.0 98.76 59 A 1 -ATOM 3312 C CG2 . ILE A ? 59 ? -6.257 -8.742 -4.113 1.0 98.83 59 A 1 -ATOM 3313 C CD1 . ILE A ? 59 ? -8.621 -9.820 -2.487 1.0 98.27 59 A 1 -ATOM 3314 N N . GLY A ? 60 ? -3.059 -7.794 -3.328 1.0 98.94 60 A 1 -ATOM 3315 C CA . GLY A ? 60 ? -2.204 -6.900 -4.088 1.0 98.94 60 A 1 -ATOM 3316 C C . GLY A ? 60 ? -2.877 -6.417 -5.371 1.0 98.95 60 A 1 -ATOM 3317 O O . GLY A ? 60 ? -3.406 -7.216 -6.132 1.0 98.88 60 A 1 -ATOM 3318 N N . VAL A ? 61 ? -2.816 -5.110 -5.622 1.0 98.92 61 A 1 -ATOM 3319 C CA . VAL A ? 61 ? -3.213 -4.498 -6.897 1.0 98.92 61 A 1 -ATOM 3320 C C . VAL A ? 61 ? -2.414 -3.209 -7.081 1.0 98.89 61 A 1 -ATOM 3321 O O . VAL A ? 61 ? -2.213 -2.469 -6.113 1.0 98.67 61 A 1 -ATOM 3322 C CB . VAL A ? 61 ? -4.742 -4.281 -6.973 1.0 98.78 61 A 1 -ATOM 3323 C CG1 . VAL A ? 61 ? -5.297 -3.359 -5.877 1.0 97.83 61 A 1 -ATOM 3324 C CG2 . VAL A ? 61 ? -5.182 -3.751 -8.343 1.0 97.1 61 A 1 -ATOM 3325 N N . VAL A ? 62 ? -1.908 -2.955 -8.279 1.0 98.83 62 A 1 -ATOM 3326 C CA . VAL A ? 62 ? -0.976 -1.838 -8.528 1.0 98.77 62 A 1 -ATOM 3327 C C . VAL A ? 62 ? -1.688 -0.610 -9.079 1.0 98.68 62 A 1 -ATOM 3328 O O . VAL A ? 62 ? -1.473 0.496 -8.579 1.0 98.3 62 A 1 -ATOM 3329 C CB . VAL A ? 62 ? 0.181 -2.267 -9.449 1.0 98.69 62 A 1 -ATOM 3330 C CG1 . VAL A ? 62 ? 1.227 -1.157 -9.579 1.0 98.18 62 A 1 -ATOM 3331 C CG2 . VAL A ? 62 ? 0.886 -3.520 -8.918 1.0 98.31 62 A 1 -ATOM 3332 N N . VAL A ? 63 ? -2.544 -0.796 -10.079 1.0 98.71 63 A 1 -ATOM 3333 C CA . VAL A ? 63 ? -3.266 0.289 -10.760 1.0 98.66 63 A 1 -ATOM 3334 C C . VAL A ? 63 ? -4.778 0.032 -10.703 1.0 98.56 63 A 1 -ATOM 3335 O O . VAL A ? 63 ? -5.395 -0.316 -11.708 1.0 98.19 63 A 1 -ATOM 3336 C CB . VAL A ? 63 ? -2.753 0.512 -12.200 1.0 98.54 63 A 1 -ATOM 3337 C CG1 . VAL A ? 63 ? -3.231 1.875 -12.710 1.0 97.53 63 A 1 -ATOM 3338 C CG2 . VAL A ? 63 ? -1.218 0.502 -12.289 1.0 97.67 63 A 1 -ATOM 3339 N N . PRO A ? 64 ? -5.412 0.186 -9.527 1.0 98.62 64 A 1 -ATOM 3340 C CA . PRO A ? 64 ? -6.839 -0.090 -9.360 1.0 98.35 64 A 1 -ATOM 3341 C C . PRO A ? 64 ? -7.755 1.024 -9.890 1.0 98.38 64 A 1 -ATOM 3342 O O . PRO A ? 64 ? -8.949 1.017 -9.605 1.0 97.59 64 A 1 -ATOM 3343 C CB . PRO A ? 64 ? -7.006 -0.313 -7.853 1.0 97.52 64 A 1 -ATOM 3344 C CG . PRO A ? 64 ? -5.995 0.669 -7.261 1.0 96.88 64 A 1 -ATOM 3345 C CD . PRO A ? 64 ? -4.827 0.582 -8.246 1.0 97.88 64 A 1 -ATOM 3346 N N . SER A ? 65 ? -7.224 1.982 -10.633 1.0 98.4 65 A 1 -ATOM 3347 C CA . SER A ? 65 ? -7.975 3.120 -11.173 1.0 98.46 65 A 1 -ATOM 3348 C C . SER A ? 65 ? -9.217 2.662 -11.941 1.0 98.45 65 A 1 -ATOM 3349 O O . SER A ? 65 ? -9.129 1.812 -12.825 1.0 98.27 65 A 1 -ATOM 3350 C CB . SER A ? 65 ? -7.083 3.957 -12.095 1.0 98.31 65 A 1 -ATOM 3351 O OG . SER A ? 65 ? -5.865 4.279 -11.456 1.0 95.43 65 A 1 -ATOM 3352 N N . ASN A ? 66 ? -10.370 3.228 -11.600 1.0 97.94 66 A 1 -ATOM 3353 C CA . ASN A ? 66 ? -11.691 2.870 -12.130 1.0 97.94 66 A 1 -ATOM 3354 C C . ASN A ? 66 ? -12.191 1.461 -11.739 1.0 98.07 66 A 1 -ATOM 3355 O O . ASN A ? 66 ? -13.207 1.000 -12.264 1.0 97.63 66 A 1 -ATOM 3356 C CB . ASN A ? 66 ? -11.722 3.164 -13.643 1.0 97.55 66 A 1 -ATOM 3357 C CG . ASN A ? 66 ? -13.115 3.202 -14.234 1.0 97.17 66 A 1 -ATOM 3358 O OD1 . ASN A ? 66 ? -14.074 3.658 -13.630 1.0 92.99 66 A 1 -ATOM 3359 N ND2 . ASN A ? 66 ? -13.261 2.766 -15.465 1.0 92.6 66 A 1 -ATOM 3360 N N . ALA A ? 67 ? -11.544 0.781 -10.792 1.0 98.54 67 A 1 -ATOM 3361 C CA . ALA A ? 67 ? -12.045 -0.484 -10.250 1.0 98.53 67 A 1 -ATOM 3362 C C . ALA A ? 67 ? -13.212 -0.307 -9.258 1.0 98.53 67 A 1 -ATOM 3363 O O . ALA A ? 67 ? -13.878 -1.285 -8.912 1.0 97.92 67 A 1 -ATOM 3364 C CB . ALA A ? 67 ? -10.877 -1.249 -9.619 1.0 98.36 67 A 1 -ATOM 3365 N N . GLY A ? 68 ? -13.489 0.920 -8.828 1.0 98.35 68 A 1 -ATOM 3366 C CA . GLY A ? 68 ? -14.488 1.238 -7.812 1.0 98.42 68 A 1 -ATOM 3367 C C . GLY A ? 68 ? -13.939 1.164 -6.384 1.0 98.51 68 A 1 -ATOM 3368 O O . GLY A ? 68 ? -12.820 0.714 -6.142 1.0 97.99 68 A 1 -ATOM 3369 N N . GLN A ? 69 ? -14.748 1.610 -5.415 1.0 98.36 69 A 1 -ATOM 3370 C CA . GLN A ? 69 ? -14.342 1.695 -4.013 1.0 98.27 69 A 1 -ATOM 3371 C C . GLN A ? 69 ? -13.902 0.339 -3.448 1.0 98.32 69 A 1 -ATOM 3372 O O . GLN A ? 69 ? -14.643 -0.644 -3.477 1.0 97.88 69 A 1 -ATOM 3373 C CB . GLN A ? 69 ? -15.488 2.286 -3.182 1.0 97.79 69 A 1 -ATOM 3374 C CG . GLN A ? 69 ? -15.065 2.551 -1.734 1.0 96.11 69 A 1 -ATOM 3375 C CD . GLN A ? 69 ? -16.234 2.987 -0.865 1.0 95.72 69 A 1 -ATOM 3376 O OE1 . GLN A ? 69 ? -17.050 2.184 -0.456 1.0 88.64 69 A 1 -ATOM 3377 N NE2 . GLN A ? 69 ? -16.350 4.257 -0.554 1.0 87.45 69 A 1 -ATOM 3378 N N . GLY A ? 70 ? -12.709 0.310 -2.866 1.0 98.07 70 A 1 -ATOM 3379 C CA . GLY A ? 70 ? -12.187 -0.867 -2.181 1.0 98.17 70 A 1 -ATOM 3380 C C . GLY A ? 70 ? -12.210 -2.140 -3.036 1.0 98.49 70 A 1 -ATOM 3381 O O . GLY A ? 70 ? -12.929 -3.078 -2.696 1.0 97.94 70 A 1 -ATOM 3382 N N . PRO A ? 71 ? -11.437 -2.227 -4.123 1.0 98.57 71 A 1 -ATOM 3383 C CA . PRO A ? 71 ? -11.506 -3.356 -5.060 1.0 98.53 71 A 1 -ATOM 3384 C C . PRO A ? 71 ? -11.269 -4.715 -4.390 1.0 98.69 71 A 1 -ATOM 3385 O O . PRO A ? 71 ? -11.947 -5.684 -4.713 1.0 98.47 71 A 1 -ATOM 3386 C CB . PRO A ? 71 ? -10.461 -3.046 -6.139 1.0 97.93 71 A 1 -ATOM 3387 C CG . PRO A ? 71 ? -9.508 -2.060 -5.463 1.0 96.14 71 A 1 -ATOM 3388 C CD . PRO A ? 71 ? -10.426 -1.272 -4.543 1.0 98.06 71 A 1 -ATOM 3389 N N . ALA A ? 72 ? -10.380 -4.787 -3.404 1.0 98.65 72 A 1 -ATOM 3390 C CA . ALA A ? 72 ? -10.162 -6.009 -2.629 1.0 98.76 72 A 1 -ATOM 3391 C C . ALA A ? 72 ? -11.415 -6.427 -1.836 1.0 98.83 72 A 1 -ATOM 3392 O O . ALA A ? 72 ? -11.742 -7.610 -1.772 1.0 98.77 72 A 1 -ATOM 3393 C CB . ALA A ? 72 ? -8.960 -5.786 -1.708 1.0 98.71 72 A 1 -ATOM 3394 N N . ARG A ? 73 ? -12.158 -5.469 -1.276 1.0 98.45 73 A 1 -ATOM 3395 C CA . ARG A ? 73 ? -13.424 -5.732 -0.562 1.0 98.5 73 A 1 -ATOM 3396 C C . ARG A ? 73 ? -14.486 -6.293 -1.510 1.0 98.61 73 A 1 -ATOM 3397 O O . ARG A ? 73 ? -15.165 -7.246 -1.146 1.0 98.5 73 A 1 -ATOM 3398 C CB . ARG A ? 73 ? -13.877 -4.437 0.142 1.0 98.27 73 A 1 -ATOM 3399 C CG . ARG A ? 73 ? -15.181 -4.573 0.951 1.0 97.09 73 A 1 -ATOM 3400 C CD . ARG A ? 73 ? -15.048 -5.475 2.186 1.0 96.07 73 A 1 -ATOM 3401 N NE . ARG A ? 73 ? -16.264 -5.376 3.013 1.0 97.0 73 A 1 -ATOM 3402 C CZ . ARG A ? 73 ? -16.591 -6.103 4.066 1.0 97.56 73 A 1 -ATOM 3403 N NH1 . ARG A ? 73 ? -15.830 -7.036 4.538 1.0 94.31 73 A 1 -ATOM 3404 N NH2 . ARG A ? 73 ? -17.722 -5.894 4.667 1.0 95.13 73 A 1 -ATOM 3405 N N . GLN A ? 74 ? -14.589 -5.758 -2.725 1.0 98.46 74 A 1 -ATOM 3406 C CA . GLN A ? 74 ? -15.492 -6.272 -3.763 1.0 98.34 74 A 1 -ATOM 3407 C C . GLN A ? 74 ? -15.185 -7.736 -4.106 1.0 98.59 74 A 1 -ATOM 3408 O O . GLN A ? 74 ? -16.101 -8.548 -4.208 1.0 98.59 74 A 1 -ATOM 3409 C CB . GLN A ? 74 ? -15.385 -5.430 -5.042 1.0 98.29 74 A 1 -ATOM 3410 C CG . GLN A ? 74 ? -15.744 -3.949 -4.870 1.0 97.78 74 A 1 -ATOM 3411 C CD . GLN A ? 74 ? -15.655 -3.209 -6.203 1.0 98.09 74 A 1 -ATOM 3412 O OE1 . GLN A ? 74 ? -16.137 -3.677 -7.225 1.0 93.38 74 A 1 -ATOM 3413 N NE2 . GLN A ? 74 ? -15.026 -2.056 -6.250 1.0 93.59 74 A 1 -ATOM 3414 N N . VAL A ? 75 ? -13.906 -8.087 -4.244 1.0 98.77 75 A 1 -ATOM 3415 C CA . VAL A ? 75 ? -13.453 -9.461 -4.510 1.0 98.81 75 A 1 -ATOM 3416 C C . VAL A ? 75 ? -13.903 -10.410 -3.405 1.0 98.82 75 A 1 -ATOM 3417 O O . VAL A ? 75 ? -14.498 -11.451 -3.684 1.0 98.76 75 A 1 -ATOM 3418 C CB . VAL A ? 75 ? -11.918 -9.491 -4.660 1.0 98.76 75 A 1 -ATOM 3419 C CG1 . VAL A ? 75 ? -11.325 -10.903 -4.603 1.0 98.36 75 A 1 -ATOM 3420 C CG2 . VAL A ? 75 ? -11.506 -8.854 -5.993 1.0 98.17 75 A 1 -ATOM 3421 N N . VAL A ? 76 ? -13.647 -10.048 -2.154 1.0 98.83 76 A 1 -ATOM 3422 C CA . VAL A ? 76 ? -13.899 -10.894 -0.982 1.0 98.79 76 A 1 -ATOM 3423 C C . VAL A ? 76 ? -15.398 -11.109 -0.754 1.0 98.75 76 A 1 -ATOM 3424 O O . VAL A ? 76 ? -15.835 -12.246 -0.588 1.0 98.62 76 A 1 -ATOM 3425 C CB . VAL A ? 76 ? -13.189 -10.286 0.244 1.0 98.69 76 A 1 -ATOM 3426 C CG1 . VAL A ? 76 ? -13.576 -10.959 1.558 1.0 98.03 76 A 1 -ATOM 3427 C CG2 . VAL A ? 76 ? -11.671 -10.436 0.074 1.0 98.1 76 A 1 -ATOM 3428 N N . LEU A ? 77 ? -16.205 -10.046 -0.809 1.0 98.75 77 A 1 -ATOM 3429 C CA . LEU A ? 77 ? -17.663 -10.174 -0.702 1.0 98.67 77 A 1 -ATOM 3430 C C . LEU A ? 77 ? -18.259 -10.904 -1.915 1.0 98.59 77 A 1 -ATOM 3431 O O . LEU A ? 77 ? -19.114 -11.773 -1.756 1.0 98.28 77 A 1 -ATOM 3432 C CB . LEU A ? 77 ? -18.303 -8.789 -0.515 1.0 98.6 77 A 1 -ATOM 3433 C CG . LEU A ? 77 ? -17.944 -8.075 0.803 1.0 98.08 77 A 1 -ATOM 3434 C CD1 . LEU A ? 77 ? -18.738 -6.774 0.892 1.0 96.98 77 A 1 -ATOM 3435 C CD2 . LEU A ? 77 ? -18.254 -8.909 2.045 1.0 96.6 77 A 1 -ATOM 3436 N N . GLY A ? 78 ? -17.768 -10.616 -3.119 1.0 98.71 78 A 1 -ATOM 3437 C CA . GLY A ? 78 ? -18.205 -11.285 -4.345 1.0 98.64 78 A 1 -ATOM 3438 C C . GLY A ? 78 ? -17.899 -12.789 -4.365 1.0 98.72 78 A 1 -ATOM 3439 O O . GLY A ? 78 ? -18.650 -13.561 -4.963 1.0 98.41 78 A 1 -ATOM 3440 N N . ALA A ? 79 ? -16.848 -13.224 -3.670 1.0 98.77 79 A 1 -ATOM 3441 C CA . ALA A ? 79 ? -16.526 -14.641 -3.490 1.0 98.79 79 A 1 -ATOM 3442 C C . ALA A ? 79 ? -17.409 -15.353 -2.441 1.0 98.77 79 A 1 -ATOM 3443 O O . ALA A ? 79 ? -17.302 -16.569 -2.281 1.0 98.54 79 A 1 -ATOM 3444 C CB . ALA A ? 79 ? -15.035 -14.770 -3.170 1.0 98.76 79 A 1 -ATOM 3445 N N . GLY A ? 80 ? -18.291 -14.619 -1.751 1.0 98.72 80 A 1 -ATOM 3446 C CA . GLY A ? 80 ? -19.224 -15.154 -0.754 1.0 98.69 80 A 1 -ATOM 3447 C C . GLY A ? 80 ? -18.686 -15.167 0.679 1.0 98.8 80 A 1 -ATOM 3448 O O . GLY A ? 80 ? -19.271 -15.836 1.533 1.0 98.35 80 A 1 -ATOM 3449 N N . CYS A ? 81 ? -17.588 -14.460 0.957 1.0 98.77 81 A 1 -ATOM 3450 C CA . CYS A ? 81 ? -17.104 -14.273 2.324 1.0 98.77 81 A 1 -ATOM 3451 C C . CYS A ? 81 ? -18.093 -13.428 3.143 1.0 98.71 81 A 1 -ATOM 3452 O O . CYS A ? 81 ? -18.865 -12.638 2.596 1.0 98.38 81 A 1 -ATOM 3453 C CB . CYS A ? 81 ? -15.709 -13.635 2.316 1.0 98.76 81 A 1 -ATOM 3454 S SG . CYS A ? 81 ? -14.520 -14.687 1.424 1.0 98.64 81 A 1 -ATOM 3455 N N . ASP A ? 82 ? -18.052 -13.588 4.470 1.0 98.65 82 A 1 -ATOM 3456 C CA . ASP A ? 82 ? -18.949 -12.863 5.364 1.0 98.59 82 A 1 -ATOM 3457 C C . ASP A ? 82 ? -18.664 -11.350 5.367 1.0 98.62 82 A 1 -ATOM 3458 O O . ASP A ? 82 ? -17.525 -10.904 5.206 1.0 98.32 82 A 1 -ATOM 3459 C CB . ASP A ? 82 ? -18.855 -13.450 6.781 1.0 98.36 82 A 1 -ATOM 3460 C CG . ASP A ? 82 ? -19.972 -12.865 7.648 1.0 97.38 82 A 1 -ATOM 3461 O OD1 . ASP A ? 82 ? -19.675 -11.932 8.425 1.0 94.62 82 A 1 -ATOM 3462 O OD2 . ASP A ? 82 ? -21.133 -13.283 7.448 1.0 94.37 82 A 1 -ATOM 3463 N N . VAL A ? 83 ? -19.699 -10.548 5.600 1.0 98.65 83 A 1 -ATOM 3464 C CA . VAL A ? 83 ? -19.562 -9.082 5.670 1.0 98.59 83 A 1 -ATOM 3465 C C . VAL A ? 83 ? -18.644 -8.618 6.809 1.0 98.64 83 A 1 -ATOM 3466 O O . VAL A ? 83 ? -18.094 -7.523 6.735 1.0 98.12 83 A 1 -ATOM 3467 C CB . VAL A ? 83 ? -20.930 -8.383 5.783 1.0 98.1 83 A 1 -ATOM 3468 C CG1 . VAL A ? 83 ? -21.761 -8.600 4.515 1.0 95.95 83 A 1 -ATOM 3469 C CG2 . VAL A ? 83 ? -21.739 -8.839 7.008 1.0 95.53 83 A 1 -ATOM 3470 N N . SER A ? 84 ? -18.429 -9.460 7.824 1.0 98.53 84 A 1 -ATOM 3471 C CA . SER A ? 84 ? -17.483 -9.208 8.920 1.0 98.53 84 A 1 -ATOM 3472 C C . SER A ? 84 ? -16.005 -9.357 8.523 1.0 98.61 84 A 1 -ATOM 3473 O O . SER A ? 84 ? -15.135 -8.931 9.281 1.0 98.27 84 A 1 -ATOM 3474 C CB . SER A ? 84 ? -17.800 -10.125 10.106 1.0 98.33 84 A 1 -ATOM 3475 O OG . SER A ? 84 ? -17.553 -11.479 9.792 1.0 96.78 84 A 1 -ATOM 3476 N N . THR A ? 85 ? -15.714 -9.924 7.354 1.0 98.62 85 A 1 -ATOM 3477 C CA . THR A ? 85 ? -14.340 -10.131 6.873 1.0 98.68 85 A 1 -ATOM 3478 C C . THR A ? 85 ? -13.609 -8.801 6.717 1.0 98.67 85 A 1 -ATOM 3479 O O . THR A ? 85 ? -14.074 -7.907 6.010 1.0 98.54 85 A 1 -ATOM 3480 C CB . THR A ? 85 ? -14.318 -10.874 5.530 1.0 98.65 85 A 1 -ATOM 3481 O OG1 . THR A ? 85 ? -15.153 -12.005 5.563 1.0 97.1 85 A 1 -ATOM 3482 C CG2 . THR A ? 85 ? -12.918 -11.366 5.158 1.0 97.23 85 A 1 -ATOM 3483 N N . VAL A ? 86 ? -12.436 -8.688 7.332 1.0 98.74 86 A 1 -ATOM 3484 C CA . VAL A ? 86 ? -11.568 -7.509 7.212 1.0 98.76 86 A 1 -ATOM 3485 C C . VAL A ? 86 ? -10.774 -7.603 5.909 1.0 98.81 86 A 1 -ATOM 3486 O O . VAL A ? 86 ? -10.175 -8.634 5.627 1.0 98.62 86 A 1 -ATOM 3487 C CB . VAL A ? 86 ? -10.635 -7.401 8.428 1.0 98.46 86 A 1 -ATOM 3488 C CG1 . VAL A ? 86 ? -9.755 -6.150 8.337 1.0 97.32 86 A 1 -ATOM 3489 C CG2 . VAL A ? 86 ? -11.441 -7.322 9.735 1.0 97.3 86 A 1 -ATOM 3490 N N . VAL A ? 87 ? -10.750 -6.542 5.115 1.0 98.72 87 A 1 -ATOM 3491 C CA . VAL A ? 87 ? -10.097 -6.583 3.796 1.0 98.76 87 A 1 -ATOM 3492 C C . VAL A ? 87 ? -9.208 -5.371 3.573 1.0 98.73 87 A 1 -ATOM 3493 O O . VAL A ? 87 ? -9.641 -4.238 3.755 1.0 98.51 87 A 1 -ATOM 3494 C CB . VAL A ? 87 ? -11.109 -6.710 2.643 1.0 98.6 87 A 1 -ATOM 3495 C CG1 . VAL A ? 87 ? -10.377 -7.008 1.327 1.0 97.58 87 A 1 -ATOM 3496 C CG2 . VAL A ? 87 ? -12.130 -7.834 2.876 1.0 97.52 87 A 1 -ATOM 3497 N N . THR A ? 88 ? -7.986 -5.621 3.124 1.0 98.8 88 A 1 -ATOM 3498 C CA . THR A ? 88 ? -7.002 -4.580 2.820 1.0 98.8 88 A 1 -ATOM 3499 C C . THR A ? 88 ? -6.368 -4.832 1.446 1.0 98.83 88 A 1 -ATOM 3500 O O . THR A ? 88 ? -5.834 -5.910 1.195 1.0 98.79 88 A 1 -ATOM 3501 C CB . THR A ? 88 ? -5.926 -4.527 3.912 1.0 98.74 88 A 1 -ATOM 3502 O OG1 . THR A ? 88 ? -6.531 -4.410 5.184 1.0 97.66 88 A 1 -ATOM 3503 C CG2 . THR A ? 88 ? -4.988 -3.332 3.764 1.0 97.83 88 A 1 -ATOM 3504 N N . ALA A ? 89 ? -6.394 -3.836 0.572 1.0 98.85 89 A 1 -ATOM 3505 C CA . ALA A ? 89 ? -5.538 -3.802 -0.610 1.0 98.81 89 A 1 -ATOM 3506 C C . ALA A ? 89 ? -4.218 -3.117 -0.266 1.0 98.75 89 A 1 -ATOM 3507 O O . ALA A ? 89 ? -4.201 -2.113 0.438 1.0 98.52 89 A 1 -ATOM 3508 C CB . ALA A ? 89 ? -6.271 -3.113 -1.767 1.0 98.69 89 A 1 -ATOM 3509 N N . VAL A ? 90 ? -3.085 -3.807 -0.867 1.0 98.68 90 A 1 -ATOM 3510 C CA . VAL A ? 90 ? -1.756 -3.223 -0.743 1.0 98.55 90 A 1 -ATOM 3511 C C . VAL A ? 90 ? -1.076 -3.152 -2.083 1.0 98.74 90 A 1 -ATOM 3512 O O . VAL A ? 90 ? -1.291 -4.009 -2.939 1.0 98.44 90 A 1 -ATOM 3513 C CB . VAL A ? 90 ? -0.881 -3.974 0.274 1.0 96.82 90 A 1 -ATOM 3514 C CG1 . VAL A ? 90 ? -1.469 -3.869 1.698 1.0 94.85 90 A 1 -ATOM 3515 C CG2 . VAL A ? 90 ? -0.690 -5.454 -0.062 1.0 94.5 90 A 1 -ATOM 3516 N N . ASN A ? 91 ? -0.239 -1.988 -2.173 1.0 98.61 91 A 1 -ATOM 3517 C CA . ASN A ? 91 ? 0.541 -1.814 -3.381 1.0 98.66 91 A 1 -ATOM 3518 C C . ASN A ? 91 ? 2.033 -1.783 -3.036 1.0 98.7 91 A 1 -ATOM 3519 O O . ASN A ? 91 ? 2.528 -0.845 -2.407 1.0 98.55 91 A 1 -ATOM 3520 C CB . ASN A ? 91 ? 0.047 -0.558 -4.122 1.0 98.43 91 A 1 -ATOM 3521 C CG . ASN A ? 91 ? 0.827 -0.279 -5.408 1.0 97.57 91 A 1 -ATOM 3522 O OD1 . ASN A ? 91 ? 1.732 -1.002 -5.800 1.0 93.63 91 A 1 -ATOM 3523 N ND2 . ASN A ? 91 ? 0.517 0.802 -6.085 1.0 92.71 91 A 1 -ATOM 3524 N N . LYS A ? 92 ? 2.736 -2.810 -3.459 1.0 98.58 92 A 1 -ATOM 3525 C CA . LYS A ? 92 ? 4.200 -2.886 -3.497 1.0 98.71 92 A 1 -ATOM 3526 C C . LYS A ? 92 ? 4.654 -3.153 -4.944 1.0 98.71 92 A 1 -ATOM 3527 O O . LYS A ? 92 ? 5.489 -4.022 -5.187 1.0 98.26 92 A 1 -ATOM 3528 C CB . LYS A ? 92 ? 4.706 -3.908 -2.465 1.0 98.63 92 A 1 -ATOM 3529 C CG . LYS A ? 92 ? 6.231 -3.799 -2.232 1.0 97.99 92 A 1 -ATOM 3530 C CD . LYS A ? 92 ? 6.691 -4.764 -1.132 1.0 97.17 92 A 1 -ATOM 3531 C CE . LYS A ? 92 ? 8.204 -4.694 -0.913 1.0 95.89 92 A 1 -ATOM 3532 N NZ . LYS A ? 92 ? 8.961 -5.514 -1.893 1.0 94.9 92 A 1 -ATOM 3533 N N . MET A ? 93 ? 4.059 -2.424 -5.875 1.0 98.78 93 A 1 -ATOM 3534 C CA . MET A ? 93 ? 4.312 -2.575 -7.309 1.0 98.7 93 A 1 -ATOM 3535 C C . MET A ? 93 ? 4.232 -4.052 -7.728 1.0 98.79 93 A 1 -ATOM 3536 O O . MET A ? 93 ? 3.330 -4.777 -7.267 1.0 98.38 93 A 1 -ATOM 3537 C CB . MET A ? 93 ? 5.621 -1.853 -7.705 1.0 98.11 93 A 1 -ATOM 3538 C CG . MET A ? 93 ? 5.570 -0.335 -7.470 1.0 93.43 93 A 1 -ATOM 3539 S SD . MET A ? 93 ? 5.612 0.198 -5.742 1.0 84.08 93 A 1 -ATOM 3540 C CE . MET A ? 93 ? 7.391 0.195 -5.440 1.0 71.73 93 A 1 -ATOM 3541 N N . CYS A ? 94 ? 5.153 -4.536 -8.563 1.0 98.62 94 A 1 -ATOM 3542 C CA . CYS A ? 94 ? 5.099 -5.898 -9.099 1.0 98.46 94 A 1 -ATOM 3543 C C . CYS A ? 94 ? 5.202 -7.006 -8.030 1.0 98.66 94 A 1 -ATOM 3544 O O . CYS A ? 94 ? 4.914 -8.160 -8.324 1.0 98.03 94 A 1 -ATOM 3545 C CB . CYS A ? 94 ? 6.203 -6.050 -10.148 1.0 97.07 94 A 1 -ATOM 3546 S SG . CYS A ? 94 ? 6.302 -4.608 -11.254 1.0 90.58 94 A 1 -ATOM 3547 N N . ALA A ? 95 ? 5.580 -6.684 -6.789 1.0 98.76 95 A 1 -ATOM 3548 C CA . ALA A ? 95 ? 5.625 -7.630 -5.671 1.0 98.86 95 A 1 -ATOM 3549 C C . ALA A ? 95 ? 4.354 -7.617 -4.791 1.0 98.91 95 A 1 -ATOM 3550 O O . ALA A ? 95 ? 4.308 -8.321 -3.781 1.0 98.82 95 A 1 -ATOM 3551 C CB . ALA A ? 95 ? 6.894 -7.372 -4.852 1.0 98.73 95 A 1 -ATOM 3552 N N . SER A ? 96 ? 3.319 -6.857 -5.151 1.0 98.89 96 A 1 -ATOM 3553 C CA . SER A ? 96 ? 2.103 -6.664 -4.346 1.0 98.91 96 A 1 -ATOM 3554 C C . SER A ? 96 ? 1.433 -7.975 -3.919 1.0 98.93 96 A 1 -ATOM 3555 O O . SER A ? 96 ? 1.125 -8.149 -2.742 1.0 98.86 96 A 1 -ATOM 3556 C CB . SER A ? 96 ? 1.096 -5.807 -5.127 1.0 98.81 96 A 1 -ATOM 3557 O OG . SER A ? 96 ? 1.652 -4.535 -5.395 1.0 98.24 96 A 1 -ATOM 3558 N N . GLY A ? 97 ? 1.262 -8.916 -4.840 1.0 98.92 97 A 1 -ATOM 3559 C CA . GLY A ? 97 ? 0.667 -10.222 -4.534 1.0 98.93 97 A 1 -ATOM 3560 C C . GLY A ? 97 ? 1.475 -11.038 -3.515 1.0 98.96 97 A 1 -ATOM 3561 O O . GLY A ? 97 ? 0.898 -11.708 -2.664 1.0 98.9 97 A 1 -ATOM 3562 N N . MET A ? 98 ? 2.805 -10.940 -3.541 1.0 98.96 98 A 1 -ATOM 3563 C CA . MET A ? 98 ? 3.662 -11.600 -2.549 1.0 98.95 98 A 1 -ATOM 3564 C C . MET A ? 98 ? 3.635 -10.872 -1.196 1.0 98.96 98 A 1 -ATOM 3565 O O . MET A ? 98 ? 3.564 -11.523 -0.157 1.0 98.9 98 A 1 -ATOM 3566 C CB . MET A ? 98 ? 5.087 -11.731 -3.095 1.0 98.85 98 A 1 -ATOM 3567 C CG . MET A ? 98 ? 5.951 -12.616 -2.188 1.0 97.58 98 A 1 -ATOM 3568 S SD . MET A ? 98 ? 7.623 -12.921 -2.817 1.0 97.43 98 A 1 -ATOM 3569 C CE . MET A ? 98 ? 7.258 -14.023 -4.204 1.0 93.28 98 A 1 -ATOM 3570 N N . LYS A ? 99 ? 3.636 -9.529 -1.193 1.0 98.92 99 A 1 -ATOM 3571 C CA . LYS A ? 99 ? 3.513 -8.752 0.051 1.0 98.92 99 A 1 -ATOM 3572 C C . LYS A ? 99 ? 2.170 -8.994 0.749 1.0 98.92 99 A 1 -ATOM 3573 O O . LYS A ? 99 ? 2.144 -9.067 1.970 1.0 98.86 99 A 1 -ATOM 3574 C CB . LYS A ? 99 ? 3.768 -7.256 -0.215 1.0 98.87 99 A 1 -ATOM 3575 C CG . LYS A ? 99 ? 3.903 -6.413 1.074 1.0 98.55 99 A 1 -ATOM 3576 C CD . LYS A ? 99 ? 5.126 -6.786 1.936 1.0 97.94 99 A 1 -ATOM 3577 C CE . LYS A ? 99 ? 5.328 -5.820 3.111 1.0 97.29 99 A 1 -ATOM 3578 N NZ . LYS A ? 99 ? 6.600 -6.061 3.844 1.0 95.99 99 A 1 -ATOM 3579 N N . ALA A ? 100 ? 1.094 -9.192 -0.007 1.0 98.96 100 A 1 -ATOM 3580 C CA . ALA A ? 100 ? -0.199 -9.589 0.548 1.0 98.96 100 A 1 -ATOM 3581 C C . ALA A ? 100 ? -0.105 -10.922 1.319 1.0 98.95 100 A 1 -ATOM 3582 O O . ALA A ? 100 ? -0.575 -11.014 2.453 1.0 98.9 100 A 1 -ATOM 3583 C CB . ALA A ? 100 ? -1.218 -9.662 -0.597 1.0 98.94 100 A 1 -ATOM 3584 N N . ILE A ? 101 ? 0.577 -11.921 0.754 1.0 98.96 101 A 1 -ATOM 3585 C CA . ILE A ? 101 ? 0.822 -13.213 1.418 1.0 98.96 101 A 1 -ATOM 3586 C C . ILE A ? 101 ? 1.696 -13.030 2.673 1.0 98.92 101 A 1 -ATOM 3587 O O . ILE A ? 101 ? 1.418 -13.636 3.704 1.0 98.84 101 A 1 -ATOM 3588 C CB . ILE A ? 101 ? 1.431 -14.233 0.427 1.0 98.96 101 A 1 -ATOM 3589 C CG1 . ILE A ? 101 ? 0.459 -14.521 -0.743 1.0 98.87 101 A 1 -ATOM 3590 C CG2 . ILE A ? 101 ? 1.775 -15.556 1.140 1.0 98.88 101 A 1 -ATOM 3591 C CD1 . ILE A ? 101 ? 1.075 -15.332 -1.897 1.0 98.7 101 A 1 -ATOM 3592 N N . ALA A ? 102 ? 2.708 -12.164 2.623 1.0 98.91 102 A 1 -ATOM 3593 C CA . ALA A ? 102 ? 3.543 -11.850 3.785 1.0 98.86 102 A 1 -ATOM 3594 C C . ALA A ? 102 ? 2.738 -11.185 4.919 1.0 98.8 102 A 1 -ATOM 3595 O O . ALA A ? 102 ? 2.861 -11.582 6.076 1.0 98.61 102 A 1 -ATOM 3596 C CB . ALA A ? 102 ? 4.713 -10.966 3.332 1.0 98.79 102 A 1 -ATOM 3597 N N . CYS A ? 103 ? 1.858 -10.229 4.594 1.0 98.85 103 A 1 -ATOM 3598 C CA . CYS A ? 103 ? 0.951 -9.614 5.567 1.0 98.8 103 A 1 -ATOM 3599 C C . CYS A ? 103 ? 0.017 -10.654 6.208 1.0 98.72 103 A 1 -ATOM 3600 O O . CYS A ? 103 ? -0.133 -10.672 7.428 1.0 98.52 103 A 1 -ATOM 3601 C CB . CYS A ? 103 ? 0.141 -8.499 4.886 1.0 98.8 103 A 1 -ATOM 3602 S SG . CYS A ? 103 ? 1.203 -7.091 4.441 1.0 98.46 103 A 1 -ATOM 3603 N N . ALA A ? 104 ? -0.556 -11.556 5.404 1.0 98.84 104 A 1 -ATOM 3604 C CA . ALA A ? 104 ? -1.396 -12.644 5.901 1.0 98.82 104 A 1 -ATOM 3605 C C . ALA A ? 104 ? -0.625 -13.595 6.836 1.0 98.72 104 A 1 -ATOM 3606 O O . ALA A ? 104 ? -1.128 -13.955 7.897 1.0 98.52 104 A 1 -ATOM 3607 C CB . ALA A ? 104 ? -1.979 -13.390 4.697 1.0 98.83 104 A 1 -ATOM 3608 N N . ALA A ? 105 ? 0.616 -13.946 6.486 1.0 98.73 105 A 1 -ATOM 3609 C CA . ALA A ? 105 ? 1.478 -14.765 7.333 1.0 98.63 105 A 1 -ATOM 3610 C C . ALA A ? 105 ? 1.753 -14.094 8.688 1.0 98.43 105 A 1 -ATOM 3611 O O . ALA A ? 105 ? 1.633 -14.744 9.725 1.0 98.15 105 A 1 -ATOM 3612 C CB . ALA A ? 105 ? 2.779 -15.068 6.582 1.0 98.62 105 A 1 -ATOM 3613 N N . SER A ? 106 ? 2.041 -12.789 8.700 1.0 98.44 106 A 1 -ATOM 3614 C CA . SER A ? 106 ? 2.265 -12.020 9.932 1.0 98.22 106 A 1 -ATOM 3615 C C . SER A ? 106 ? 1.039 -12.019 10.854 1.0 97.96 106 A 1 -ATOM 3616 O O . SER A ? 106 ? 1.175 -12.216 12.060 1.0 97.48 106 A 1 -ATOM 3617 C CB . SER A ? 106 ? 2.649 -10.574 9.598 1.0 98.08 106 A 1 -ATOM 3618 O OG . SER A ? 106 ? 3.841 -10.515 8.838 1.0 96.59 106 A 1 -ATOM 3619 N N . ILE A ? 107 ? -0.163 -11.855 10.297 1.0 98.07 107 A 1 -ATOM 3620 C CA . ILE A ? 107 ? -1.430 -11.894 11.049 1.0 97.63 107 A 1 -ATOM 3621 C C . ILE A ? 107 ? -1.660 -13.274 11.688 1.0 97.79 107 A 1 -ATOM 3622 O O . ILE A ? 107 ? -2.044 -13.356 12.854 1.0 96.95 107 A 1 -ATOM 3623 C CB . ILE A ? 107 ? -2.598 -11.479 10.119 1.0 95.84 107 A 1 -ATOM 3624 C CG1 . ILE A ? 107 ? -2.511 -9.990 9.695 1.0 87.44 107 A 1 -ATOM 3625 C CG2 . ILE A ? 107 ? -3.976 -11.765 10.735 1.0 83.67 107 A 1 -ATOM 3626 C CD1 . ILE A ? 107 ? -2.627 -8.963 10.817 1.0 80.15 107 A 1 -ATOM 3627 N N . LEU A ? 108 ? -1.383 -14.354 10.949 1.0 98.19 108 A 1 -ATOM 3628 C CA . LEU A ? 108 ? -1.504 -15.727 11.452 1.0 98.2 108 A 1 -ATOM 3629 C C . LEU A ? 108 ? -0.462 -16.042 12.535 1.0 97.78 108 A 1 -ATOM 3630 O O . LEU A ? 108 ? -0.798 -16.660 13.544 1.0 97.29 108 A 1 -ATOM 3631 C CB . LEU A ? 108 ? -1.376 -16.709 10.278 1.0 98.46 108 A 1 -ATOM 3632 C CG . LEU A ? 108 ? -2.562 -16.689 9.296 1.0 98.41 108 A 1 -ATOM 3633 C CD1 . LEU A ? 108 ? -2.207 -17.518 8.062 1.0 98.27 108 A 1 -ATOM 3634 C CD2 . LEU A ? 108 ? -3.831 -17.275 9.911 1.0 98.22 108 A 1 -ATOM 3635 N N . GLN A ? 109 ? 0.782 -15.593 12.367 1.0 97.91 109 A 1 -ATOM 3636 C CA . GLN A ? 109 ? 1.840 -15.776 13.374 1.0 97.64 109 A 1 -ATOM 3637 C C . GLN A ? 109 ? 1.520 -15.073 14.695 1.0 97.26 109 A 1 -ATOM 3638 O O . GLN A ? 109 ? 1.862 -15.585 15.758 1.0 96.51 109 A 1 -ATOM 3639 C CB . GLN A ? 109 ? 3.175 -15.240 12.852 1.0 97.52 109 A 1 -ATOM 3640 C CG . GLN A ? 109 ? 3.856 -16.187 11.864 1.0 96.48 109 A 1 -ATOM 3641 C CD . GLN A ? 109 ? 5.267 -15.680 11.569 1.0 96.67 109 A 1 -ATOM 3642 O OE1 . GLN A ? 109 ? 5.497 -14.886 10.675 1.0 91.91 109 A 1 -ATOM 3643 N NE2 . GLN A ? 109 ? 6.252 -16.093 12.339 1.0 90.88 109 A 1 -ATOM 3644 N N . LEU A ? 110 ? 0.855 -13.919 14.638 1.0 97.55 110 A 1 -ATOM 3645 C CA . LEU A ? 110 ? 0.427 -13.162 15.820 1.0 97.13 110 A 1 -ATOM 3646 C C . LEU A ? 110 ? -0.884 -13.682 16.436 1.0 96.6 110 A 1 -ATOM 3647 O O . LEU A ? 110 ? -1.360 -13.095 17.404 1.0 95.35 110 A 1 -ATOM 3648 C CB . LEU A ? 110 ? 0.332 -11.674 15.458 1.0 97.09 110 A 1 -ATOM 3649 C CG . LEU A ? 110 ? 1.696 -10.997 15.224 1.0 96.81 110 A 1 -ATOM 3650 C CD1 . LEU A ? 110 ? 1.467 -9.599 14.655 1.0 96.11 110 A 1 -ATOM 3651 C CD2 . LEU A ? 110 ? 2.500 -10.860 16.518 1.0 95.95 110 A 1 -ATOM 3652 N N . ASP A ? 111 ? -1.463 -14.764 15.893 1.0 96.62 111 A 1 -ATOM 3653 C CA . ASP A ? 111 ? -2.744 -15.338 16.345 1.0 96.1 111 A 1 -ATOM 3654 C C . ASP A ? 111 ? -3.910 -14.322 16.348 1.0 96.41 111 A 1 -ATOM 3655 O O . ASP A ? 111 ? -4.863 -14.452 17.113 1.0 94.77 111 A 1 -ATOM 3656 C CB . ASP A ? 111 ? -2.555 -16.107 17.677 1.0 94.59 111 A 1 -ATOM 3657 C CG . ASP A ? 111 ? -2.772 -17.620 17.610 1.0 91.02 111 A 1 -ATOM 3658 O OD1 . ASP A ? 111 ? -3.287 -18.156 16.608 1.0 86.05 111 A 1 -ATOM 3659 O OD2 . ASP A ? 111 ? -2.380 -18.316 18.582 1.0 84.71 111 A 1 -ATOM 3660 N N . LEU A ? 112 ? -3.833 -13.289 15.499 1.0 96.84 112 A 1 -ATOM 3661 C CA . LEU A ? 112 ? -4.892 -12.280 15.347 1.0 96.84 112 A 1 -ATOM 3662 C C . LEU A ? 112 ? -6.087 -12.817 14.552 1.0 97.19 112 A 1 -ATOM 3663 O O . LEU A ? 112 ? -7.215 -12.362 14.741 1.0 96.44 112 A 1 -ATOM 3664 C CB . LEU A ? 112 ? -4.314 -11.030 14.660 1.0 96.57 112 A 1 -ATOM 3665 C CG . LEU A ? 112 ? -3.235 -10.283 15.466 1.0 95.93 112 A 1 -ATOM 3666 C CD1 . LEU A ? 112 ? -2.647 -9.158 14.617 1.0 94.6 112 A 1 -ATOM 3667 C CD2 . LEU A ? 112 ? -3.800 -9.667 16.746 1.0 94.28 112 A 1 -ATOM 3668 N N . GLN A ? 113 ? -5.823 -13.770 13.663 1.0 97.33 113 A 1 -ATOM 3669 C CA . GLN A ? 113 ? -6.805 -14.488 12.844 1.0 97.81 113 A 1 -ATOM 3670 C C . GLN A ? 113 ? -6.356 -15.947 12.690 1.0 97.92 113 A 1 -ATOM 3671 O O . GLN A ? 113 ? -5.186 -16.274 12.875 1.0 97.45 113 A 1 -ATOM 3672 C CB . GLN A ? 113 ? -6.924 -13.830 11.460 1.0 97.82 113 A 1 -ATOM 3673 C CG . GLN A ? 113 ? -7.329 -12.354 11.446 1.0 97.4 113 A 1 -ATOM 3674 C CD . GLN A ? 113 ? -8.757 -12.037 11.885 1.0 97.73 113 A 1 -ATOM 3675 O OE1 . GLN A ? 113 ? -9.499 -12.837 12.422 1.0 93.83 113 A 1 -ATOM 3676 N NE2 . GLN A ? 113 ? -9.176 -10.811 11.660 1.0 94.47 113 A 1 -ATOM 3677 N N . GLU A ? 114 ? -7.295 -16.823 12.325 1.0 98.38 114 A 1 -ATOM 3678 C CA . GLU A ? 114 ? -7.049 -18.255 12.097 1.0 98.41 114 A 1 -ATOM 3679 C C . GLU A ? 114 ? -7.209 -18.657 10.619 1.0 98.65 114 A 1 -ATOM 3680 O O . GLU A ? 114 ? -6.568 -19.596 10.162 1.0 98.37 114 A 1 -ATOM 3681 C CB . GLU A ? 114 ? -8.007 -19.042 13.011 1.0 97.53 114 A 1 -ATOM 3682 C CG . GLU A ? 114 ? -7.751 -20.557 13.041 1.0 94.32 114 A 1 -ATOM 3683 C CD . GLU A ? 114 ? -8.795 -21.261 13.939 1.0 92.94 114 A 1 -ATOM 3684 O OE1 . GLU A ? 114 ? -8.440 -21.931 14.926 1.0 85.7 114 A 1 -ATOM 3685 O OE2 . GLU A ? 114 ? -10.017 -21.139 13.674 1.0 87.29 114 A 1 -ATOM 3686 N N . MET A ? 115 ? -8.053 -17.947 9.868 1.0 98.72 115 A 1 -ATOM 3687 C CA . MET A ? 115 ? -8.306 -18.206 8.448 1.0 98.81 115 A 1 -ATOM 3688 C C . MET A ? 115 ? -8.190 -16.917 7.642 1.0 98.88 115 A 1 -ATOM 3689 O O . MET A ? 115 ? -9.031 -16.024 7.761 1.0 98.76 115 A 1 -ATOM 3690 C CB . MET A ? 115 ? -9.692 -18.843 8.286 1.0 98.56 115 A 1 -ATOM 3691 C CG . MET A ? 115 ? -9.928 -19.407 6.882 1.0 94.45 115 A 1 -ATOM 3692 S SD . MET A ? 115 ? -8.913 -20.849 6.423 1.0 95.02 115 A 1 -ATOM 3693 C CE . MET A ? 115 ? -9.466 -22.049 7.657 1.0 88.83 115 A 1 -ATOM 3694 N N . VAL A ? 116 ? -7.169 -16.829 6.807 1.0 98.92 116 A 1 -ATOM 3695 C CA . VAL A ? 116 ? -6.850 -15.637 6.013 1.0 98.93 116 A 1 -ATOM 3696 C C . VAL A ? 116 ? -6.704 -16.017 4.542 1.0 98.96 116 A 1 -ATOM 3697 O O . VAL A ? 116 ? -6.155 -17.062 4.206 1.0 98.89 116 A 1 -ATOM 3698 C CB . VAL A ? 116 ? -5.585 -14.935 6.554 1.0 98.62 116 A 1 -ATOM 3699 C CG1 . VAL A ? 116 ? -5.329 -13.609 5.836 1.0 93.62 116 A 1 -ATOM 3700 C CG2 . VAL A ? 116 ? -5.707 -14.616 8.052 1.0 91.81 116 A 1 -ATOM 3701 N N . VAL A ? 117 ? -7.181 -15.169 3.653 1.0 98.94 117 A 1 -ATOM 3702 C CA . VAL A ? 117 ? -6.903 -15.278 2.218 1.0 98.95 117 A 1 -ATOM 3703 C C . VAL A ? 117 ? -5.965 -14.162 1.782 1.0 98.95 117 A 1 -ATOM 3704 O O . VAL A ? 117 ? -5.994 -13.059 2.320 1.0 98.9 117 A 1 -ATOM 3705 C CB . VAL A ? 117 ? -8.173 -15.343 1.352 1.0 98.83 117 A 1 -ATOM 3706 C CG1 . VAL A ? 117 ? -9.012 -16.571 1.707 1.0 97.94 117 A 1 -ATOM 3707 C CG2 . VAL A ? 117 ? -9.049 -14.093 1.470 1.0 97.63 117 A 1 -ATOM 3708 N N . ALA A ? 118 ? -5.124 -14.449 0.804 1.0 98.96 118 A 1 -ATOM 3709 C CA . ALA A ? 118 ? -4.200 -13.474 0.249 1.0 98.96 118 A 1 -ATOM 3710 C C . ALA A ? 118 ? -3.980 -13.723 -1.241 1.0 98.97 118 A 1 -ATOM 3711 O O . ALA A ? 118 ? -4.301 -14.787 -1.764 1.0 98.89 118 A 1 -ATOM 3712 C CB . ALA A ? 118 ? -2.889 -13.518 1.036 1.0 98.87 118 A 1 -ATOM 3713 N N . GLY A ? 119 ? -3.414 -12.751 -1.931 1.0 98.94 119 A 1 -ATOM 3714 C CA . GLY A ? 119 ? -3.093 -12.904 -3.340 1.0 98.92 119 A 1 -ATOM 3715 C C . GLY A ? 119 ? -2.888 -11.579 -4.040 1.0 98.95 119 A 1 -ATOM 3716 O O . GLY A ? 119 ? -2.567 -10.565 -3.420 1.0 98.81 119 A 1 -ATOM 3717 N N . GLY A ? 120 ? -3.058 -11.602 -5.348 1.0 98.97 120 A 1 -ATOM 3718 C CA . GLY A ? 120 ? -2.901 -10.416 -6.165 1.0 98.97 120 A 1 -ATOM 3719 C C . GLY A ? 120 ? -3.711 -10.483 -7.446 1.0 98.98 120 A 1 -ATOM 3720 O O . GLY A ? 120 ? -4.060 -11.562 -7.928 1.0 98.92 120 A 1 -ATOM 3721 N N . MET A ? 121 ? -4.008 -9.311 -7.982 1.0 98.97 121 A 1 -ATOM 3722 C CA . MET A ? 121 ? -4.801 -9.161 -9.191 1.0 98.96 121 A 1 -ATOM 3723 C C . MET A ? 121 ? -4.363 -7.921 -9.966 1.0 98.96 121 A 1 -ATOM 3724 O O . MET A ? 121 ? -3.915 -6.938 -9.384 1.0 98.87 121 A 1 -ATOM 3725 C CB . MET A ? 121 ? -6.291 -9.111 -8.831 1.0 98.83 121 A 1 -ATOM 3726 C CG . MET A ? 121 ? -6.686 -7.905 -7.961 1.0 98.8 121 A 1 -ATOM 3727 S SD . MET A ? 121 ? -8.403 -7.993 -7.384 1.0 98.79 121 A 1 -ATOM 3728 C CE . MET A ? 121 ? -8.537 -6.402 -6.559 1.0 97.65 121 A 1 -ATOM 3729 N N . GLU A ? 122 ? -4.525 -7.969 -11.275 1.0 98.97 122 A 1 -ATOM 3730 C CA . GLU A ? 122 ? -4.356 -6.797 -12.137 1.0 98.96 122 A 1 -ATOM 3731 C C . GLU A ? 122 ? -5.198 -6.960 -13.398 1.0 98.95 122 A 1 -ATOM 3732 O O . GLU A ? 122 ? -5.279 -8.050 -13.961 1.0 98.88 122 A 1 -ATOM 3733 C CB . GLU A ? 122 ? -2.883 -6.612 -12.515 1.0 98.9 122 A 1 -ATOM 3734 C CG . GLU A ? 122 ? -2.487 -5.134 -12.722 1.0 98.5 122 A 1 -ATOM 3735 C CD . GLU A ? 122 ? -2.396 -4.373 -11.395 1.0 98.87 122 A 1 -ATOM 3736 O OE1 . GLU A ? 122 ? -3.105 -3.368 -11.220 1.0 97.82 122 A 1 -ATOM 3737 O OE2 . GLU A ? 122 ? -1.611 -4.803 -10.514 1.0 98.02 122 A 1 -ATOM 3738 N N . SER A ? 123 ? -5.802 -5.891 -13.847 1.0 98.88 123 A 1 -ATOM 3739 C CA . SER A ? 123 ? -6.345 -5.774 -15.198 1.0 98.86 123 A 1 -ATOM 3740 C C . SER A ? 123 ? -5.705 -4.572 -15.868 1.0 98.85 123 A 1 -ATOM 3741 O O . SER A ? 123 ? -6.189 -3.449 -15.741 1.0 98.64 123 A 1 -ATOM 3742 C CB . SER A ? 123 ? -7.865 -5.661 -15.191 1.0 98.72 123 A 1 -ATOM 3743 O OG . SER A ? 123 ? -8.309 -5.475 -16.519 1.0 97.96 123 A 1 -ATOM 3744 N N . MET A ? 124 ? -4.615 -4.799 -16.584 1.0 98.72 124 A 1 -ATOM 3745 C CA . MET A ? 124 ? -3.943 -3.729 -17.326 1.0 98.68 124 A 1 -ATOM 3746 C C . MET A ? 124 ? -4.833 -3.230 -18.477 1.0 98.57 124 A 1 -ATOM 3747 O O . MET A ? 124 ? -4.838 -2.040 -18.765 1.0 98.37 124 A 1 -ATOM 3748 C CB . MET A ? 124 ? -2.559 -4.188 -17.803 1.0 98.7 124 A 1 -ATOM 3749 C CG . MET A ? 124 ? -1.693 -4.704 -16.644 1.0 98.24 124 A 1 -ATOM 3750 S SD . MET A ? 124 ? 0.035 -5.092 -17.043 1.0 97.96 124 A 1 -ATOM 3751 C CE . MET A ? 124 ? 0.744 -3.435 -17.025 1.0 94.42 124 A 1 -ATOM 3752 N N . SER A ? 125 ? -5.655 -4.101 -19.050 1.0 98.62 125 A 1 -ATOM 3753 C CA . SER A ? 125 ? -6.653 -3.740 -20.069 1.0 98.4 125 A 1 -ATOM 3754 C C . SER A ? 125 ? -7.703 -2.740 -19.572 1.0 98.23 125 A 1 -ATOM 3755 O O . SER A ? 125 ? -8.143 -1.883 -20.339 1.0 97.76 125 A 1 -ATOM 3756 C CB . SER A ? 125 ? -7.385 -4.995 -20.552 1.0 98.13 125 A 1 -ATOM 3757 O OG . SER A ? 125 ? -6.481 -5.886 -21.170 1.0 97.26 125 A 1 -ATOM 3758 N N . CYS A ? 126 ? -8.094 -2.828 -18.305 1.0 98.47 126 A 1 -ATOM 3759 C CA . CYS A ? 126 ? -9.099 -1.951 -17.701 1.0 98.34 126 A 1 -ATOM 3760 C C . CYS A ? 126 ? -8.521 -0.665 -17.088 1.0 98.35 126 A 1 -ATOM 3761 O O . CYS A ? 126 ? -9.296 0.174 -16.624 1.0 97.96 126 A 1 -ATOM 3762 C CB . CYS A ? 126 ? -9.923 -2.742 -16.678 1.0 98.1 126 A 1 -ATOM 3763 S SG . CYS A ? 126 ? -10.992 -3.966 -17.508 1.0 97.26 126 A 1 -ATOM 3764 N N . VAL A ? 127 ? -7.202 -0.467 -17.077 1.0 98.07 127 A 1 -ATOM 3765 C CA . VAL A ? 127 ? -6.602 0.790 -16.603 1.0 98.07 127 A 1 -ATOM 3766 C C . VAL A ? 127 ? -6.995 1.925 -17.554 1.0 97.83 127 A 1 -ATOM 3767 O O . VAL A ? 127 ? -6.733 1.827 -18.755 1.0 97.84 127 A 1 -ATOM 3768 C CB . VAL A ? 127 ? -5.073 0.692 -16.468 1.0 98.18 127 A 1 -ATOM 3769 C CG1 . VAL A ? 127 ? -4.449 2.037 -16.074 1.0 97.45 127 A 1 -ATOM 3770 C CG2 . VAL A ? 127 ? -4.677 -0.327 -15.392 1.0 96.8 127 A 1 -ATOM 3771 N N . PRO A ? 128 ? -7.600 3.013 -17.046 1.0 98.05 128 A 1 -ATOM 3772 C CA . PRO A ? 128 ? -8.060 4.112 -17.884 1.0 97.96 128 A 1 -ATOM 3773 C C . PRO A ? 128 ? -6.926 5.063 -18.288 1.0 98.03 128 A 1 -ATOM 3774 O O . PRO A ? 128 ? -5.806 5.013 -17.777 1.0 98.12 128 A 1 -ATOM 3775 C CB . PRO A ? 128 ? -9.131 4.803 -17.037 1.0 97.73 128 A 1 -ATOM 3776 C CG . PRO A ? 128 ? -8.585 4.648 -15.619 1.0 97.39 128 A 1 -ATOM 3777 C CD . PRO A ? 128 ? -7.959 3.255 -15.651 1.0 98.09 128 A 1 -ATOM 3778 N N . PHE A ? 129 ? -7.251 5.981 -19.184 1.0 97.67 129 A 1 -ATOM 3779 C CA . PHE A ? 129 ? -6.507 7.227 -19.342 1.0 97.53 129 A 1 -ATOM 3780 C C . PHE A ? 129 ? -6.968 8.250 -18.301 1.0 97.75 129 A 1 -ATOM 3781 O O . PHE A ? 129 ? -8.114 8.210 -17.851 1.0 97.56 129 A 1 -ATOM 3782 C CB . PHE A ? 129 ? -6.682 7.772 -20.759 1.0 97.05 129 A 1 -ATOM 3783 C CG . PHE A ? 129 ? -6.203 6.833 -21.840 1.0 96.76 129 A 1 -ATOM 3784 C CD1 . PHE A ? 129 ? -4.829 6.723 -22.122 1.0 92.87 129 A 1 -ATOM 3785 C CD2 . PHE A ? 129 ? -7.122 6.050 -22.560 1.0 92.39 129 A 1 -ATOM 3786 C CE1 . PHE A ? 129 ? -4.378 5.841 -23.119 1.0 90.44 129 A 1 -ATOM 3787 C CE2 . PHE A ? 129 ? -6.676 5.162 -23.556 1.0 90.36 129 A 1 -ATOM 3788 C CZ . PHE A ? 129 ? -5.302 5.059 -23.836 1.0 93.06 129 A 1 -ATOM 3789 N N . TYR A ? 130 ? -6.094 9.189 -17.961 1.0 97.86 130 A 1 -ATOM 3790 C CA . TYR A ? 130 ? -6.361 10.222 -16.963 1.0 97.75 130 A 1 -ATOM 3791 C C . TYR A ? 130 ? -6.419 11.614 -17.582 1.0 97.36 130 A 1 -ATOM 3792 O O . TYR A ? 130 ? -5.558 11.995 -18.373 1.0 96.87 130 A 1 -ATOM 3793 C CB . TYR A ? 130 ? -5.300 10.182 -15.858 1.0 97.74 130 A 1 -ATOM 3794 C CG . TYR A ? 130 ? -5.053 8.847 -15.182 1.0 98.2 130 A 1 -ATOM 3795 C CD1 . TYR A ? 130 ? -6.083 7.907 -14.993 1.0 96.85 130 A 1 -ATOM 3796 C CD2 . TYR A ? 130 ? -3.764 8.549 -14.707 1.0 96.3 130 A 1 -ATOM 3797 C CE1 . TYR A ? 130 ? -5.836 6.683 -14.343 1.0 96.52 130 A 1 -ATOM 3798 C CE2 . TYR A ? 130 ? -3.504 7.333 -14.047 1.0 96.23 130 A 1 -ATOM 3799 C CZ . TYR A ? 130 ? -4.543 6.402 -13.870 1.0 98.07 130 A 1 -ATOM 3800 O OH . TYR A ? 130 ? -4.296 5.224 -13.229 1.0 97.81 130 A 1 -ATOM 3801 N N . LEU A ? 131 ? -7.397 12.398 -17.140 1.0 97.29 131 A 1 -ATOM 3802 C CA . LEU A ? 131 ? -7.455 13.840 -17.347 1.0 96.93 131 A 1 -ATOM 3803 C C . LEU A ? 131 ? -7.321 14.533 -15.981 1.0 96.89 131 A 1 -ATOM 3804 O O . LEU A ? 131 ? -8.256 14.461 -15.177 1.0 96.77 131 A 1 -ATOM 3805 C CB . LEU A ? 131 ? -8.759 14.213 -18.069 1.0 96.41 131 A 1 -ATOM 3806 C CG . LEU A ? 131 ? -8.877 15.724 -18.364 1.0 94.99 131 A 1 -ATOM 3807 C CD1 . LEU A ? 131 ? -7.833 16.195 -19.378 1.0 92.06 131 A 1 -ATOM 3808 C CD2 . LEU A ? 131 ? -10.257 16.036 -18.929 1.0 91.13 131 A 1 -ATOM 3809 N N . PRO A ? 132 ? -6.201 15.216 -15.695 1.0 96.83 132 A 1 -ATOM 3810 C CA . PRO A ? 132 ? -6.051 15.992 -14.467 1.0 95.93 132 A 1 -ATOM 3811 C C . PRO A ? 132 ? -7.124 17.075 -14.327 1.0 95.8 132 A 1 -ATOM 3812 O O . PRO A ? 132 ? -7.611 17.625 -15.314 1.0 94.97 132 A 1 -ATOM 3813 C CB . PRO A ? 132 ? -4.647 16.600 -14.526 1.0 94.76 132 A 1 -ATOM 3814 C CG . PRO A ? 132 ? -3.890 15.642 -15.442 1.0 94.35 132 A 1 -ATOM 3815 C CD . PRO A ? 132 ? -4.959 15.215 -16.446 1.0 96.41 132 A 1 -ATOM 3816 N N . ARG A ? 133 ? -7.457 17.437 -13.096 1.0 96.4 133 A 1 -ATOM 3817 C CA . ARG A ? 133 ? -8.331 18.583 -12.813 1.0 95.55 133 A 1 -ATOM 3818 C C . ARG A ? 133 ? -7.620 19.890 -13.149 1.0 94.93 133 A 1 -ATOM 3819 O O . ARG A ? 133 ? -6.428 20.034 -12.918 1.0 92.28 133 A 1 -ATOM 3820 C CB . ARG A ? 133 ? -8.785 18.581 -11.349 1.0 94.06 133 A 1 -ATOM 3821 C CG . ARG A ? 133 ? -9.630 17.349 -11.013 1.0 91.05 133 A 1 -ATOM 3822 C CD . ARG A ? 133 ? -10.123 17.403 -9.567 1.0 89.21 133 A 1 -ATOM 3823 N NE . ARG A ? 133 ? -10.729 16.122 -9.219 1.0 94.1 133 A 1 -ATOM 3824 C CZ . ARG A ? 133 ? -11.992 15.741 -9.377 1.0 95.92 133 A 1 -ATOM 3825 N NH1 . ARG A ? 133 ? -12.965 16.540 -9.724 1.0 90.66 133 A 1 -ATOM 3826 N NH2 . ARG A ? 133 ? -12.283 14.504 -9.196 1.0 92.93 133 A 1 -ATOM 3827 N N . GLY A ? 134 ? -8.386 20.864 -13.606 1.0 94.1 134 A 1 -ATOM 3828 C CA . GLY A ? 134 ? -7.880 22.193 -13.941 1.0 93.1 134 A 1 -ATOM 3829 C C . GLY A ? 134 ? -8.478 22.721 -15.237 1.0 93.98 134 A 1 -ATOM 3830 O O . GLY A ? 134 ? -9.298 22.057 -15.876 1.0 91.08 134 A 1 -ATOM 3831 N N . GLU A ? 135 ? -8.068 23.925 -15.613 1.0 90.86 135 A 1 -ATOM 3832 C CA . GLU A ? 135 ? -8.399 24.464 -16.928 1.0 89.93 135 A 1 -ATOM 3833 C C . GLU A ? 135 ? -7.650 23.707 -18.024 1.0 90.48 135 A 1 -ATOM 3834 O O . GLU A ? 135 ? -6.453 23.425 -17.918 1.0 87.86 135 A 1 -ATOM 3835 C CB . GLU A ? 135 ? -8.089 25.964 -17.017 1.0 87.58 135 A 1 -ATOM 3836 C CG . GLU A ? 135 ? -9.202 26.817 -16.394 1.0 77.81 135 A 1 -ATOM 3837 C CD . GLU A ? 135 ? -9.009 28.317 -16.643 1.0 70.78 135 A 1 -ATOM 3838 O OE1 . GLU A ? 135 ? -10.035 29.036 -16.648 1.0 64.52 135 A 1 -ATOM 3839 O OE2 . GLU A ? 135 ? -7.846 28.742 -16.827 1.0 66.33 135 A 1 -ATOM 3840 N N . ILE A ? 136 ? -8.367 23.408 -19.105 1.0 89.1 136 A 1 -ATOM 3841 C CA . ILE A ? 136 ? -7.773 22.875 -20.328 1.0 89.4 136 A 1 -ATOM 3842 C C . ILE A ? 136 ? -7.390 24.070 -21.205 1.0 89.71 136 A 1 -ATOM 3843 O O . ILE A ? 136 ? -8.265 24.865 -21.560 1.0 87.73 136 A 1 -ATOM 3844 C CB . ILE A ? 136 ? -8.734 21.894 -21.033 1.0 88.9 136 A 1 -ATOM 3845 C CG1 . ILE A ? 136 ? -9.059 20.705 -20.096 1.0 87.29 136 A 1 -ATOM 3846 C CG2 . ILE A ? 136 ? -8.109 21.401 -22.350 1.0 87.31 136 A 1 -ATOM 3847 C CD1 . ILE A ? 136 ? -10.088 19.723 -20.661 1.0 82.8 136 A 1 -ATOM 3848 N N . PRO A ? 137 ? -6.116 24.229 -21.562 1.0 89.23 137 A 1 -ATOM 3849 C CA . PRO A ? 137 ? -5.673 25.346 -22.382 1.0 88.38 137 A 1 -ATOM 3850 C C . PRO A ? 137 ? -6.231 25.257 -23.805 1.0 89.15 137 A 1 -ATOM 3851 O O . PRO A ? 137 ? -6.640 24.192 -24.283 1.0 87.05 137 A 1 -ATOM 3852 C CB . PRO A ? 137 ? -4.144 25.294 -22.343 1.0 86.64 137 A 1 -ATOM 3853 C CG . PRO A ? 137 ? -3.849 23.810 -22.145 1.0 84.86 137 A 1 -ATOM 3854 C CD . PRO A ? 137 ? -4.997 23.351 -21.247 1.0 88.69 137 A 1 -ATOM 3855 N N . PHE A ? 138 ? -6.203 26.378 -24.510 1.0 90.38 138 A 1 -ATOM 3856 C CA . PHE A ? 138 ? -6.497 26.400 -25.940 1.0 87.08 138 A 1 -ATOM 3857 C C . PHE A ? 138 ? -5.606 25.400 -26.698 1.0 85.55 138 A 1 -ATOM 3858 O O . PHE A ? 138 ? -4.409 25.291 -26.429 1.0 83.55 138 A 1 -ATOM 3859 C CB . PHE A ? 138 ? -6.313 27.824 -26.478 1.0 87.39 138 A 1 -ATOM 3860 C CG . PHE A ? 138 ? -6.592 27.935 -27.964 1.0 86.59 138 A 1 -ATOM 3861 C CD1 . PHE A ? 138 ? -5.536 27.861 -28.892 1.0 83.14 138 A 1 -ATOM 3862 C CD2 . PHE A ? 138 ? -7.917 28.065 -28.431 1.0 85.98 138 A 1 -ATOM 3863 C CE1 . PHE A ? 138 ? -5.802 27.924 -30.275 1.0 82.6 138 A 1 -ATOM 3864 C CE2 . PHE A ? 138 ? -8.187 28.126 -29.809 1.0 85.51 138 A 1 -ATOM 3865 C CZ . PHE A ? 138 ? -7.129 28.057 -30.730 1.0 86.21 138 A 1 -ATOM 3866 N N . GLY A ? 139 ? -6.195 24.682 -27.637 1.0 88.16 139 A 1 -ATOM 3867 C CA . GLY A ? 139 ? -5.525 23.605 -28.373 1.0 85.21 139 A 1 -ATOM 3868 C C . GLY A ? 139 ? -5.679 22.222 -27.734 1.0 86.54 139 A 1 -ATOM 3869 O O . GLY A ? 139 ? -5.297 21.229 -28.351 1.0 83.03 139 A 1 -ATOM 3870 N N . GLY A ? 140 ? -6.263 22.137 -26.547 1.0 89.61 140 A 1 -ATOM 3871 C CA . GLY A ? 140 ? -6.517 20.880 -25.850 1.0 88.91 140 A 1 -ATOM 3872 C C . GLY A ? 140 ? -5.371 20.442 -24.939 1.0 89.37 140 A 1 -ATOM 3873 O O . GLY A ? 140 ? -4.430 21.188 -24.657 1.0 87.57 140 A 1 -ATOM 3874 N N . THR A ? 141 ? -5.474 19.203 -24.447 1.0 90.14 141 A 1 -ATOM 3875 C CA . THR A ? 141 ? -4.477 18.586 -23.564 1.0 90.84 141 A 1 -ATOM 3876 C C . THR A ? 141 ? -4.265 17.122 -23.938 1.0 91.77 141 A 1 -ATOM 3877 O O . THR A ? 141 ? -5.085 16.522 -24.639 1.0 90.62 141 A 1 -ATOM 3878 C CB . THR A ? 141 ? -4.886 18.753 -22.090 1.0 89.08 141 A 1 -ATOM 3879 O OG1 . THR A ? 141 ? -3.798 18.407 -21.262 1.0 84.7 141 A 1 -ATOM 3880 C CG2 . THR A ? 141 ? -6.078 17.889 -21.673 1.0 84.41 141 A 1 -ATOM 3881 N N . LYS A ? 142 ? -3.160 16.530 -23.472 1.0 94.08 142 A 1 -ATOM 3882 C CA . LYS A ? 142 ? -2.939 15.088 -23.592 1.0 94.58 142 A 1 -ATOM 3883 C C . LYS A ? 142 ? -3.559 14.359 -22.403 1.0 95.66 142 A 1 -ATOM 3884 O O . LYS A ? 142 ? -3.378 14.765 -21.257 1.0 94.46 142 A 1 -ATOM 3885 C CB . LYS A ? 142 ? -1.445 14.766 -23.726 1.0 91.33 142 A 1 -ATOM 3886 C CG . LYS A ? 142 ? -0.939 15.027 -25.155 1.0 76.39 142 A 1 -ATOM 3887 C CD . LYS A ? 142 ? 0.520 14.579 -25.292 1.0 74.56 142 A 1 -ATOM 3888 C CE . LYS A ? 142 ? 0.978 14.705 -26.746 1.0 62.19 142 A 1 -ATOM 3889 N NZ . LYS A ? 142 ? 2.376 14.240 -26.919 1.0 55.07 142 A 1 -ATOM 3890 N N . LEU A ? 143 ? -4.233 13.254 -22.700 1.0 96.03 143 A 1 -ATOM 3891 C CA . LEU A ? 143 ? -4.587 12.265 -21.693 1.0 96.48 143 A 1 -ATOM 3892 C C . LEU A ? 143 ? -3.332 11.486 -21.280 1.0 97.18 143 A 1 -ATOM 3893 O O . LEU A ? 143 ? -2.458 11.206 -22.100 1.0 96.62 143 A 1 -ATOM 3894 C CB . LEU A ? 143 ? -5.673 11.327 -22.237 1.0 95.27 143 A 1 -ATOM 3895 C CG . LEU A ? 143 ? -7.023 12.013 -22.505 1.0 92.16 143 A 1 -ATOM 3896 C CD1 . LEU A ? 143 ? -7.965 11.024 -23.182 1.0 89.26 143 A 1 -ATOM 3897 C CD2 . LEU A ? 143 ? -7.694 12.495 -21.219 1.0 88.38 143 A 1 -ATOM 3898 N N . ILE A ? 144 ? -3.264 11.128 -20.010 1.0 96.61 144 A 1 -ATOM 3899 C CA . ILE A ? 144 ? -2.165 10.364 -19.423 1.0 97.03 144 A 1 -ATOM 3900 C C . ILE A ? 144 ? -2.577 8.892 -19.395 1.0 97.47 144 A 1 -ATOM 3901 O O . ILE A ? 144 ? -3.625 8.557 -18.852 1.0 97.45 144 A 1 -ATOM 3902 C CB . ILE A ? 144 ? -1.830 10.911 -18.017 1.0 96.89 144 A 1 -ATOM 3903 C CG1 . ILE A ? 144 ? -1.395 12.401 -18.088 1.0 95.93 144 A 1 -ATOM 3904 C CG2 . ILE A ? 144 ? -0.733 10.062 -17.352 1.0 96.15 144 A 1 -ATOM 3905 C CD1 . ILE A ? 144 ? -1.386 13.100 -16.725 1.0 93.02 144 A 1 -ATOM 3906 N N . ASP A ? 145 ? -1.754 8.003 -19.952 1.0 95.94 145 A 1 -ATOM 3907 C CA . ASP A ? 145 ? -1.992 6.563 -19.855 1.0 96.71 145 A 1 -ATOM 3908 C C . ASP A ? 145 ? -1.645 6.072 -18.442 1.0 96.93 145 A 1 -ATOM 3909 O O . ASP A ? 145 ? -0.493 6.151 -18.011 1.0 97.14 145 A 1 -ATOM 3910 C CB . ASP A ? 145 ? -1.213 5.814 -20.952 1.0 96.67 145 A 1 -ATOM 3911 C CG . ASP A ? 145 ? -1.614 4.335 -21.050 1.0 97.02 145 A 1 -ATOM 3912 O OD1 . ASP A ? 145 ? -2.052 3.745 -20.040 1.0 95.12 145 A 1 -ATOM 3913 O OD2 . ASP A ? 145 ? -1.557 3.749 -22.144 1.0 94.59 145 A 1 -ATOM 3914 N N . GLY A ? 146 ? -2.638 5.556 -17.722 1.0 97.43 146 A 1 -ATOM 3915 C CA . GLY A ? 146 ? -2.472 5.061 -16.360 1.0 97.45 146 A 1 -ATOM 3916 C C . GLY A ? 146 ? -1.520 3.870 -16.232 1.0 97.81 146 A 1 -ATOM 3917 O O . GLY A ? 146 ? -0.891 3.708 -15.187 1.0 97.84 146 A 1 -ATOM 3918 N N . ILE A ? 147 ? -1.350 3.058 -17.278 1.0 97.96 147 A 1 -ATOM 3919 C CA . ILE A ? 147 ? -0.444 1.894 -17.252 1.0 97.89 147 A 1 -ATOM 3920 C C . ILE A ? 147 ? 1.015 2.328 -17.050 1.0 97.82 147 A 1 -ATOM 3921 O O . ILE A ? 147 ? 1.607 1.943 -16.043 1.0 97.87 147 A 1 -ATOM 3922 C CB . ILE A ? 147 ? -0.610 0.987 -18.490 1.0 97.95 147 A 1 -ATOM 3923 C CG1 . ILE A ? 147 ? -2.031 0.393 -18.564 1.0 97.29 147 A 1 -ATOM 3924 C CG2 . ILE A ? 147 ? 0.440 -0.146 -18.468 1.0 97.27 147 A 1 -ATOM 3925 C CD1 . ILE A ? 147 ? -2.310 -0.340 -19.886 1.0 96.29 147 A 1 -ATOM 3926 N N . PRO A ? 148 ? 1.630 3.115 -17.950 1.0 98.17 148 A 1 -ATOM 3927 C CA . PRO A ? 148 ? 2.989 3.590 -17.706 1.0 97.87 148 A 1 -ATOM 3928 C C . PRO A ? 148 ? 3.048 4.530 -16.498 1.0 97.78 148 A 1 -ATOM 3929 O O . PRO A ? 148 ? 3.954 4.389 -15.685 1.0 97.58 148 A 1 -ATOM 3930 C CB . PRO A ? 148 ? 3.431 4.276 -19.003 1.0 97.36 148 A 1 -ATOM 3931 C CG . PRO A ? 148 ? 2.113 4.685 -19.660 1.0 95.6 148 A 1 -ATOM 3932 C CD . PRO A ? 148 ? 1.172 3.563 -19.252 1.0 97.76 148 A 1 -ATOM 3933 N N . ARG A ? 149 ? 2.086 5.435 -16.334 1.0 98.09 149 A 1 -ATOM 3934 C CA . ARG A ? 149 ? 2.122 6.474 -15.290 1.0 97.92 149 A 1 -ATOM 3935 C C . ARG A ? 149 ? 2.214 5.890 -13.883 1.0 97.93 149 A 1 -ATOM 3936 O O . ARG A ? 149 ? 3.105 6.278 -13.125 1.0 97.52 149 A 1 -ATOM 3937 C CB . ARG A ? 149 ? 0.900 7.393 -15.455 1.0 97.76 149 A 1 -ATOM 3938 C CG . ARG A ? 149 ? 0.770 8.473 -14.357 1.0 97.03 149 A 1 -ATOM 3939 C CD . ARG A ? 149 ? 2.010 9.380 -14.269 1.0 95.63 149 A 1 -ATOM 3940 N NE . ARG A ? 149 ? 1.828 10.408 -13.241 1.0 95.2 149 A 1 -ATOM 3941 C CZ . ARG A ? 149 ? 2.775 11.081 -12.622 1.0 94.94 149 A 1 -ATOM 3942 N NH1 . ARG A ? 149 ? 4.040 10.911 -12.909 1.0 90.81 149 A 1 -ATOM 3943 N NH2 . ARG A ? 149 ? 2.462 11.931 -11.693 1.0 91.56 149 A 1 -ATOM 3944 N N . ASP A ? 150 ? 1.309 4.987 -13.534 1.0 98.52 150 A 1 -ATOM 3945 C CA . ASP A ? 150 ? 1.176 4.438 -12.177 1.0 98.48 150 A 1 -ATOM 3946 C C . ASP A ? 150 ? 1.736 3.007 -12.040 1.0 98.43 150 A 1 -ATOM 3947 O O . ASP A ? 150 ? 1.907 2.519 -10.917 1.0 97.89 150 A 1 -ATOM 3948 C CB . ASP A ? 150 ? -0.300 4.497 -11.749 1.0 98.45 150 A 1 -ATOM 3949 C CG . ASP A ? 150 ? -0.846 5.921 -11.553 1.0 98.58 150 A 1 -ATOM 3950 O OD1 . ASP A ? 150 ? -0.060 6.848 -11.252 1.0 97.26 150 A 1 -ATOM 3951 O OD2 . ASP A ? 150 ? -2.080 6.095 -11.656 1.0 97.22 150 A 1 -ATOM 3952 N N . GLY A ? 151 ? 2.062 2.355 -13.156 1.0 98.56 151 A 1 -ATOM 3953 C CA . GLY A ? 151 ? 2.549 0.978 -13.180 1.0 98.45 151 A 1 -ATOM 3954 C C . GLY A ? 151 ? 4.005 0.800 -13.610 1.0 98.52 151 A 1 -ATOM 3955 O O . GLY A ? 151 ? 4.784 0.155 -12.905 1.0 97.9 151 A 1 -ATOM 3956 N N . LEU A ? 152 ? 4.386 1.350 -14.769 1.0 98.54 152 A 1 -ATOM 3957 C CA . LEU A ? 152 ? 5.594 0.927 -15.491 1.0 98.56 152 A 1 -ATOM 3958 C C . LEU A ? 152 ? 6.691 1.991 -15.642 1.0 98.51 152 A 1 -ATOM 3959 O O . LEU A ? 152 ? 7.783 1.657 -16.107 1.0 97.92 152 A 1 -ATOM 3960 C CB . LEU A ? 152 ? 5.196 0.380 -16.874 1.0 98.42 152 A 1 -ATOM 3961 C CG . LEU A ? 152 ? 4.160 -0.763 -16.875 1.0 97.94 152 A 1 -ATOM 3962 C CD1 . LEU A ? 152 ? 3.964 -1.242 -18.312 1.0 97.1 152 A 1 -ATOM 3963 C CD2 . LEU A ? 152 ? 4.592 -1.961 -16.028 1.0 96.8 152 A 1 -ATOM 3964 N N . ASN A ? 153 ? 6.440 3.255 -15.295 1.0 98.37 153 A 1 -ATOM 3965 C CA . ASN A ? 153 ? 7.427 4.332 -15.385 1.0 98.25 153 A 1 -ATOM 3966 C C . ASN A ? 153 ? 8.156 4.513 -14.052 1.0 98.23 153 A 1 -ATOM 3967 O O . ASN A ? 153 ? 7.517 4.744 -13.026 1.0 97.59 153 A 1 -ATOM 3968 C CB . ASN A ? 153 ? 6.756 5.631 -15.853 1.0 97.79 153 A 1 -ATOM 3969 C CG . ASN A ? 153 ? 7.774 6.628 -16.385 1.0 95.21 153 A 1 -ATOM 3970 O OD1 . ASN A ? 153 ? 8.453 6.365 -17.358 1.0 85.5 153 A 1 -ATOM 3971 N ND2 . ASN A ? 153 ? 7.896 7.794 -15.792 1.0 85.07 153 A 1 -ATOM 3972 N N . ASP A ? 154 ? 9.481 4.431 -14.072 1.0 98.19 154 A 1 -ATOM 3973 C CA . ASP A ? 154 ? 10.323 4.842 -12.949 1.0 98.07 154 A 1 -ATOM 3974 C C . ASP A ? 154 ? 10.260 6.370 -12.825 1.0 98.07 154 A 1 -ATOM 3975 O O . ASP A ? 154 ? 10.764 7.097 -13.681 1.0 97.33 154 A 1 -ATOM 3976 C CB . ASP A ? 154 ? 11.759 4.350 -13.164 1.0 97.51 154 A 1 -ATOM 3977 C CG . ASP A ? 154 ? 12.680 4.757 -12.012 1.0 96.59 154 A 1 -ATOM 3978 O OD1 . ASP A ? 154 ? 13.028 5.954 -11.913 1.0 91.51 154 A 1 -ATOM 3979 O OD2 . ASP A ? 154 ? 13.057 3.878 -11.215 1.0 90.97 154 A 1 -ATOM 3980 N N . VAL A ? 155 ? 9.639 6.858 -11.760 1.0 97.86 155 A 1 -ATOM 3981 C CA . VAL A ? 155 ? 9.404 8.295 -11.556 1.0 97.65 155 A 1 -ATOM 3982 C C . VAL A ? 155 ? 10.657 9.068 -11.136 1.0 97.72 155 A 1 -ATOM 3983 O O . VAL A ? 155 ? 10.642 10.293 -11.129 1.0 96.21 155 A 1 -ATOM 3984 C CB . VAL A ? 155 ? 8.279 8.541 -10.530 1.0 96.56 155 A 1 -ATOM 3985 C CG1 . VAL A ? 155 ? 6.969 7.877 -10.962 1.0 91.62 155 A 1 -ATOM 3986 C CG2 . VAL A ? 155 ? 8.656 8.036 -9.127 1.0 91.82 155 A 1 -ATOM 3987 N N . TYR A ? 156 ? 11.731 8.371 -10.755 1.0 97.41 156 A 1 -ATOM 3988 C CA . TYR A ? 156 ? 12.972 8.993 -10.279 1.0 97.11 156 A 1 -ATOM 3989 C C . TYR A ? 156 ? 13.909 9.323 -11.441 1.0 97.21 156 A 1 -ATOM 3990 O O . TYR A ? 156 ? 14.599 10.338 -11.411 1.0 95.26 156 A 1 -ATOM 3991 C CB . TYR A ? 156 ? 13.663 8.065 -9.274 1.0 96.7 156 A 1 -ATOM 3992 C CG . TYR A ? 156 ? 12.743 7.504 -8.205 1.0 97.17 156 A 1 -ATOM 3993 C CD1 . TYR A ? 156 ? 12.387 8.279 -7.080 1.0 95.23 156 A 1 -ATOM 3994 C CD2 . TYR A ? 156 ? 12.185 6.220 -8.368 1.0 95.64 156 A 1 -ATOM 3995 C CE1 . TYR A ? 156 ? 11.482 7.775 -6.131 1.0 95.0 156 A 1 -ATOM 3996 C CE2 . TYR A ? 156 ? 11.275 5.708 -7.428 1.0 94.83 156 A 1 -ATOM 3997 C CZ . TYR A ? 156 ? 10.921 6.489 -6.312 1.0 96.68 156 A 1 -ATOM 3998 O OH . TYR A ? 156 ? 10.017 5.994 -5.409 1.0 95.71 156 A 1 -ATOM 3999 N N . ASN A ? 157 ? 13.918 8.470 -12.462 1.0 97.53 157 A 1 -ATOM 4000 C CA . ASN A ? 157 ? 14.730 8.634 -13.673 1.0 97.34 157 A 1 -ATOM 4001 C C . ASN A ? 157 ? 13.887 8.992 -14.911 1.0 97.76 157 A 1 -ATOM 4002 O O . ASN A ? 157 ? 14.446 9.241 -15.972 1.0 96.65 157 A 1 -ATOM 4003 C CB . ASN A ? 157 ? 15.526 7.342 -13.897 1.0 96.78 157 A 1 -ATOM 4004 C CG . ASN A ? 157 ? 16.383 6.966 -12.697 1.0 95.14 157 A 1 -ATOM 4005 O OD1 . ASN A ? 157 ? 17.474 7.476 -12.503 1.0 87.73 157 A 1 -ATOM 4006 N ND2 . ASN A ? 157 ? 15.908 6.066 -11.860 1.0 86.81 157 A 1 -ATOM 4007 N N . ASP A ? 158 ? 12.566 8.992 -14.768 1.0 97.56 158 A 1 -ATOM 4008 C CA . ASP A ? 158 ? 11.567 9.212 -15.822 1.0 97.84 158 A 1 -ATOM 4009 C C . ASP A ? 158 ? 11.762 8.316 -17.058 1.0 98.13 158 A 1 -ATOM 4010 O O . ASP A ? 158 ? 11.735 8.752 -18.209 1.0 97.56 158 A 1 -ATOM 4011 C CB . ASP A ? 158 ? 11.404 10.715 -16.125 1.0 97.43 158 A 1 -ATOM 4012 C CG . ASP A ? 158 ? 10.086 11.017 -16.848 1.0 96.38 158 A 1 -ATOM 4013 O OD1 . ASP A ? 158 ? 9.099 10.267 -16.622 1.0 93.75 158 A 1 -ATOM 4014 O OD2 . ASP A ? 158 ? 10.038 12.021 -17.594 1.0 92.84 158 A 1 -ATOM 4015 N N . ILE A ? 159 ? 11.975 7.028 -16.801 1.0 98.34 159 A 1 -ATOM 4016 C CA . ILE A ? 159 ? 12.136 5.991 -17.825 1.0 98.42 159 A 1 -ATOM 4017 C C . ILE A ? 159 ? 11.276 4.768 -17.491 1.0 98.57 159 A 1 -ATOM 4018 O O . ILE A ? 159 ? 11.002 4.468 -16.328 1.0 98.35 159 A 1 -ATOM 4019 C CB . ILE A ? 159 ? 13.621 5.606 -18.027 1.0 98.18 159 A 1 -ATOM 4020 C CG1 . ILE A ? 159 ? 14.267 5.057 -16.738 1.0 97.38 159 A 1 -ATOM 4021 C CG2 . ILE A ? 159 ? 14.411 6.793 -18.612 1.0 96.68 159 A 1 -ATOM 4022 C CD1 . ILE A ? 159 ? 15.711 4.570 -16.899 1.0 96.24 159 A 1 -ATOM 4023 N N . LEU A ? 160 ? 10.872 4.014 -18.510 1.0 98.35 160 A 1 -ATOM 4024 C CA . LEU A ? 160 ? 10.102 2.787 -18.319 1.0 98.49 160 A 1 -ATOM 4025 C C . LEU A ? 160 ? 10.946 1.680 -17.663 1.0 98.57 160 A 1 -ATOM 4026 O O . LEU A ? 160 ? 12.166 1.633 -17.812 1.0 98.46 160 A 1 -ATOM 4027 C CB . LEU A ? 160 ? 9.523 2.325 -19.667 1.0 98.44 160 A 1 -ATOM 4028 C CG . LEU A ? 160 ? 8.449 3.263 -20.260 1.0 98.07 160 A 1 -ATOM 4029 C CD1 . LEU A ? 160 ? 8.095 2.808 -21.673 1.0 97.19 160 A 1 -ATOM 4030 C CD2 . LEU A ? 160 ? 7.159 3.263 -19.432 1.0 97.0 160 A 1 -ATOM 4031 N N . MET A ? 161 ? 10.276 0.730 -17.013 1.0 98.63 161 A 1 -ATOM 4032 C CA . MET A ? 161 ? 10.921 -0.444 -16.408 1.0 98.64 161 A 1 -ATOM 4033 C C . MET A ? 161 ? 11.854 -1.185 -17.383 1.0 98.73 161 A 1 -ATOM 4034 O O . MET A ? 161 ? 12.929 -1.626 -16.993 1.0 98.7 161 A 1 -ATOM 4035 C CB . MET A ? 161 ? 9.844 -1.416 -15.900 1.0 98.6 161 A 1 -ATOM 4036 C CG . MET A ? 161 ? 8.964 -0.878 -14.764 1.0 97.91 161 A 1 -ATOM 4037 S SD . MET A ? 161 ? 9.791 -0.579 -13.170 1.0 97.72 161 A 1 -ATOM 4038 C CE . MET A ? 161 ? 10.313 1.145 -13.370 1.0 94.54 161 A 1 -ATOM 4039 N N . GLY A ? 162 ? 11.480 -1.274 -18.649 1.0 98.71 162 A 1 -ATOM 4040 C CA . GLY A ? 162 ? 12.318 -1.901 -19.677 1.0 98.77 162 A 1 -ATOM 4041 C C . GLY A ? 162 ? 13.638 -1.163 -19.931 1.0 98.83 162 A 1 -ATOM 4042 O O . GLY A ? 162 ? 14.659 -1.807 -20.149 1.0 98.73 162 A 1 -ATOM 4043 N N . ALA A ? 163 ? 13.654 0.171 -19.830 1.0 98.75 163 A 1 -ATOM 4044 C CA . ALA A ? 163 ? 14.887 0.958 -19.928 1.0 98.75 163 A 1 -ATOM 4045 C C . ALA A ? 163 ? 15.780 0.777 -18.685 1.0 98.78 163 A 1 -ATOM 4046 O O . ALA A ? 163 ? 17.004 0.732 -18.799 1.0 98.63 163 A 1 -ATOM 4047 C CB . ALA A ? 163 ? 14.512 2.426 -20.165 1.0 98.69 163 A 1 -ATOM 4048 N N . CYS A ? 164 ? 15.183 0.589 -17.507 1.0 98.76 164 A 1 -ATOM 4049 C CA . CYS A ? 164 ? 15.920 0.184 -16.308 1.0 98.74 164 A 1 -ATOM 4050 C C . CYS A ? 164 ? 16.562 -1.207 -16.490 1.0 98.79 164 A 1 -ATOM 4051 O O . CYS A ? 164 ? 17.719 -1.408 -16.121 1.0 98.71 164 A 1 -ATOM 4052 C CB . CYS A ? 164 ? 14.982 0.180 -15.090 1.0 98.69 164 A 1 -ATOM 4053 S SG . CYS A ? 164 ? 14.187 1.790 -14.817 1.0 98.4 164 A 1 -ATOM 4054 N N . ALA A ? 165 ? 15.835 -2.149 -17.104 1.0 98.77 165 A 1 -ATOM 4055 C CA . ALA A ? 165 ? 16.361 -3.480 -17.414 1.0 98.8 165 A 1 -ATOM 4056 C C . ALA A ? 165 ? 17.511 -3.430 -18.439 1.0 98.82 165 A 1 -ATOM 4057 O O . ALA A ? 165 ? 18.512 -4.121 -18.254 1.0 98.75 165 A 1 -ATOM 4058 C CB . ALA A ? 165 ? 15.207 -4.370 -17.885 1.0 98.76 165 A 1 -ATOM 4059 N N . ASP A ? 166 ? 17.422 -2.570 -19.461 1.0 98.79 166 A 1 -ATOM 4060 C CA . ASP A ? 166 ? 18.516 -2.318 -20.415 1.0 98.77 166 A 1 -ATOM 4061 C C . ASP A ? 166 ? 19.790 -1.832 -19.705 1.0 98.75 166 A 1 -ATOM 4062 O O . ASP A ? 166 ? 20.888 -2.319 -19.986 1.0 98.59 166 A 1 -ATOM 4063 C CB . ASP A ? 166 ? 18.090 -1.257 -21.450 1.0 98.66 166 A 1 -ATOM 4064 C CG . ASP A ? 166 ? 17.261 -1.790 -22.619 1.0 98.52 166 A 1 -ATOM 4065 O OD1 . ASP A ? 166 ? 17.405 -2.982 -22.970 1.0 96.69 166 A 1 -ATOM 4066 O OD2 . ASP A ? 166 ? 16.559 -0.971 -23.255 1.0 96.98 166 A 1 -ATOM 4067 N N . LYS A ? 167 ? 19.652 -0.902 -18.744 1.0 98.72 167 A 1 -ATOM 4068 C CA . LYS A ? 167 ? 20.776 -0.407 -17.940 1.0 98.6 167 A 1 -ATOM 4069 C C . LYS A ? 167 ? 21.430 -1.538 -17.141 1.0 98.67 167 A 1 -ATOM 4070 O O . LYS A ? 167 ? 22.653 -1.674 -17.169 1.0 98.4 167 A 1 -ATOM 4071 C CB . LYS A ? 167 ? 20.292 0.758 -17.055 1.0 98.23 167 A 1 -ATOM 4072 C CG . LYS A ? 167 ? 21.382 1.365 -16.142 1.0 96.46 167 A 1 -ATOM 4073 C CD . LYS A ? 167 ? 21.375 0.752 -14.727 1.0 92.74 167 A 1 -ATOM 4074 C CE . LYS A ? 167 ? 22.428 1.401 -13.827 1.0 90.06 167 A 1 -ATOM 4075 N NZ . LYS A ? 167 ? 22.345 0.913 -12.435 1.0 85.08 167 A 1 -ATOM 4076 N N . VAL A ? 168 ? 20.639 -2.362 -16.463 1.0 98.7 168 A 1 -ATOM 4077 C CA . VAL A ? 168 ? 21.140 -3.515 -15.693 1.0 98.71 168 A 1 -ATOM 4078 C C . VAL A ? 168 ? 21.850 -4.512 -16.612 1.0 98.75 168 A 1 -ATOM 4079 O O . VAL A ? 168 ? 22.973 -4.918 -16.319 1.0 98.65 168 A 1 -ATOM 4080 C CB . VAL A ? 168 ? 20.000 -4.184 -14.897 1.0 98.58 168 A 1 -ATOM 4081 C CG1 . VAL A ? 168 ? 20.422 -5.510 -14.249 1.0 97.78 168 A 1 -ATOM 4082 C CG2 . VAL A ? 168 ? 19.520 -3.261 -13.766 1.0 97.83 168 A 1 -ATOM 4083 N N . ALA A ? 169 ? 21.249 -4.849 -17.757 1.0 98.79 169 A 1 -ATOM 4084 C CA . ALA A ? 169 ? 21.848 -5.762 -18.728 1.0 98.8 169 A 1 -ATOM 4085 C C . ALA A ? 169 ? 23.216 -5.263 -19.222 1.0 98.76 169 A 1 -ATOM 4086 O O . ALA A ? 169 ? 24.183 -6.027 -19.247 1.0 98.58 169 A 1 -ATOM 4087 C CB . ALA A ? 169 ? 20.872 -5.940 -19.895 1.0 98.74 169 A 1 -ATOM 4088 N N . LYS A ? 170 ? 23.319 -3.973 -19.541 1.0 98.71 170 A 1 -ATOM 4089 C CA . LYS A ? 170 ? 24.567 -3.348 -20.002 1.0 98.6 170 A 1 -ATOM 4090 C C . LYS A ? 170 ? 25.624 -3.308 -18.896 1.0 98.55 170 A 1 -ATOM 4091 O O . LYS A ? 170 ? 26.779 -3.640 -19.142 1.0 98.1 170 A 1 -ATOM 4092 C CB . LYS A ? 170 ? 24.241 -1.953 -20.572 1.0 98.27 170 A 1 -ATOM 4093 C CG . LYS A ? 170 ? 25.358 -1.378 -21.473 1.0 93.94 170 A 1 -ATOM 4094 C CD . LYS A ? 170 ? 24.884 -0.085 -22.166 1.0 88.74 170 A 1 -ATOM 4095 C CE . LYS A ? 170 ? 25.890 0.410 -23.225 1.0 77.86 170 A 1 -ATOM 4096 N NZ . LYS A ? 170 ? 25.357 1.532 -24.060 1.0 67.82 170 A 1 -ATOM 4097 N N . GLN A ? 171 ? 25.227 -2.947 -17.679 1.0 98.55 171 A 1 -ATOM 4098 C CA . GLN A ? 171 ? 26.142 -2.843 -16.536 1.0 98.4 171 A 1 -ATOM 4099 C C . GLN A ? 171 ? 26.736 -4.197 -16.121 1.0 98.39 171 A 1 -ATOM 4100 O O . GLN A ? 171 ? 27.913 -4.272 -15.771 1.0 97.81 171 A 1 -ATOM 4101 C CB . GLN A ? 171 ? 25.397 -2.180 -15.368 1.0 98.1 171 A 1 -ATOM 4102 C CG . GLN A ? 171 ? 26.302 -2.005 -14.131 1.0 96.15 171 A 1 -ATOM 4103 C CD . GLN A ? 171 ? 25.624 -1.260 -12.982 1.0 95.34 171 A 1 -ATOM 4104 O OE1 . GLN A ? 171 ? 24.561 -0.673 -13.106 1.0 89.54 171 A 1 -ATOM 4105 N NE2 . GLN A ? 171 ? 26.220 -1.242 -11.817 1.0 88.18 171 A 1 -ATOM 4106 N N . PHE A ? 172 ? 25.944 -5.260 -16.162 1.0 98.53 172 A 1 -ATOM 4107 C CA . PHE A ? 172 ? 26.339 -6.594 -15.701 1.0 98.39 172 A 1 -ATOM 4108 C C . PHE A ? 172 ? 26.610 -7.584 -16.843 1.0 98.37 172 A 1 -ATOM 4109 O O . PHE A ? 172 ? 26.688 -8.790 -16.608 1.0 97.63 172 A 1 -ATOM 4110 C CB . PHE A ? 172 ? 25.306 -7.103 -14.693 1.0 98.22 172 A 1 -ATOM 4111 C CG . PHE A ? 172 ? 25.208 -6.250 -13.446 1.0 97.99 172 A 1 -ATOM 4112 C CD1 . PHE A ? 172 ? 26.223 -6.300 -12.472 1.0 96.29 172 A 1 -ATOM 4113 C CD2 . PHE A ? 172 ? 24.110 -5.391 -13.253 1.0 96.47 172 A 1 -ATOM 4114 C CE1 . PHE A ? 172 ? 26.140 -5.506 -11.318 1.0 95.35 172 A 1 -ATOM 4115 C CE2 . PHE A ? 172 ? 24.022 -4.590 -12.099 1.0 95.33 172 A 1 -ATOM 4116 C CZ . PHE A ? 172 ? 25.038 -4.648 -11.130 1.0 95.89 172 A 1 -ATOM 4117 N N . ALA A ? 173 ? 26.778 -7.084 -18.074 1.0 98.38 173 A 1 -ATOM 4118 C CA . ALA A ? 173 ? 27.103 -7.867 -19.270 1.0 98.32 173 A 1 -ATOM 4119 C C . ALA A ? 173 ? 26.150 -9.059 -19.522 1.0 98.47 173 A 1 -ATOM 4120 O O . ALA A ? 173 ? 26.581 -10.135 -19.937 1.0 97.65 173 A 1 -ATOM 4121 C CB . ALA A ? 173 ? 28.596 -8.228 -19.244 1.0 97.77 173 A 1 -ATOM 4122 N N . ILE A ? 174 ? 24.857 -8.872 -19.295 1.0 98.66 174 A 1 -ATOM 4123 C CA . ILE A ? 174 ? 23.815 -9.832 -19.681 1.0 98.75 174 A 1 -ATOM 4124 C C . ILE A ? 174 ? 23.456 -9.568 -21.148 1.0 98.78 174 A 1 -ATOM 4125 O O . ILE A ? 174 ? 22.709 -8.643 -21.468 1.0 98.55 174 A 1 -ATOM 4126 C CB . ILE A ? 174 ? 22.584 -9.750 -18.753 1.0 98.64 174 A 1 -ATOM 4127 C CG1 . ILE A ? 174 ? 22.922 -9.792 -17.245 1.0 97.36 174 A 1 -ATOM 4128 C CG2 . ILE A ? 174 ? 21.585 -10.866 -19.112 1.0 98.08 174 A 1 -ATOM 4129 C CD1 . ILE A ? 174 ? 23.599 -11.068 -16.753 1.0 91.97 174 A 1 -ATOM 4130 N N . THR A ? 175 ? 24.010 -10.356 -22.053 1.0 98.65 175 A 1 -ATOM 4131 C CA . THR A ? 175 ? 23.953 -10.098 -23.496 1.0 98.65 175 A 1 -ATOM 4132 C C . THR A ? 175 ? 22.553 -10.281 -24.082 1.0 98.76 175 A 1 -ATOM 4133 O O . THR A ? 175 ? 21.686 -10.952 -23.517 1.0 98.62 175 A 1 -ATOM 4134 C CB . THR A ? 175 ? 24.950 -10.973 -24.270 1.0 98.35 175 A 1 -ATOM 4135 O OG1 . THR A ? 175 ? 24.587 -12.326 -24.172 1.0 96.37 175 A 1 -ATOM 4136 C CG2 . THR A ? 175 ? 26.390 -10.816 -23.776 1.0 95.81 175 A 1 -ATOM 4137 N N . ARG A ? 176 ? 22.327 -9.707 -25.269 1.0 98.58 176 A 1 -ATOM 4138 C CA . ARG A ? 176 ? 21.106 -9.906 -26.052 1.0 98.64 176 A 1 -ATOM 4139 C C . ARG A ? 176 ? 20.885 -11.384 -26.386 1.0 98.76 176 A 1 -ATOM 4140 O O . ARG A ? 176 ? 19.767 -11.865 -26.221 1.0 98.63 176 A 1 -ATOM 4141 C CB . ARG A ? 176 ? 21.178 -9.030 -27.310 1.0 98.14 176 A 1 -ATOM 4142 C CG . ARG A ? 176 ? 20.049 -9.291 -28.313 1.0 96.58 176 A 1 -ATOM 4143 C CD . ARG A ? 176 ? 18.646 -9.019 -27.754 1.0 95.2 176 A 1 -ATOM 4144 N NE . ARG A ? 176 ? 17.635 -9.402 -28.736 1.0 94.98 176 A 1 -ATOM 4145 C CZ . ARG A ? 176 ? 17.210 -8.705 -29.785 1.0 96.37 176 A 1 -ATOM 4146 N NH1 . ARG A ? 176 ? 17.599 -7.485 -30.021 1.0 91.74 176 A 1 -ATOM 4147 N NH2 . ARG A ? 176 ? 16.391 -9.260 -30.617 1.0 93.42 176 A 1 -ATOM 4148 N N . GLU A ? 177 ? 21.941 -12.095 -26.810 1.0 98.66 177 A 1 -ATOM 4149 C CA . GLU A ? 177 ? 21.853 -13.534 -27.090 1.0 98.64 177 A 1 -ATOM 4150 C C . GLU A ? 177 ? 21.413 -14.340 -25.865 1.0 98.76 177 A 1 -ATOM 4151 O O . GLU A ? 177 ? 20.580 -15.231 -25.992 1.0 98.6 177 A 1 -ATOM 4152 C CB . GLU A ? 177 ? 23.198 -14.100 -27.569 1.0 98.26 177 A 1 -ATOM 4153 C CG . GLU A ? 177 ? 23.463 -13.921 -29.069 1.0 84.07 177 A 1 -ATOM 4154 C CD . GLU A ? 177 ? 24.264 -12.675 -29.445 1.0 76.26 177 A 1 -ATOM 4155 O OE1 . GLU A ? 177 ? 24.463 -12.496 -30.671 1.0 69.55 177 A 1 -ATOM 4156 O OE2 . GLU A ? 177 ? 24.649 -11.900 -28.534 1.0 69.86 177 A 1 -ATOM 4157 N N . GLU A ? 178 ? 21.944 -14.040 -24.679 1.0 98.74 178 A 1 -ATOM 4158 C CA . GLU A ? 178 ? 21.550 -14.735 -23.448 1.0 98.72 178 A 1 -ATOM 4159 C C . GLU A ? 178 ? 20.077 -14.485 -23.102 1.0 98.82 178 A 1 -ATOM 4160 O O . GLU A ? 178 ? 19.359 -15.429 -22.770 1.0 98.72 178 A 1 -ATOM 4161 C CB . GLU A ? 178 ? 22.439 -14.292 -22.279 1.0 98.46 178 A 1 -ATOM 4162 C CG . GLU A ? 178 ? 23.859 -14.872 -22.364 1.0 94.16 178 A 1 -ATOM 4163 C CD . GLU A ? 178 ? 24.724 -14.357 -21.207 1.0 94.34 178 A 1 -ATOM 4164 O OE1 . GLU A ? 178 ? 25.343 -15.192 -20.509 1.0 86.49 178 A 1 -ATOM 4165 O OE2 . GLU A ? 178 ? 24.761 -13.133 -20.952 1.0 88.71 178 A 1 -ATOM 4166 N N . GLN A ? 179 ? 19.617 -13.241 -23.228 1.0 98.85 179 A 1 -ATOM 4167 C CA . GLN A ? 179 ? 18.223 -12.873 -22.964 1.0 98.87 179 A 1 -ATOM 4168 C C . GLN A ? 179 ? 17.262 -13.559 -23.941 1.0 98.89 179 A 1 -ATOM 4169 O O . GLN A ? 179 ? 16.252 -14.118 -23.521 1.0 98.84 179 A 1 -ATOM 4170 C CB . GLN A ? 179 ? 18.061 -11.349 -23.034 1.0 98.84 179 A 1 -ATOM 4171 C CG . GLN A ? 179 ? 18.747 -10.618 -21.873 1.0 98.66 179 A 1 -ATOM 4172 C CD . GLN A ? 179 ? 18.700 -9.109 -22.060 1.0 98.66 179 A 1 -ATOM 4173 O OE1 . GLN A ? 179 ? 17.650 -8.499 -22.201 1.0 93.23 179 A 1 -ATOM 4174 N NE2 . GLN A ? 179 ? 19.833 -8.452 -22.086 1.0 93.39 179 A 1 -ATOM 4175 N N . ASP A ? 180 ? 17.588 -13.567 -25.239 1.0 98.82 180 A 1 -ATOM 4176 C CA . ASP A ? 180 ? 16.765 -14.223 -26.260 1.0 98.81 180 A 1 -ATOM 4177 C C . ASP A ? 180 ? 16.755 -15.750 -26.080 1.0 98.8 180 A 1 -ATOM 4178 O O . ASP A ? 180 ? 15.709 -16.388 -26.189 1.0 98.65 180 A 1 -ATOM 4179 C CB . ASP A ? 180 ? 17.271 -13.841 -27.664 1.0 98.73 180 A 1 -ATOM 4180 C CG . ASP A ? 180 ? 16.930 -12.409 -28.108 1.0 98.68 180 A 1 -ATOM 4181 O OD1 . ASP A ? 180 ? 16.195 -11.682 -27.406 1.0 97.6 180 A 1 -ATOM 4182 O OD2 . ASP A ? 180 ? 17.350 -12.019 -29.221 1.0 97.64 180 A 1 -ATOM 4183 N N . LYS A ? 181 ? 17.902 -16.348 -25.745 1.0 98.82 181 A 1 -ATOM 4184 C CA . LYS A ? 181 ? 18.006 -17.784 -25.461 1.0 98.77 181 A 1 -ATOM 4185 C C . LYS A ? 181 ? 17.169 -18.176 -24.239 1.0 98.82 181 A 1 -ATOM 4186 O O . LYS A ? 181 ? 16.477 -19.192 -24.272 1.0 98.67 181 A 1 -ATOM 4187 C CB . LYS A ? 181 ? 19.488 -18.140 -25.280 1.0 98.4 181 A 1 -ATOM 4188 C CG . LYS A ? 181 ? 19.752 -19.650 -25.357 1.0 89.41 181 A 1 -ATOM 4189 C CD . LYS A ? 181 ? 21.251 -19.906 -25.162 1.0 86.56 181 A 1 -ATOM 4190 C CE . LYS A ? 181 ? 21.571 -21.397 -25.286 1.0 72.61 181 A 1 -ATOM 4191 N NZ . LYS A ? 181 ? 22.993 -21.663 -24.956 1.0 64.79 181 A 1 -ATOM 4192 N N . TYR A ? 182 ? 17.196 -17.352 -23.189 1.0 98.83 182 A 1 -ATOM 4193 C CA . TYR A ? 182 ? 16.360 -17.554 -22.004 1.0 98.86 182 A 1 -ATOM 4194 C C . TYR A ? 182 ? 14.866 -17.395 -22.324 1.0 98.89 182 A 1 -ATOM 4195 O O . TYR A ? 182 ? 14.065 -18.223 -21.903 1.0 98.83 182 A 1 -ATOM 4196 C CB . TYR A ? 182 ? 16.799 -16.593 -20.894 1.0 98.81 182 A 1 -ATOM 4197 C CG . TYR A ? 182 ? 16.067 -16.859 -19.598 1.0 98.82 182 A 1 -ATOM 4198 C CD1 . TYR A ? 182 ? 14.800 -16.293 -19.366 1.0 98.58 182 A 1 -ATOM 4199 C CD2 . TYR A ? 182 ? 16.608 -17.753 -18.650 1.0 98.6 182 A 1 -ATOM 4200 C CE1 . TYR A ? 182 ? 14.071 -16.631 -18.215 1.0 98.41 182 A 1 -ATOM 4201 C CE2 . TYR A ? 182 ? 15.888 -18.099 -17.495 1.0 98.35 182 A 1 -ATOM 4202 C CZ . TYR A ? 182 ? 14.611 -17.543 -17.288 1.0 98.53 182 A 1 -ATOM 4203 O OH . TYR A ? 182 ? 13.884 -17.913 -16.188 1.0 98.0 182 A 1 -ATOM 4204 N N . ALA A ? 183 ? 14.496 -16.391 -23.120 1.0 98.87 183 A 1 -ATOM 4205 C CA . ALA A ? 183 ? 13.114 -16.204 -23.559 1.0 98.87 183 A 1 -ATOM 4206 C C . ALA A ? 183 ? 12.602 -17.426 -24.339 1.0 98.87 183 A 1 -ATOM 4207 O O . ALA A ? 183 ? 11.532 -17.952 -24.038 1.0 98.81 183 A 1 -ATOM 4208 C CB . ALA A ? 183 ? 13.031 -14.922 -24.393 1.0 98.82 183 A 1 -ATOM 4209 N N . ILE A ? 184 ? 13.394 -17.945 -25.279 1.0 98.84 184 A 1 -ATOM 4210 C CA . ILE A ? 184 ? 13.077 -19.180 -26.016 1.0 98.8 184 A 1 -ATOM 4211 C C . ILE A ? 184 ? 12.887 -20.360 -25.052 1.0 98.81 184 A 1 -ATOM 4212 O O . ILE A ? 184 ? 11.957 -21.150 -25.229 1.0 98.67 184 A 1 -ATOM 4213 C CB . ILE A ? 184 ? 14.178 -19.474 -27.065 1.0 98.67 184 A 1 -ATOM 4214 C CG1 . ILE A ? 184 ? 14.104 -18.441 -28.218 1.0 98.07 184 A 1 -ATOM 4215 C CG2 . ILE A ? 184 ? 14.068 -20.906 -27.634 1.0 98.21 184 A 1 -ATOM 4216 C CD1 . ILE A ? 184 ? 15.344 -18.425 -29.126 1.0 95.75 184 A 1 -ATOM 4217 N N . LEU A ? 185 ? 13.746 -20.486 -24.034 1.0 98.74 185 A 1 -ATOM 4218 C CA . LEU A ? 185 ? 13.623 -21.525 -23.013 1.0 98.73 185 A 1 -ATOM 4219 C C . LEU A ? 185 ? 12.317 -21.375 -22.219 1.0 98.81 185 A 1 -ATOM 4220 O O . LEU A ? 185 ? 11.609 -22.365 -22.047 1.0 98.74 185 A 1 -ATOM 4221 C CB . LEU A ? 185 ? 14.865 -21.488 -22.106 1.0 98.58 185 A 1 -ATOM 4222 C CG . LEU A ? 185 ? 14.878 -22.562 -21.002 1.0 97.36 185 A 1 -ATOM 4223 C CD1 . LEU A ? 185 ? 14.929 -23.978 -21.576 1.0 95.37 185 A 1 -ATOM 4224 C CD2 . LEU A ? 185 ? 16.102 -22.354 -20.113 1.0 95.42 185 A 1 -ATOM 4225 N N . SER A ? 186 ? 11.962 -20.159 -21.806 1.0 98.8 186 A 1 -ATOM 4226 C CA . SER A ? 186 ? 10.705 -19.864 -21.110 1.0 98.85 186 A 1 -ATOM 4227 C C . SER A ? 186 ? 9.490 -20.285 -21.948 1.0 98.87 186 A 1 -ATOM 4228 O O . SER A ? 186 ? 8.653 -21.051 -21.472 1.0 98.83 186 A 1 -ATOM 4229 C CB . SER A ? 186 ? 10.644 -18.372 -20.750 1.0 98.85 186 A 1 -ATOM 4230 O OG . SER A ? 186 ? 9.528 -18.113 -19.916 1.0 98.57 186 A 1 -ATOM 4231 N N . TYR A ? 187 ? 9.435 -19.899 -23.221 1.0 98.86 187 A 1 -ATOM 4232 C CA . TYR A ? 187 ? 8.348 -20.290 -24.135 1.0 98.84 187 A 1 -ATOM 4233 C C . TYR A ? 187 ? 8.269 -21.808 -24.360 1.0 98.82 187 A 1 -ATOM 4234 O O . TYR A ? 187 ? 7.175 -22.365 -24.429 1.0 98.64 187 A 1 -ATOM 4235 C CB . TYR A ? 187 ? 8.507 -19.571 -25.480 1.0 98.78 187 A 1 -ATOM 4236 C CG . TYR A ? 187 ? 7.938 -18.168 -25.499 1.0 98.7 187 A 1 -ATOM 4237 C CD1 . TYR A ? 187 ? 6.545 -17.974 -25.576 1.0 97.93 187 A 1 -ATOM 4238 C CD2 . TYR A ? 187 ? 8.787 -17.045 -25.440 1.0 98.15 187 A 1 -ATOM 4239 C CE1 . TYR A ? 187 ? 6.006 -16.678 -25.585 1.0 97.79 187 A 1 -ATOM 4240 C CE2 . TYR A ? 187 ? 8.259 -15.742 -25.446 1.0 97.63 187 A 1 -ATOM 4241 C CZ . TYR A ? 187 ? 6.866 -15.562 -25.516 1.0 97.98 187 A 1 -ATOM 4242 O OH . TYR A ? 187 ? 6.345 -14.292 -25.507 1.0 96.85 187 A 1 -ATOM 4243 N N . LYS A ? 188 ? 9.411 -22.498 -24.461 1.0 98.77 188 A 1 -ATOM 4244 C CA . LYS A ? 188 ? 9.427 -23.965 -24.593 1.0 98.72 188 A 1 -ATOM 4245 C C . LYS A ? 188 ? 8.937 -24.652 -23.318 1.0 98.77 188 A 1 -ATOM 4246 O O . LYS A ? 188 ? 8.170 -25.611 -23.404 1.0 98.58 188 A 1 -ATOM 4247 C CB . LYS A ? 188 ? 10.828 -24.452 -24.979 1.0 98.62 188 A 1 -ATOM 4248 C CG . LYS A ? 188 ? 11.137 -24.156 -26.457 1.0 97.04 188 A 1 -ATOM 4249 C CD . LYS A ? 188 ? 12.538 -24.656 -26.823 1.0 91.84 188 A 1 -ATOM 4250 C CE . LYS A ? 188 ? 12.792 -24.400 -28.311 1.0 87.49 188 A 1 -ATOM 4251 N NZ . LYS A ? 188 ? 14.123 -24.891 -28.744 1.0 77.85 188 A 1 -ATOM 4252 N N . ARG A ? 189 ? 9.343 -24.158 -22.154 1.0 98.85 189 A 1 -ATOM 4253 C CA . ARG A ? 189 ? 8.938 -24.702 -20.850 1.0 98.86 189 A 1 -ATOM 4254 C C . ARG A ? 189 ? 7.449 -24.483 -20.572 1.0 98.88 189 A 1 -ATOM 4255 O O . ARG A ? 189 ? 6.782 -25.435 -20.176 1.0 98.75 189 A 1 -ATOM 4256 C CB . ARG A ? 189 ? 9.794 -24.075 -19.747 1.0 98.69 189 A 1 -ATOM 4257 C CG . ARG A ? 189 ? 11.209 -24.672 -19.690 1.0 98.13 189 A 1 -ATOM 4258 C CD . ARG A ? 189 ? 12.027 -23.903 -18.655 1.0 97.17 189 A 1 -ATOM 4259 N NE . ARG A ? 189 ? 13.301 -24.574 -18.320 1.0 95.67 189 A 1 -ATOM 4260 C CZ . ARG A ? 189 ? 14.187 -24.128 -17.447 1.0 95.37 189 A 1 -ATOM 4261 N NH1 . ARG A ? 189 ? 14.046 -22.983 -16.844 1.0 90.41 189 A 1 -ATOM 4262 N NH2 . ARG A ? 189 ? 15.232 -24.835 -17.149 1.0 91.04 189 A 1 -ATOM 4263 N N . SER A ? 190 ? 6.917 -23.294 -20.827 1.0 98.88 190 A 1 -ATOM 4264 C CA . SER A ? 190 ? 5.486 -23.019 -20.644 1.0 98.85 190 A 1 -ATOM 4265 C C . SER A ? 190 ? 4.612 -23.846 -21.591 1.0 98.87 190 A 1 -ATOM 4266 O O . SER A ? 190 ? 3.625 -24.435 -21.153 1.0 98.71 190 A 1 -ATOM 4267 C CB . SER A ? 190 ? 5.194 -21.523 -20.794 1.0 98.54 190 A 1 -ATOM 4268 O OG . SER A ? 190 ? 5.606 -21.040 -22.055 1.0 91.0 190 A 1 -ATOM 4269 N N . ALA A ? 191 ? 5.013 -23.985 -22.859 1.0 98.77 191 A 1 -ATOM 4270 C CA . ALA A ? 191 ? 4.306 -24.835 -23.818 1.0 98.71 191 A 1 -ATOM 4271 C C . ALA A ? 191 ? 4.324 -26.320 -23.404 1.0 98.73 191 A 1 -ATOM 4272 O O . ALA A ? 191 ? 3.303 -26.998 -23.511 1.0 98.53 191 A 1 -ATOM 4273 C CB . ALA A ? 191 ? 4.921 -24.632 -25.208 1.0 98.51 191 A 1 -ATOM 4274 N N . ALA A ? 192 ? 5.459 -26.819 -22.909 1.0 98.72 192 A 1 -ATOM 4275 C CA . ALA A ? 192 ? 5.552 -28.181 -22.384 1.0 98.71 192 A 1 -ATOM 4276 C C . ALA A ? 192 ? 4.668 -28.368 -21.140 1.0 98.72 192 A 1 -ATOM 4277 O O . ALA A ? 192 ? 3.911 -29.335 -21.078 1.0 98.5 192 A 1 -ATOM 4278 C CB . ALA A ? 192 ? 7.023 -28.509 -22.103 1.0 98.63 192 A 1 -ATOM 4279 N N . ALA A ? 193 ? 4.697 -27.415 -20.201 1.0 98.8 193 A 1 -ATOM 4280 C CA . ALA A ? 193 ? 3.880 -27.449 -18.989 1.0 98.79 193 A 1 -ATOM 4281 C C . ALA A ? 193 ? 2.374 -27.471 -19.302 1.0 98.77 193 A 1 -ATOM 4282 O O . ALA A ? 193 ? 1.641 -28.285 -18.739 1.0 98.55 193 A 1 -ATOM 4283 C CB . ALA A ? 193 ? 4.254 -26.240 -18.125 1.0 98.71 193 A 1 -ATOM 4284 N N . TRP A ? 194 ? 1.917 -26.641 -20.237 1.0 98.73 194 A 1 -ATOM 4285 C CA . TRP A ? 194 ? 0.528 -26.662 -20.707 1.0 98.67 194 A 1 -ATOM 4286 C C . TRP A ? 194 ? 0.158 -27.990 -21.370 1.0 98.54 194 A 1 -ATOM 4287 O O . TRP A ? 194 ? -0.889 -28.559 -21.076 1.0 98.01 194 A 1 -ATOM 4288 C CB . TRP A ? 194 ? 0.285 -25.478 -21.648 1.0 98.56 194 A 1 -ATOM 4289 C CG . TRP A ? 194 ? -0.255 -24.280 -20.933 1.0 98.46 194 A 1 -ATOM 4290 C CD1 . TRP A ? 194 ? 0.418 -23.155 -20.608 1.0 97.77 194 A 1 -ATOM 4291 C CD2 . TRP A ? 194 ? -1.597 -24.130 -20.378 1.0 98.35 194 A 1 -ATOM 4292 N NE1 . TRP A ? 194 ? -0.406 -22.307 -19.883 1.0 97.66 194 A 1 -ATOM 4293 C CE2 . TRP A ? 194 ? -1.648 -22.879 -19.699 1.0 97.87 194 A 1 -ATOM 4294 C CE3 . TRP A ? 194 ? -2.751 -24.940 -20.358 1.0 97.71 194 A 1 -ATOM 4295 C CZ2 . TRP A ? 194 ? -2.795 -22.463 -18.989 1.0 97.07 194 A 1 -ATOM 4296 C CZ3 . TRP A ? 194 ? -3.902 -24.521 -19.658 1.0 96.83 194 A 1 -ATOM 4297 C CH2 . TRP A ? 194 ? -3.914 -23.304 -18.970 1.0 96.71 194 A 1 -ATOM 4298 N N . LYS A ? 195 ? 1.048 -28.530 -22.223 1.0 98.37 195 A 1 -ATOM 4299 C CA . LYS A ? 195 ? 0.831 -29.810 -22.905 1.0 98.22 195 A 1 -ATOM 4300 C C . LYS A ? 195 ? 0.735 -30.989 -21.931 1.0 98.16 195 A 1 -ATOM 4301 O O . LYS A ? 195 ? -0.034 -31.915 -22.178 1.0 97.55 195 A 1 -ATOM 4302 C CB . LYS A ? 195 ? 1.958 -30.008 -23.923 1.0 97.98 195 A 1 -ATOM 4303 C CG . LYS A ? 195 ? 1.698 -31.214 -24.839 1.0 93.7 195 A 1 -ATOM 4304 C CD . LYS A ? 195 ? 2.851 -31.377 -25.830 1.0 89.13 195 A 1 -ATOM 4305 C CE . LYS A ? 195 ? 2.578 -32.593 -26.719 1.0 78.99 195 A 1 -ATOM 4306 N NZ . LYS A ? 195 ? 3.714 -32.864 -27.624 1.0 70.35 195 A 1 -ATOM 4307 N N . GLU A ? 196 ? 1.488 -30.947 -20.835 1.0 98.52 196 A 1 -ATOM 4308 C CA . GLU A ? 196 ? 1.470 -31.971 -19.780 1.0 98.33 196 A 1 -ATOM 4309 C C . GLU A ? 196 ? 0.358 -31.757 -18.734 1.0 98.29 196 A 1 -ATOM 4310 O O . GLU A ? 196 ? 0.194 -32.573 -17.830 1.0 97.35 196 A 1 -ATOM 4311 C CB . GLU A ? 196 ? 2.850 -32.067 -19.111 1.0 97.93 196 A 1 -ATOM 4312 C CG . GLU A ? 196 ? 3.949 -32.521 -20.085 1.0 91.82 196 A 1 -ATOM 4313 C CD . GLU A ? 196 ? 4.916 -33.563 -19.519 1.0 83.73 196 A 1 -ATOM 4314 O OE1 . GLU A ? 196 ? 5.605 -34.201 -20.353 1.0 73.65 196 A 1 -ATOM 4315 O OE2 . GLU A ? 196 ? 4.943 -33.770 -18.280 1.0 75.26 196 A 1 -ATOM 4316 N N . GLY A ? 197 ? -0.416 -30.678 -18.836 1.0 98.32 197 A 1 -ATOM 4317 C CA . GLY A ? 197 ? -1.498 -30.377 -17.894 1.0 98.08 197 A 1 -ATOM 4318 C C . GLY A ? 197 ? -1.022 -29.950 -16.502 1.0 98.24 197 A 1 -ATOM 4319 O O . GLY A ? 197 ? -1.776 -30.071 -15.534 1.0 97.23 197 A 1 -ATOM 4320 N N . ILE A ? 198 ? 0.203 -29.436 -16.384 1.0 98.43 198 A 1 -ATOM 4321 C CA . ILE A ? 198 ? 0.818 -29.029 -15.105 1.0 98.36 198 A 1 -ATOM 4322 C C . ILE A ? 198 ? -0.044 -28.021 -14.339 1.0 98.3 198 A 1 -ATOM 4323 O O . ILE A ? 198 ? -0.168 -28.110 -13.118 1.0 97.4 198 A 1 -ATOM 4324 C CB . ILE A ? 198 ? 2.234 -28.467 -15.372 1.0 98.01 198 A 1 -ATOM 4325 C CG1 . ILE A ? 198 ? 3.202 -29.544 -15.918 1.0 96.46 198 A 1 -ATOM 4326 C CG2 . ILE A ? 198 ? 2.844 -27.789 -14.130 1.0 96.88 198 A 1 -ATOM 4327 C CD1 . ILE A ? 198 ? 3.540 -30.694 -14.963 1.0 92.67 198 A 1 -ATOM 4328 N N . PHE A ? 199 ? -0.683 -27.089 -15.045 1.0 98.47 199 A 1 -ATOM 4329 C CA . PHE A ? 199 ? -1.476 -26.017 -14.443 1.0 98.36 199 A 1 -ATOM 4330 C C . PHE A ? 199 ? -2.902 -26.433 -14.051 1.0 98.06 199 A 1 -ATOM 4331 O O . PHE A ? 199 ? -3.614 -25.649 -13.428 1.0 96.86 199 A 1 -ATOM 4332 C CB . PHE A ? 199 ? -1.470 -24.804 -15.378 1.0 98.25 199 A 1 -ATOM 4333 C CG . PHE A ? 199 ? -0.089 -24.283 -15.718 1.0 98.54 199 A 1 -ATOM 4334 C CD1 . PHE A ? 199 ? 0.773 -23.829 -14.702 1.0 97.96 199 A 1 -ATOM 4335 C CD2 . PHE A ? 199 ? 0.345 -24.258 -17.055 1.0 97.95 199 A 1 -ATOM 4336 C CE1 . PHE A ? 199 ? 2.054 -23.347 -15.017 1.0 97.52 199 A 1 -ATOM 4337 C CE2 . PHE A ? 199 ? 1.627 -23.772 -17.378 1.0 97.47 199 A 1 -ATOM 4338 C CZ . PHE A ? 199 ? 2.481 -23.317 -16.359 1.0 98.02 199 A 1 -ATOM 4339 N N . ALA A ? 200 ? -3.328 -27.664 -14.351 1.0 97.06 200 A 1 -ATOM 4340 C CA . ALA A ? 200 ? -4.709 -28.113 -14.138 1.0 96.12 200 A 1 -ATOM 4341 C C . ALA A ? 200 ? -5.203 -27.991 -12.681 1.0 96.16 200 A 1 -ATOM 4342 O O . ALA A ? 200 ? -6.400 -27.857 -12.440 1.0 94.58 200 A 1 -ATOM 4343 C CB . ALA A ? 200 ? -4.818 -29.563 -14.619 1.0 94.53 200 A 1 -ATOM 4344 N N . LYS A ? 201 ? -4.297 -28.034 -11.704 1.0 96.52 201 A 1 -ATOM 4345 C CA . LYS A ? 201 ? -4.637 -27.886 -10.279 1.0 95.84 201 A 1 -ATOM 4346 C C . LYS A ? 201 ? -4.849 -26.437 -9.842 1.0 96.89 201 A 1 -ATOM 4347 O O . LYS A ? 201 ? -5.457 -26.220 -8.798 1.0 95.41 201 A 1 -ATOM 4348 C CB . LYS A ? 201 ? -3.543 -28.521 -9.413 1.0 92.67 201 A 1 -ATOM 4349 C CG . LYS A ? 201 ? -3.508 -30.048 -9.545 1.0 83.97 201 A 1 -ATOM 4350 C CD . LYS A ? 201 ? -2.439 -30.603 -8.601 1.0 79.69 201 A 1 -ATOM 4351 C CE . LYS A ? 201 ? -2.385 -32.128 -8.699 1.0 69.18 201 A 1 -ATOM 4352 N NZ . LYS A ? 201 ? -1.296 -32.669 -7.856 1.0 61.34 201 A 1 -ATOM 4353 N N . GLU A ? 202 ? -4.303 -25.479 -10.583 1.0 97.94 202 A 1 -ATOM 4354 C CA . GLU A ? 202 ? -4.279 -24.066 -10.176 1.0 98.03 202 A 1 -ATOM 4355 C C . GLU A ? 202 ? -5.108 -23.144 -11.076 1.0 98.52 202 A 1 -ATOM 4356 O O . GLU A ? 202 ? -5.540 -22.094 -10.613 1.0 98.16 202 A 1 -ATOM 4357 C CB . GLU A ? 202 ? -2.825 -23.582 -10.047 1.0 95.65 202 A 1 -ATOM 4358 C CG . GLU A ? 202 ? -2.056 -23.457 -11.369 1.0 91.23 202 A 1 -ATOM 4359 C CD . GLU A ? 202 ? -0.571 -23.152 -11.140 1.0 95.99 202 A 1 -ATOM 4360 O OE1 . GLU A ? 202 ? -0.105 -22.075 -11.552 1.0 91.96 202 A 1 -ATOM 4361 O OE2 . GLU A ? 202 ? 0.118 -24.016 -10.546 1.0 93.97 202 A 1 -ATOM 4362 N N . ILE A ? 203 ? -5.361 -23.538 -12.322 1.0 98.5 203 A 1 -ATOM 4363 C CA . ILE A ? 203 ? -6.201 -22.769 -13.248 1.0 98.4 203 A 1 -ATOM 4364 C C . ILE A ? 203 ? -7.677 -22.981 -12.923 1.0 98.43 203 A 1 -ATOM 4365 O O . ILE A ? 203 ? -8.146 -24.103 -12.752 1.0 97.55 203 A 1 -ATOM 4366 C CB . ILE A ? 203 ? -5.889 -23.132 -14.718 1.0 97.08 203 A 1 -ATOM 4367 C CG1 . ILE A ? 203 ? -4.477 -22.658 -15.132 1.0 91.8 203 A 1 -ATOM 4368 C CG2 . ILE A ? 203 ? -6.937 -22.570 -15.693 1.0 93.73 203 A 1 -ATOM 4369 C CD1 . ILE A ? 203 ? -4.350 -21.170 -15.476 1.0 84.41 203 A 1 -ATOM 4370 N N . ILE A ? 204 ? -8.420 -21.883 -12.922 1.0 98.54 204 A 1 -ATOM 4371 C CA . ILE A ? 204 ? -9.877 -21.879 -12.947 1.0 98.19 204 A 1 -ATOM 4372 C C . ILE A ? 204 ? -10.364 -21.343 -14.299 1.0 98.44 204 A 1 -ATOM 4373 O O . ILE A ? 204 ? -9.889 -20.299 -14.746 1.0 97.78 204 A 1 -ATOM 4374 C CB . ILE A ? 204 ? -10.462 -21.082 -11.766 1.0 96.15 204 A 1 -ATOM 4375 C CG1 . ILE A ? 204 ? -9.775 -19.721 -11.530 1.0 86.02 204 A 1 -ATOM 4376 C CG2 . ILE A ? 204 ? -10.395 -21.919 -10.482 1.0 78.27 204 A 1 -ATOM 4377 C CD1 . ILE A ? 204 ? -10.795 -18.628 -11.266 1.0 74.93 204 A 1 -ATOM 4378 N N . PRO A ? 205 ? -11.318 -22.014 -14.953 1.0 98.14 205 A 1 -ATOM 4379 C CA . PRO A ? 205 ? -11.961 -21.472 -16.142 1.0 97.83 205 A 1 -ATOM 4380 C C . PRO A ? 205 ? -12.721 -20.184 -15.810 1.0 97.95 205 A 1 -ATOM 4381 O O . PRO A ? 205 ? -13.356 -20.088 -14.758 1.0 97.07 205 A 1 -ATOM 4382 C CB . PRO A ? 205 ? -12.902 -22.568 -16.650 1.0 96.39 205 A 1 -ATOM 4383 C CG . PRO A ? 205 ? -12.412 -23.840 -15.956 1.0 92.89 205 A 1 -ATOM 4384 C CD . PRO A ? 205 ? -11.843 -23.323 -14.642 1.0 96.71 205 A 1 -ATOM 4385 N N . LEU A ? 206 ? -12.702 -19.213 -16.722 1.0 97.87 206 A 1 -ATOM 4386 C CA . LEU A ? 206 ? -13.550 -18.024 -16.647 1.0 97.82 206 A 1 -ATOM 4387 C C . LEU A ? 206 ? -14.509 -17.977 -17.827 1.0 98.01 206 A 1 -ATOM 4388 O O . LEU A ? 206 ? -14.092 -18.022 -18.979 1.0 97.03 206 A 1 -ATOM 4389 C CB . LEU A ? 206 ? -12.717 -16.731 -16.582 1.0 96.53 206 A 1 -ATOM 4390 C CG . LEU A ? 206 ? -12.576 -16.198 -15.148 1.0 90.84 206 A 1 -ATOM 4391 C CD1 . LEU A ? 206 ? -11.412 -16.854 -14.434 1.0 84.59 206 A 1 -ATOM 4392 C CD2 . LEU A ? 206 ? -12.357 -14.685 -15.154 1.0 85.73 206 A 1 -ATOM 4393 N N . GLU A ? 207 ? -15.795 -17.797 -17.534 1.0 97.06 207 A 1 -ATOM 4394 C CA . GLU A ? 207 ? -16.756 -17.379 -18.545 1.0 96.65 207 A 1 -ATOM 4395 C C . GLU A ? 207 ? -16.654 -15.872 -18.783 1.0 96.85 207 A 1 -ATOM 4396 O O . GLU A ? 207 ? -16.741 -15.061 -17.858 1.0 95.26 207 A 1 -ATOM 4397 C CB . GLU A ? 207 ? -18.183 -17.768 -18.159 1.0 95.02 207 A 1 -ATOM 4398 C CG . GLU A ? 207 ? -18.436 -19.272 -18.330 1.0 84.63 207 A 1 -ATOM 4399 C CD . GLU A ? 207 ? -19.920 -19.636 -18.212 1.0 80.25 207 A 1 -ATOM 4400 O OE1 . GLU A ? 207 ? -20.267 -20.758 -18.645 1.0 72.61 207 A 1 -ATOM 4401 O OE2 . GLU A ? 207 ? -20.711 -18.789 -17.729 1.0 73.28 207 A 1 -ATOM 4402 N N . VAL A ? 208 ? -16.496 -15.506 -20.048 1.0 95.75 208 A 1 -ATOM 4403 C CA . VAL A ? 208 ? -16.421 -14.121 -20.498 1.0 95.39 208 A 1 -ATOM 4404 C C . VAL A ? 208 ? -17.437 -13.887 -21.605 1.0 95.11 208 A 1 -ATOM 4405 O O . VAL A ? 208 ? -17.548 -14.668 -22.545 1.0 93.1 208 A 1 -ATOM 4406 C CB . VAL A ? 208 ? -15.014 -13.715 -20.983 1.0 93.63 208 A 1 -ATOM 4407 C CG1 . VAL A ? 208 ? -14.443 -12.663 -20.042 1.0 86.83 208 A 1 -ATOM 4408 C CG2 . VAL A ? 208 ? -13.989 -14.860 -21.067 1.0 87.51 208 A 1 -ATOM 4409 N N . THR A ? 209 ? -18.174 -12.797 -21.506 1.0 92.5 209 A 1 -ATOM 4410 C CA . THR A ? 209 ? -19.133 -12.413 -22.542 1.0 90.3 209 A 1 -ATOM 4411 C C . THR A ? 209 ? -18.464 -11.455 -23.524 1.0 89.32 209 A 1 -ATOM 4412 O O . THR A ? 209 ? -18.130 -10.325 -23.174 1.0 84.87 209 A 1 -ATOM 4413 C CB . THR A ? 209 ? -20.403 -11.810 -21.932 1.0 86.91 209 A 1 -ATOM 4414 O OG1 . THR A ? 209 ? -20.920 -12.678 -20.950 1.0 76.99 209 A 1 -ATOM 4415 C CG2 . THR A ? 209 ? -21.501 -11.624 -22.974 1.0 74.57 209 A 1 -ATOM 4416 N N . GLN A ? 210 ? -18.297 -11.893 -24.768 1.0 86.41 210 A 1 -ATOM 4417 C CA . GLN A ? 210 ? -17.846 -11.059 -25.883 1.0 84.27 210 A 1 -ATOM 4418 C C . GLN A ? 210 ? -19.036 -10.763 -26.804 1.0 84.53 210 A 1 -ATOM 4419 O O . GLN A ? 210 ? -19.458 -11.599 -27.609 1.0 78.7 210 A 1 -ATOM 4420 C CB . GLN A ? 210 ? -16.686 -11.728 -26.631 1.0 80.31 210 A 1 -ATOM 4421 C CG . GLN A ? 210 ? -15.379 -11.719 -25.818 1.0 73.92 210 A 1 -ATOM 4422 C CD . GLN A ? 210 ? -14.188 -12.248 -26.623 1.0 69.41 210 A 1 -ATOM 4423 O OE1 . GLN A ? 210 ? -14.311 -12.695 -27.754 1.0 63.61 210 A 1 -ATOM 4424 N NE2 . GLN A ? 210 ? -12.998 -12.221 -26.061 1.0 62.45 210 A 1 -ATOM 4425 N N . GLY A ? 211 ? -19.598 -9.566 -26.653 1.0 82.45 211 A 1 -ATOM 4426 C CA . GLY A ? 211 ? -20.821 -9.178 -27.353 1.0 82.59 211 A 1 -ATOM 4427 C C . GLY A ? 211 ? -21.996 -10.092 -26.977 1.0 85.16 211 A 1 -ATOM 4428 O O . GLY A ? 211 ? -22.488 -10.054 -25.852 1.0 81.14 211 A 1 -ATOM 4429 N N . LYS A ? 212 ? -22.454 -10.919 -27.918 1.0 86.32 212 A 1 -ATOM 4430 C CA . LYS A ? 212 ? -23.572 -11.864 -27.711 1.0 88.3 212 A 1 -ATOM 4431 C C . LYS A ? 212 ? -23.120 -13.301 -27.419 1.0 90.05 212 A 1 -ATOM 4432 O O . LYS A ? 212 ? -23.974 -14.171 -27.256 1.0 85.97 212 A 1 -ATOM 4433 C CB . LYS A ? 212 ? -24.522 -11.841 -28.918 1.0 85.97 212 A 1 -ATOM 4434 C CG . LYS A ? 212 ? -25.253 -10.499 -29.079 1.0 78.24 212 A 1 -ATOM 4435 C CD . LYS A ? 212 ? -26.305 -10.617 -30.191 1.0 70.38 212 A 1 -ATOM 4436 C CE . LYS A ? 212 ? -27.068 -9.291 -30.335 1.0 62.21 212 A 1 -ATOM 4437 N NZ . LYS A ? 212 ? -28.136 -9.369 -31.367 1.0 52.18 212 A 1 -ATOM 4438 N N . LYS A ? 213 ? -21.821 -13.577 -27.424 1.0 89.28 213 A 1 -ATOM 4439 C CA . LYS A ? 213 ? -21.281 -14.915 -27.173 1.0 90.49 213 A 1 -ATOM 4440 C C . LYS A ? 213 ? -20.627 -14.968 -25.800 1.0 92.04 213 A 1 -ATOM 4441 O O . LYS A ? 213 ? -19.813 -14.111 -25.468 1.0 89.19 213 A 1 -ATOM 4442 C CB . LYS A ? 213 ? -20.294 -15.333 -28.272 1.0 86.79 213 A 1 -ATOM 4443 C CG . LYS A ? 213 ? -21.008 -15.701 -29.585 1.0 75.45 213 A 1 -ATOM 4444 C CD . LYS A ? 213 ? -19.994 -16.253 -30.594 1.0 71.78 213 A 1 -ATOM 4445 C CE . LYS A ? 213 ? -20.703 -16.743 -31.864 1.0 61.73 213 A 1 -ATOM 4446 N NZ . LYS A ? 213 ? -19.748 -17.355 -32.818 1.0 55.04 213 A 1 -ATOM 4447 N N . THR A ? 214 ? -20.950 -16.018 -25.060 1.0 92.55 214 A 1 -ATOM 4448 C CA . THR A ? 214 ? -20.190 -16.412 -23.878 1.0 93.14 214 A 1 -ATOM 4449 C C . THR A ? 214 ? -19.117 -17.405 -24.306 1.0 93.97 214 A 1 -ATOM 4450 O O . THR A ? 214 ? -19.405 -18.355 -25.035 1.0 91.97 214 A 1 -ATOM 4451 C CB . THR A ? 214 ? -21.105 -17.001 -22.798 1.0 90.67 214 A 1 -ATOM 4452 O OG1 . THR A ? 214 ? -22.160 -16.091 -22.547 1.0 81.81 214 A 1 -ATOM 4453 C CG2 . THR A ? 214 ? -20.372 -17.219 -21.483 1.0 80.59 214 A 1 -ATOM 4454 N N . ILE A ? 215 ? -17.876 -17.147 -23.909 1.0 94.93 215 A 1 -ATOM 4455 C CA . ILE A ? 215 ? -16.716 -17.992 -24.183 1.0 94.91 215 A 1 -ATOM 4456 C C . ILE A ? 215 ? -16.098 -18.360 -22.837 1.0 96.31 215 A 1 -ATOM 4457 O O . ILE A ? 215 ? -15.955 -17.498 -21.972 1.0 95.42 215 A 1 -ATOM 4458 C CB . ILE A ? 215 ? -15.693 -17.275 -25.098 1.0 91.93 215 A 1 -ATOM 4459 C CG1 . ILE A ? 215 ? -16.374 -16.660 -26.351 1.0 78.9 215 A 1 -ATOM 4460 C CG2 . ILE A ? 215 ? -14.584 -18.262 -25.511 1.0 76.74 215 A 1 -ATOM 4461 C CD1 . ILE A ? 215 ? -15.420 -15.884 -27.270 1.0 72.22 215 A 1 -ATOM 4462 N N . THR A ? 216 ? -15.711 -19.614 -22.673 1.0 96.78 216 A 1 -ATOM 4463 C CA . THR A ? 216 ? -14.926 -20.051 -21.520 1.0 97.21 216 A 1 -ATOM 4464 C C . THR A ? 216 ? -13.447 -19.930 -21.852 1.0 97.39 216 A 1 -ATOM 4465 O O . THR A ? 216 ? -12.988 -20.487 -22.847 1.0 96.56 216 A 1 -ATOM 4466 C CB . THR A ? 216 ? -15.284 -21.481 -21.098 1.0 96.59 216 A 1 -ATOM 4467 O OG1 . THR A ? 216 ? -16.686 -21.611 -20.978 1.0 91.79 216 A 1 -ATOM 4468 C CG2 . THR A ? 216 ? -14.689 -21.834 -19.741 1.0 91.94 216 A 1 -ATOM 4469 N N . VAL A ? 217 ? -12.706 -19.179 -21.040 1.0 97.75 217 A 1 -ATOM 4470 C CA . VAL A ? 217 ? -11.249 -19.044 -21.138 1.0 97.94 217 A 1 -ATOM 4471 C C . VAL A ? 217 ? -10.622 -19.973 -20.105 1.0 98.15 217 A 1 -ATOM 4472 O O . VAL A ? 217 ? -10.844 -19.805 -18.907 1.0 97.9 217 A 1 -ATOM 4473 C CB . VAL A ? 217 ? -10.797 -17.590 -20.934 1.0 97.61 217 A 1 -ATOM 4474 C CG1 . VAL A ? 217 ? -9.292 -17.444 -21.158 1.0 96.45 217 A 1 -ATOM 4475 C CG2 . VAL A ? 217 ? -11.516 -16.643 -21.907 1.0 96.57 217 A 1 -ATOM 4476 N N . GLU A ? 218 ? -9.840 -20.941 -20.573 1.0 97.98 218 A 1 -ATOM 4477 C CA . GLU A ? 218 ? -9.257 -22.014 -19.752 1.0 97.58 218 A 1 -ATOM 4478 C C . GLU A ? 218 ? -7.730 -22.075 -19.842 1.0 97.93 218 A 1 -ATOM 4479 O O . GLU A ? 218 ? -7.093 -22.775 -19.056 1.0 96.88 218 A 1 -ATOM 4480 C CB . GLU A ? 218 ? -9.854 -23.367 -20.176 1.0 95.15 218 A 1 -ATOM 4481 C CG . GLU A ? 218 ? -11.391 -23.391 -20.094 1.0 85.96 218 A 1 -ATOM 4482 C CD . GLU A ? 218 ? -11.990 -24.774 -20.360 1.0 85.44 218 A 1 -ATOM 4483 O OE1 . GLU A ? 218 ? -12.902 -25.160 -19.590 1.0 77.6 218 A 1 -ATOM 4484 O OE2 . GLU A ? 218 ? -11.560 -25.434 -21.330 1.0 79.77 218 A 1 -ATOM 4485 N N . GLU A ? 219 ? -7.136 -21.338 -20.777 1.0 98.06 219 A 1 -ATOM 4486 C CA . GLU A ? 219 ? -5.702 -21.333 -21.058 1.0 98.06 219 A 1 -ATOM 4487 C C . GLU A ? 219 ? -5.103 -19.931 -20.977 1.0 98.46 219 A 1 -ATOM 4488 O O . GLU A ? 219 ? -5.731 -18.939 -21.346 1.0 98.08 219 A 1 -ATOM 4489 C CB . GLU A ? 219 ? -5.427 -21.934 -22.449 1.0 95.97 219 A 1 -ATOM 4490 C CG . GLU A ? 219 ? -5.426 -23.478 -22.480 1.0 87.84 219 A 1 -ATOM 4491 C CD . GLU A ? 219 ? -4.966 -23.957 -23.871 1.0 90.26 219 A 1 -ATOM 4492 O OE1 . GLU A ? 219 ? -3.941 -24.663 -23.992 1.0 84.72 219 A 1 -ATOM 4493 O OE2 . GLU A ? 219 ? -5.545 -23.518 -24.889 1.0 86.4 219 A 1 -ATOM 4494 N N . ASP A ? 220 ? -3.835 -19.864 -20.560 1.0 98.58 220 A 1 -ATOM 4495 C CA . ASP A ? 220 ? -3.009 -18.670 -20.713 1.0 98.61 220 A 1 -ATOM 4496 C C . ASP A ? 220 ? -2.839 -18.344 -22.207 1.0 98.49 220 A 1 -ATOM 4497 O O . ASP A ? 220 ? -2.572 -19.225 -23.032 1.0 97.99 220 A 1 -ATOM 4498 C CB . ASP A ? 220 ? -1.641 -18.893 -20.046 1.0 98.6 220 A 1 -ATOM 4499 C CG . ASP A ? 220 ? -1.706 -19.110 -18.530 1.0 98.66 220 A 1 -ATOM 4500 O OD1 . ASP A ? 220 ? -2.443 -18.385 -17.835 1.0 97.94 220 A 1 -ATOM 4501 O OD2 . ASP A ? 220 ? -0.981 -19.980 -17.998 1.0 97.96 220 A 1 -ATOM 4502 N N . GLU A ? 221 ? -2.957 -17.067 -22.570 1.0 98.56 221 A 1 -ATOM 4503 C CA . GLU A ? 221 ? -2.931 -16.656 -23.985 1.0 98.34 221 A 1 -ATOM 4504 C C . GLU A ? 221 ? -1.515 -16.450 -24.545 1.0 98.16 221 A 1 -ATOM 4505 O O . GLU A ? 221 ? -1.297 -16.651 -25.743 1.0 96.94 221 A 1 -ATOM 4506 C CB . GLU A ? 221 ? -3.746 -15.370 -24.177 1.0 97.89 221 A 1 -ATOM 4507 C CG . GLU A ? 221 ? -5.269 -15.577 -24.065 1.0 96.78 221 A 1 -ATOM 4508 C CD . GLU A ? 221 ? -5.968 -14.292 -24.522 1.0 97.1 221 A 1 -ATOM 4509 O OE1 . GLU A ? 221 ? -6.300 -14.165 -25.724 1.0 94.18 221 A 1 -ATOM 4510 O OE2 . GLU A ? 221 ? -6.111 -13.359 -23.708 1.0 94.51 221 A 1 -ATOM 4511 N N . GLU A ? 222 ? -0.554 -16.033 -23.706 1.0 98.43 222 A 1 -ATOM 4512 C CA . GLU A ? 222 ? 0.753 -15.546 -24.183 1.0 98.3 222 A 1 -ATOM 4513 C C . GLU A ? 222 ? 1.695 -16.653 -24.668 1.0 98.22 222 A 1 -ATOM 4514 O O . GLU A ? 222 ? 2.424 -16.451 -25.638 1.0 97.09 222 A 1 -ATOM 4515 C CB . GLU A ? 222 ? 1.456 -14.720 -23.097 1.0 97.62 222 A 1 -ATOM 4516 C CG . GLU A ? 222 ? 0.797 -13.369 -22.788 1.0 94.47 222 A 1 -ATOM 4517 C CD . GLU A ? 222 ? 0.781 -12.374 -23.959 1.0 96.18 222 A 1 -ATOM 4518 O OE1 . GLU A ? 222 ? 0.054 -11.359 -23.837 1.0 92.02 222 A 1 -ATOM 4519 O OE2 . GLU A ? 222 ? 1.445 -12.604 -24.993 1.0 92.72 222 A 1 -ATOM 4520 N N . TYR A ? 223 ? 1.686 -17.826 -24.040 1.0 98.36 223 A 1 -ATOM 4521 C CA . TYR A ? 223 ? 2.661 -18.892 -24.331 1.0 98.14 223 A 1 -ATOM 4522 C C . TYR A ? 223 ? 2.620 -19.395 -25.780 1.0 98.12 223 A 1 -ATOM 4523 O O . TYR A ? 223 ? 3.607 -19.939 -26.279 1.0 97.03 223 A 1 -ATOM 4524 C CB . TYR A ? 223 ? 2.487 -20.048 -23.340 1.0 97.62 223 A 1 -ATOM 4525 C CG . TYR A ? 223 ? 1.451 -21.078 -23.728 1.0 97.77 223 A 1 -ATOM 4526 C CD1 . TYR A ? 223 ? 0.101 -20.940 -23.344 1.0 96.91 223 A 1 -ATOM 4527 C CD2 . TYR A ? 223 ? 1.845 -22.207 -24.478 1.0 97.08 223 A 1 -ATOM 4528 C CE1 . TYR A ? 223 ? -0.841 -21.924 -23.695 1.0 96.06 223 A 1 -ATOM 4529 C CE2 . TYR A ? 223 ? 0.910 -23.194 -24.838 1.0 96.21 223 A 1 -ATOM 4530 C CZ . TYR A ? 223 ? -0.431 -23.053 -24.440 1.0 96.21 223 A 1 -ATOM 4531 O OH . TYR A ? 223 ? -1.332 -24.031 -24.780 1.0 94.63 223 A 1 -ATOM 4532 N N . LYS A ? 224 ? 1.499 -19.180 -26.473 1.0 97.76 224 A 1 -ATOM 4533 C CA . LYS A ? 224 ? 1.306 -19.510 -27.895 1.0 97.21 224 A 1 -ATOM 4534 C C . LYS A ? 224 ? 1.759 -18.385 -28.836 1.0 97.59 224 A 1 -ATOM 4535 O O . LYS A ? 224 ? 1.902 -18.620 -30.034 1.0 95.95 224 A 1 -ATOM 4536 C CB . LYS A ? 224 ? -0.174 -19.870 -28.141 1.0 95.31 224 A 1 -ATOM 4537 C CG . LYS A ? 224 ? -0.634 -21.096 -27.332 1.0 92.17 224 A 1 -ATOM 4538 C CD . LYS A ? 224 ? -2.108 -21.447 -27.587 1.0 88.35 224 A 1 -ATOM 4539 C CE . LYS A ? 224 ? -2.496 -22.623 -26.675 1.0 80.41 224 A 1 -ATOM 4540 N NZ . LYS A ? 224 ? -3.935 -22.974 -26.721 1.0 73.62 224 A 1 -ATOM 4541 N N . LYS A ? 225 ? 1.970 -17.176 -28.328 1.0 97.63 225 A 1 -ATOM 4542 C CA . LYS A ? 225 ? 2.273 -15.967 -29.113 1.0 97.46 225 A 1 -ATOM 4543 C C . LYS A ? 225 ? 3.782 -15.764 -29.293 1.0 97.69 225 A 1 -ATOM 4544 O O . LYS A ? 225 ? 4.344 -14.740 -28.911 1.0 95.95 225 A 1 -ATOM 4545 C CB . LYS A ? 225 ? 1.579 -14.744 -28.494 1.0 96.6 225 A 1 -ATOM 4546 C CG . LYS A ? 225 ? 0.049 -14.860 -28.535 1.0 95.07 225 A 1 -ATOM 4547 C CD . LYS A ? 225 ? -0.586 -13.577 -27.991 1.0 92.16 225 A 1 -ATOM 4548 C CE . LYS A ? 225 ? -2.111 -13.677 -28.048 1.0 87.27 225 A 1 -ATOM 4549 N NZ . LYS A ? 225 ? -2.752 -12.475 -27.472 1.0 80.26 225 A 1 -ATOM 4550 N N . VAL A ? 226 ? 4.457 -16.740 -29.896 1.0 97.72 226 A 1 -ATOM 4551 C CA . VAL A ? 226 ? 5.906 -16.706 -30.124 1.0 98.02 226 A 1 -ATOM 4552 C C . VAL A ? 226 ? 6.259 -17.115 -31.551 1.0 98.22 226 A 1 -ATOM 4553 O O . VAL A ? 226 ? 5.693 -18.050 -32.112 1.0 97.58 226 A 1 -ATOM 4554 C CB . VAL A ? 226 ? 6.644 -17.549 -29.062 1.0 97.34 226 A 1 -ATOM 4555 C CG1 . VAL A ? 226 ? 6.353 -19.053 -29.152 1.0 96.02 226 A 1 -ATOM 4556 C CG2 . VAL A ? 226 ? 8.158 -17.328 -29.122 1.0 95.4 226 A 1 -ATOM 4557 N N . ASN A ? 227 ? 7.233 -16.415 -32.138 1.0 98.04 227 A 1 -ATOM 4558 C CA . ASN A ? 227 ? 7.909 -16.812 -33.371 1.0 98.09 227 A 1 -ATOM 4559 C C . ASN A ? 227 ? 9.419 -16.854 -33.098 1.0 98.33 227 A 1 -ATOM 4560 O O . ASN A ? 227 ? 10.080 -15.813 -33.077 1.0 97.85 227 A 1 -ATOM 4561 C CB . ASN A ? 227 ? 7.514 -15.857 -34.510 1.0 97.38 227 A 1 -ATOM 4562 C CG . ASN A ? 227 ? 8.156 -16.234 -35.837 1.0 95.9 227 A 1 -ATOM 4563 O OD1 . ASN A ? 227 ? 9.201 -16.845 -35.910 1.0 91.01 227 A 1 -ATOM 4564 N ND2 . ASN A ? 227 ? 7.548 -15.859 -36.938 1.0 89.0 227 A 1 -ATOM 4565 N N . PHE A ? 228 ? 9.954 -18.055 -32.901 1.0 98.24 228 A 1 -ATOM 4566 C CA . PHE A ? 228 ? 11.354 -18.265 -32.521 1.0 98.29 228 A 1 -ATOM 4567 C C . PHE A ? 228 ? 12.355 -17.701 -33.541 1.0 98.32 228 A 1 -ATOM 4568 O O . PHE A ? 228 ? 13.374 -17.143 -33.150 1.0 97.4 228 A 1 -ATOM 4569 C CB . PHE A ? 228 ? 11.603 -19.760 -32.300 1.0 97.88 228 A 1 -ATOM 4570 C CG . PHE A ? 228 ? 10.822 -20.356 -31.149 1.0 98.06 228 A 1 -ATOM 4571 C CD1 . PHE A ? 228 ? 11.050 -19.902 -29.837 1.0 96.76 228 A 1 -ATOM 4572 C CD2 . PHE A ? 228 ? 9.870 -21.368 -31.374 1.0 96.69 228 A 1 -ATOM 4573 C CE1 . PHE A ? 228 ? 10.336 -20.453 -28.759 1.0 95.81 228 A 1 -ATOM 4574 C CE2 . PHE A ? 228 ? 9.153 -21.924 -30.299 1.0 95.79 228 A 1 -ATOM 4575 C CZ . PHE A ? 228 ? 9.387 -21.466 -28.987 1.0 96.82 228 A 1 -ATOM 4576 N N . GLU A ? 229 ? 12.060 -17.784 -34.842 1.0 98.29 229 A 1 -ATOM 4577 C CA . GLU A ? 229 ? 12.938 -17.249 -35.894 1.0 98.14 229 A 1 -ATOM 4578 C C . GLU A ? 229 ? 12.998 -15.716 -35.897 1.0 98.27 229 A 1 -ATOM 4579 O O . GLU A ? 229 ? 13.976 -15.122 -36.357 1.0 97.14 229 A 1 -ATOM 4580 C CB . GLU A ? 229 ? 12.434 -17.695 -37.268 1.0 97.43 229 A 1 -ATOM 4581 C CG . GLU A ? 229 ? 12.459 -19.214 -37.476 1.0 87.98 229 A 1 -ATOM 4582 C CD . GLU A ? 229 ? 12.064 -19.603 -38.905 1.0 79.08 229 A 1 -ATOM 4583 O OE1 . GLU A ? 229 ? 12.180 -20.810 -39.217 1.0 70.16 229 A 1 -ATOM 4584 O OE2 . GLU A ? 229 ? 11.662 -18.696 -39.678 1.0 70.84 229 A 1 -ATOM 4585 N N . LYS A ? 230 ? 11.955 -15.070 -35.393 1.0 98.06 230 A 1 -ATOM 4586 C CA . LYS A ? 230 ? 11.852 -13.611 -35.345 1.0 98.09 230 A 1 -ATOM 4587 C C . LYS A ? 230 ? 12.563 -13.018 -34.127 1.0 98.42 230 A 1 -ATOM 4588 O O . LYS A ? 230 ? 13.047 -11.896 -34.219 1.0 97.78 230 A 1 -ATOM 4589 C CB . LYS A ? 230 ? 10.368 -13.221 -35.414 1.0 97.02 230 A 1 -ATOM 4590 C CG . LYS A ? 230 ? 10.163 -11.782 -35.901 1.0 89.66 230 A 1 -ATOM 4591 C CD . LYS A ? 230 ? 8.671 -11.447 -35.973 1.0 88.76 230 A 1 -ATOM 4592 C CE . LYS A ? 230 ? 8.466 -10.028 -36.509 1.0 80.83 230 A 1 -ATOM 4593 N NZ . LYS A ? 230 ? 7.044 -9.620 -36.460 1.0 73.89 230 A 1 -ATOM 4594 N N . ILE A ? 231 ? 12.654 -13.757 -33.021 1.0 98.36 231 A 1 -ATOM 4595 C CA . ILE A ? 231 ? 13.221 -13.289 -31.740 1.0 98.5 231 A 1 -ATOM 4596 C C . ILE A ? 231 ? 14.587 -12.593 -31.904 1.0 98.49 231 A 1 -ATOM 4597 O O . ILE A ? 231 ? 14.695 -11.430 -31.517 1.0 98.2 231 A 1 -ATOM 4598 C CB . ILE A ? 231 ? 13.241 -14.420 -30.684 1.0 98.41 231 A 1 -ATOM 4599 C CG1 . ILE A ? 231 ? 11.795 -14.773 -30.279 1.0 97.95 231 A 1 -ATOM 4600 C CG2 . ILE A ? 231 ? 14.065 -14.023 -29.439 1.0 98.05 231 A 1 -ATOM 4601 C CD1 . ILE A ? 231 ? 11.670 -15.929 -29.275 1.0 96.93 231 A 1 -ATOM 4602 N N . PRO A ? 232 ? 15.619 -13.218 -32.519 1.0 98.34 232 A 1 -ATOM 4603 C CA . PRO A ? 232 ? 16.947 -12.597 -32.632 1.0 98.0 232 A 1 -ATOM 4604 C C . PRO A ? 232 ? 16.992 -11.387 -33.582 1.0 98.12 232 A 1 -ATOM 4605 O O . PRO A ? 232 ? 17.969 -10.646 -33.597 1.0 97.28 232 A 1 -ATOM 4606 C CB . PRO A ? 232 ? 17.877 -13.729 -33.091 1.0 97.03 232 A 1 -ATOM 4607 C CG . PRO A ? 232 ? 16.955 -14.687 -33.843 1.0 94.77 232 A 1 -ATOM 4608 C CD . PRO A ? 232 ? 15.650 -14.574 -33.064 1.0 97.52 232 A 1 -ATOM 4609 N N . LYS A ? 233 ? 15.945 -11.166 -34.370 1.0 98.21 233 A 1 -ATOM 4610 C CA . LYS A ? 233 ? 15.840 -10.076 -35.359 1.0 98.08 233 A 1 -ATOM 4611 C C . LYS A ? 233 ? 15.022 -8.881 -34.856 1.0 98.2 233 A 1 -ATOM 4612 O O . LYS A ? 233 ? 14.906 -7.883 -35.568 1.0 96.85 233 A 1 -ATOM 4613 C CB . LYS A ? 233 ? 15.246 -10.630 -36.666 1.0 97.42 233 A 1 -ATOM 4614 C CG . LYS A ? 233 ? 16.076 -11.778 -37.272 1.0 95.19 233 A 1 -ATOM 4615 C CD . LYS A ? 233 ? 15.386 -12.353 -38.514 1.0 91.29 233 A 1 -ATOM 4616 C CE . LYS A ? 233 ? 16.169 -13.576 -39.010 1.0 83.47 233 A 1 -ATOM 4617 N NZ . LYS A ? 233 ? 15.411 -14.369 -40.013 1.0 74.63 233 A 1 -ATOM 4618 N N . LEU A ? 234 ? 14.431 -8.978 -33.677 1.0 98.31 234 A 1 -ATOM 4619 C CA . LEU A ? 234 ? 13.612 -7.903 -33.119 1.0 98.44 234 A 1 -ATOM 4620 C C . LEU A ? 234 ? 14.465 -6.679 -32.779 1.0 98.5 234 A 1 -ATOM 4621 O O . LEU A ? 234 ? 15.603 -6.793 -32.326 1.0 98.07 234 A 1 -ATOM 4622 C CB . LEU A ? 234 ? 12.826 -8.392 -31.893 1.0 98.25 234 A 1 -ATOM 4623 C CG . LEU A ? 234 ? 11.759 -9.455 -32.206 1.0 97.61 234 A 1 -ATOM 4624 C CD1 . LEU A ? 234 ? 11.077 -9.879 -30.911 1.0 97.02 234 A 1 -ATOM 4625 C CD2 . LEU A ? 234 ? 10.683 -8.956 -33.171 1.0 96.85 234 A 1 -ATOM 4626 N N . LYS A ? 235 ? 13.888 -5.492 -32.971 1.0 98.38 235 A 1 -ATOM 4627 C CA . LYS A ? 235 ? 14.498 -4.242 -32.515 1.0 98.36 235 A 1 -ATOM 4628 C C . LYS A ? 235 ? 14.376 -4.120 -30.993 1.0 98.65 235 A 1 -ATOM 4629 O O . LYS A ? 235 ? 13.400 -4.630 -30.432 1.0 98.25 235 A 1 -ATOM 4630 C CB . LYS A ? 235 ? 13.861 -3.039 -33.218 1.0 97.26 235 A 1 -ATOM 4631 C CG . LYS A ? 235 ? 14.199 -3.008 -34.717 1.0 84.92 235 A 1 -ATOM 4632 C CD . LYS A ? 235 ? 13.680 -1.713 -35.351 1.0 79.39 235 A 1 -ATOM 4633 C CE . LYS A ? 235 ? 14.062 -1.667 -36.831 1.0 66.07 235 A 1 -ATOM 4634 N NZ . LYS A ? 235 ? 13.659 -0.381 -37.461 1.0 56.31 235 A 1 -ATOM 4635 N N . PRO A ? 236 ? 15.307 -3.397 -30.350 1.0 98.6 236 A 1 -ATOM 4636 C CA . PRO A ? 236 ? 15.146 -2.987 -28.959 1.0 98.65 236 A 1 -ATOM 4637 C C . PRO A ? 236 ? 13.792 -2.296 -28.742 1.0 98.69 236 A 1 -ATOM 4638 O O . PRO A ? 236 ? 13.354 -1.507 -29.582 1.0 98.33 236 A 1 -ATOM 4639 C CB . PRO A ? 236 ? 16.315 -2.045 -28.669 1.0 98.26 236 A 1 -ATOM 4640 C CG . PRO A ? 236 ? 17.379 -2.458 -29.682 1.0 96.27 236 A 1 -ATOM 4641 C CD . PRO A ? 236 ? 16.547 -2.865 -30.896 1.0 98.31 236 A 1 -ATOM 4642 N N . ALA A ? 237 ? 13.130 -2.606 -27.635 1.0 98.64 237 A 1 -ATOM 4643 C CA . ALA A ? 237 ? 11.778 -2.121 -27.351 1.0 98.62 237 A 1 -ATOM 4644 C C . ALA A ? 237 ? 11.738 -0.809 -26.547 1.0 98.61 237 A 1 -ATOM 4645 O O . ALA A ? 237 ? 10.731 -0.102 -26.593 1.0 98.01 237 A 1 -ATOM 4646 C CB . ALA A ? 237 ? 11.009 -3.240 -26.633 1.0 98.44 237 A 1 -ATOM 4647 N N . PHE A ? 238 ? 12.805 -0.494 -25.813 1.0 98.68 238 A 1 -ATOM 4648 C CA . PHE A ? 238 ? 12.811 0.609 -24.844 1.0 98.62 238 A 1 -ATOM 4649 C C . PHE A ? 238 ? 13.886 1.659 -25.114 1.0 98.46 238 A 1 -ATOM 4650 O O . PHE A ? 238 ? 13.596 2.855 -25.073 1.0 97.28 238 A 1 -ATOM 4651 C CB . PHE A ? 238 ? 12.959 0.032 -23.437 1.0 98.52 238 A 1 -ATOM 4652 C CG . PHE A ? 238 ? 11.821 -0.878 -23.034 1.0 98.71 238 A 1 -ATOM 4653 C CD1 . PHE A ? 238 ? 10.603 -0.330 -22.592 1.0 98.28 238 A 1 -ATOM 4654 C CD2 . PHE A ? 238 ? 11.952 -2.276 -23.132 1.0 98.29 238 A 1 -ATOM 4655 C CE1 . PHE A ? 238 ? 9.533 -1.167 -22.239 1.0 98.02 238 A 1 -ATOM 4656 C CE2 . PHE A ? 238 ? 10.883 -3.122 -22.784 1.0 97.96 238 A 1 -ATOM 4657 C CZ . PHE A ? 238 ? 9.675 -2.565 -22.335 1.0 98.38 238 A 1 -ATOM 4658 N N . THR A ? 239 ? 15.114 1.244 -25.395 1.0 98.42 239 A 1 -ATOM 4659 C CA . THR A ? 239 ? 16.231 2.133 -25.734 1.0 98.27 239 A 1 -ATOM 4660 C C . THR A ? 239 ? 16.857 1.707 -27.060 1.0 98.3 239 A 1 -ATOM 4661 O O . THR A ? 239 ? 16.856 0.534 -27.415 1.0 97.66 239 A 1 -ATOM 4662 C CB . THR A ? 239 ? 17.279 2.213 -24.613 1.0 97.64 239 A 1 -ATOM 4663 O OG1 . THR A ? 239 ? 17.960 1.005 -24.451 1.0 92.71 239 A 1 -ATOM 4664 C CG2 . THR A ? 239 ? 16.667 2.578 -23.259 1.0 91.98 239 A 1 -ATOM 4665 N N . SER A ? 240 ? 17.377 2.671 -27.819 1.0 98.01 240 A 1 -ATOM 4666 C CA . SER A ? 240 ? 17.877 2.426 -29.180 1.0 97.5 240 A 1 -ATOM 4667 C C . SER A ? 240 ? 19.063 1.457 -29.235 1.0 97.43 240 A 1 -ATOM 4668 O O . SER A ? 240 ? 19.196 0.708 -30.198 1.0 95.16 240 A 1 -ATOM 4669 C CB . SER A ? 240 ? 18.251 3.752 -29.850 1.0 96.31 240 A 1 -ATOM 4670 O OG . SER A ? 240 ? 18.897 4.625 -28.947 1.0 83.74 240 A 1 -ATOM 4671 N N . GLU A ? 241 ? 19.892 1.431 -28.186 1.0 97.31 241 A 1 -ATOM 4672 C CA . GLU A ? 241 ? 21.029 0.512 -28.026 1.0 96.73 241 A 1 -ATOM 4673 C C . GLU A ? 241 ? 20.757 -0.590 -26.987 1.0 97.41 241 A 1 -ATOM 4674 O O . GLU A ? 241 ? 21.679 -1.272 -26.545 1.0 95.34 241 A 1 -ATOM 4675 C CB . GLU A ? 241 ? 22.287 1.298 -27.638 1.0 94.59 241 A 1 -ATOM 4676 C CG . GLU A ? 241 ? 22.699 2.370 -28.650 1.0 85.56 241 A 1 -ATOM 4677 C CD . GLU A ? 241 ? 24.052 3.010 -28.294 1.0 73.68 241 A 1 -ATOM 4678 O OE1 . GLU A ? 241 ? 24.533 3.823 -29.116 1.0 65.25 241 A 1 -ATOM 4679 O OE2 . GLU A ? 241 ? 24.613 2.698 -27.206 1.0 66.81 241 A 1 -ATOM 4680 N N . GLY A ? 242 ? 19.508 -0.754 -26.585 1.0 97.87 242 A 1 -ATOM 4681 C CA . GLY A ? 242 ? 19.115 -1.718 -25.571 1.0 98.23 242 A 1 -ATOM 4682 C C . GLY A ? 242 ? 19.123 -3.163 -26.069 1.0 98.62 242 A 1 -ATOM 4683 O O . GLY A ? 242 ? 19.125 -3.452 -27.267 1.0 98.25 242 A 1 -ATOM 4684 N N . SER A ? 243 ? 19.090 -4.085 -25.129 1.0 98.66 243 A 1 -ATOM 4685 C CA . SER A ? 243 ? 19.024 -5.530 -25.369 1.0 98.72 243 A 1 -ATOM 4686 C C . SER A ? 243 ? 17.638 -6.121 -25.091 1.0 98.78 243 A 1 -ATOM 4687 O O . SER A ? 243 ? 17.323 -7.211 -25.565 1.0 98.42 243 A 1 -ATOM 4688 C CB . SER A ? 243 ? 20.095 -6.222 -24.524 1.0 98.49 243 A 1 -ATOM 4689 O OG . SER A ? 243 ? 19.964 -5.877 -23.163 1.0 97.94 243 A 1 -ATOM 4690 N N . VAL A ? 244 ? 16.800 -5.396 -24.360 1.0 98.84 244 A 1 -ATOM 4691 C CA . VAL A ? 244 ? 15.428 -5.812 -24.055 1.0 98.87 244 A 1 -ATOM 4692 C C . VAL A ? 244 ? 14.530 -5.600 -25.277 1.0 98.85 244 A 1 -ATOM 4693 O O . VAL A ? 244 ? 14.489 -4.525 -25.879 1.0 98.73 244 A 1 -ATOM 4694 C CB . VAL A ? 244 ? 14.879 -5.104 -22.808 1.0 98.83 244 A 1 -ATOM 4695 C CG1 . VAL A ? 244 ? 13.486 -5.621 -22.445 1.0 98.38 244 A 1 -ATOM 4696 C CG2 . VAL A ? 244 ? 15.783 -5.341 -21.588 1.0 98.26 244 A 1 -ATOM 4697 N N . THR A ? 245 ? 13.793 -6.649 -25.639 1.0 98.82 245 A 1 -ATOM 4698 C CA . THR A ? 245 ? 12.873 -6.665 -26.786 1.0 98.81 245 A 1 -ATOM 4699 C C . THR A ? 245 ? 11.476 -7.113 -26.368 1.0 98.81 245 A 1 -ATOM 4700 O O . THR A ? 245 ? 11.270 -7.582 -25.250 1.0 98.63 245 A 1 -ATOM 4701 C CB . THR A ? 245 ? 13.383 -7.574 -27.911 1.0 98.71 245 A 1 -ATOM 4702 O OG1 . THR A ? 245 ? 13.284 -8.929 -27.548 1.0 97.9 245 A 1 -ATOM 4703 C CG2 . THR A ? 245 ? 14.818 -7.277 -28.327 1.0 97.44 245 A 1 -ATOM 4704 N N . ALA A ? 246 ? 10.520 -7.038 -27.282 1.0 98.77 246 A 1 -ATOM 4705 C CA . ALA A ? 246 ? 9.168 -7.539 -27.038 1.0 98.71 246 A 1 -ATOM 4706 C C . ALA A ? 246 ? 9.108 -9.053 -26.738 1.0 98.76 246 A 1 -ATOM 4707 O O . ALA A ? 246 ? 8.139 -9.507 -26.143 1.0 98.43 246 A 1 -ATOM 4708 C CB . ALA A ? 246 ? 8.299 -7.183 -28.247 1.0 98.35 246 A 1 -ATOM 4709 N N . ALA A ? 247 ? 10.119 -9.833 -27.137 1.0 98.73 247 A 1 -ATOM 4710 C CA . ALA A ? 247 ? 10.148 -11.284 -26.930 1.0 98.73 247 A 1 -ATOM 4711 C C . ALA A ? 247 ? 10.881 -11.723 -25.651 1.0 98.8 247 A 1 -ATOM 4712 O O . ALA A ? 247 ? 10.614 -12.811 -25.154 1.0 98.56 247 A 1 -ATOM 4713 C CB . ALA A ? 247 ? 10.773 -11.940 -28.162 1.0 98.46 247 A 1 -ATOM 4714 N N . ASN A ? 248 ? 11.802 -10.910 -25.123 1.0 98.76 248 A 1 -ATOM 4715 C CA . ASN A ? 248 ? 12.554 -11.202 -23.892 1.0 98.81 248 A 1 -ATOM 4716 C C . ASN A ? 248 ? 12.129 -10.334 -22.691 1.0 98.88 248 A 1 -ATOM 4717 O O . ASN A ? 248 ? 12.745 -10.395 -21.623 1.0 98.77 248 A 1 -ATOM 4718 C CB . ASN A ? 248 ? 14.067 -11.196 -24.199 1.0 98.64 248 A 1 -ATOM 4719 C CG . ASN A ? 248 ? 14.653 -9.821 -24.494 1.0 98.79 248 A 1 -ATOM 4720 O OD1 . ASN A ? 248 ? 14.179 -8.792 -24.055 1.0 94.09 248 A 1 -ATOM 4721 N ND2 . ASN A ? 248 ? 15.739 -9.769 -25.232 1.0 93.31 248 A 1 -ATOM 4722 N N . ALA A ? 249 ? 11.074 -9.543 -22.862 1.0 98.9 249 A 1 -ATOM 4723 C CA . ALA A ? 249 ? 10.339 -8.859 -21.811 1.0 98.89 249 A 1 -ATOM 4724 C C . ALA A ? 249 ? 9.001 -9.564 -21.548 1.0 98.89 249 A 1 -ATOM 4725 O O . ALA A ? 249 ? 8.442 -10.197 -22.440 1.0 98.74 249 A 1 -ATOM 4726 C CB . ALA A ? 249 ? 10.115 -7.405 -22.238 1.0 98.76 249 A 1 -ATOM 4727 N N . SER A ? 250 ? 8.458 -9.401 -20.348 1.0 98.88 250 A 1 -ATOM 4728 C CA . SER A ? 250 ? 7.058 -9.730 -20.092 1.0 98.85 250 A 1 -ATOM 4729 C C . SER A ? 250 ? 6.124 -8.750 -20.815 1.0 98.82 250 A 1 -ATOM 4730 O O . SER A ? 250 ? 6.497 -7.624 -21.147 1.0 98.57 250 A 1 -ATOM 4731 C CB . SER A ? 250 ? 6.772 -9.772 -18.587 1.0 98.72 250 A 1 -ATOM 4732 O OG . SER A ? 250 ? 6.985 -8.514 -17.981 1.0 98.33 250 A 1 -ATOM 4733 N N . THR A ? 251 ? 4.887 -9.170 -21.033 1.0 98.75 251 A 1 -ATOM 4734 C CA . THR A ? 251 ? 3.853 -8.397 -21.729 1.0 98.75 251 A 1 -ATOM 4735 C C . THR A ? 251 ? 2.930 -7.646 -20.758 1.0 98.78 251 A 1 -ATOM 4736 O O . THR A ? 251 ? 3.047 -7.764 -19.534 1.0 98.41 251 A 1 -ATOM 4737 C CB . THR A ? 251 ? 3.067 -9.327 -22.663 1.0 98.46 251 A 1 -ATOM 4738 O OG1 . THR A ? 251 ? 2.696 -10.496 -21.971 1.0 97.26 251 A 1 -ATOM 4739 C CG2 . THR A ? 251 ? 3.902 -9.758 -23.870 1.0 96.99 251 A 1 -ATOM 4740 N N . LEU A ? 252 ? 2.019 -6.850 -21.300 1.0 98.78 252 A 1 -ATOM 4741 C CA . LEU A ? 252 ? 0.904 -6.259 -20.559 1.0 98.77 252 A 1 -ATOM 4742 C C . LEU A ? 252 ? -0.220 -7.298 -20.466 1.0 98.78 252 A 1 -ATOM 4743 O O . LEU A ? 252 ? -0.643 -7.821 -21.500 1.0 98.4 252 A 1 -ATOM 4744 C CB . LEU A ? 252 ? 0.408 -4.991 -21.267 1.0 98.53 252 A 1 -ATOM 4745 C CG . LEU A ? 252 ? 1.475 -3.906 -21.510 1.0 97.38 252 A 1 -ATOM 4746 C CD1 . LEU A ? 252 ? 0.838 -2.721 -22.238 1.0 95.5 252 A 1 -ATOM 4747 C CD2 . LEU A ? 252 ? 2.094 -3.392 -20.213 1.0 95.0 252 A 1 -ATOM 4748 N N . ASN A ? 253 ? -0.700 -7.596 -19.256 1.0 98.84 253 A 1 -ATOM 4749 C CA . ASN A ? 253 ? -1.608 -8.726 -19.055 1.0 98.9 253 A 1 -ATOM 4750 C C . ASN A ? 253 ? -2.687 -8.469 -18.000 1.0 98.92 253 A 1 -ATOM 4751 O O . ASN A ? 253 ? -2.591 -7.553 -17.182 1.0 98.82 253 A 1 -ATOM 4752 C CB . ASN A ? 253 ? -0.773 -9.968 -18.705 1.0 98.84 253 A 1 -ATOM 4753 C CG . ASN A ? 253 ? 0.162 -10.401 -19.820 1.0 98.81 253 A 1 -ATOM 4754 O OD1 . ASN A ? 253 ? 1.356 -10.161 -19.776 1.0 89.2 253 A 1 -ATOM 4755 N ND2 . ASN A ? 253 ? -0.353 -11.042 -20.844 1.0 89.06 253 A 1 -ATOM 4756 N N . ASP A ? 254 ? -3.686 -9.351 -18.014 1.0 98.92 254 A 1 -ATOM 4757 C CA . ASP A ? 254 ? -4.803 -9.382 -17.077 1.0 98.92 254 A 1 -ATOM 4758 C C . ASP A ? 254 ? -4.849 -10.735 -16.358 1.0 98.93 254 A 1 -ATOM 4759 O O . ASP A ? 254 ? -4.624 -11.782 -16.966 1.0 98.84 254 A 1 -ATOM 4760 C CB . ASP A ? 254 ? -6.118 -9.138 -17.831 1.0 98.83 254 A 1 -ATOM 4761 C CG . ASP A ? 254 ? -6.109 -7.885 -18.708 1.0 98.72 254 A 1 -ATOM 4762 O OD1 . ASP A ? 254 ? -5.635 -6.823 -18.252 1.0 97.92 254 A 1 -ATOM 4763 O OD2 . ASP A ? 254 ? -6.605 -7.945 -19.852 1.0 97.7 254 A 1 -ATOM 4764 N N . GLY A ? 255 ? -5.168 -10.735 -15.064 1.0 98.92 255 A 1 -ATOM 4765 C CA . GLY A ? 255 ? -5.327 -11.970 -14.301 1.0 98.94 255 A 1 -ATOM 4766 C C . GLY A ? 255 ? -5.318 -11.780 -12.790 1.0 98.96 255 A 1 -ATOM 4767 O O . GLY A ? 255 ? -5.023 -10.704 -12.265 1.0 98.92 255 A 1 -ATOM 4768 N N . ALA A ? 256 ? -5.630 -12.860 -12.071 1.0 98.96 256 A 1 -ATOM 4769 C CA . ALA A ? 256 ? -5.582 -12.891 -10.614 1.0 98.97 256 A 1 -ATOM 4770 C C . ALA A ? 256 ? -5.137 -14.259 -10.087 1.0 98.97 256 A 1 -ATOM 4771 O O . ALA A ? 256 ? -5.433 -15.297 -10.679 1.0 98.92 256 A 1 -ATOM 4772 C CB . ALA A ? 256 ? -6.949 -12.489 -10.055 1.0 98.94 256 A 1 -ATOM 4773 N N . ALA A ? 257 ? -4.447 -14.257 -8.945 1.0 98.96 257 A 1 -ATOM 4774 C CA . ALA A ? 257 ? -4.034 -15.452 -8.224 1.0 98.97 257 A 1 -ATOM 4775 C C . ALA A ? 257 ? -4.297 -15.278 -6.727 1.0 98.97 257 A 1 -ATOM 4776 O O . ALA A ? 257 ? -3.986 -14.231 -6.158 1.0 98.93 257 A 1 -ATOM 4777 C CB . ALA A ? 257 ? -2.556 -15.735 -8.507 1.0 98.93 257 A 1 -ATOM 4778 N N . MET A ? 258 ? -4.857 -16.304 -6.086 1.0 98.98 258 A 1 -ATOM 4779 C CA . MET A ? 258 ? -5.210 -16.275 -4.669 1.0 98.98 258 A 1 -ATOM 4780 C C . MET A ? 258 ? -4.737 -17.539 -3.953 1.0 98.98 258 A 1 -ATOM 4781 O O . MET A ? 258 ? -4.656 -18.619 -4.538 1.0 98.92 258 A 1 -ATOM 4782 C CB . MET A ? 258 ? -6.722 -16.095 -4.493 1.0 98.94 258 A 1 -ATOM 4783 C CG . MET A ? 258 ? -7.263 -14.791 -5.085 1.0 98.42 258 A 1 -ATOM 4784 S SD . MET A ? 258 ? -6.752 -13.276 -4.241 1.0 98.21 258 A 1 -ATOM 4785 C CE . MET A ? 258 ? -7.299 -12.062 -5.456 1.0 95.13 258 A 1 -ATOM 4786 N N . VAL A ? 259 ? -4.457 -17.390 -2.659 1.0 98.96 259 A 1 -ATOM 4787 C CA . VAL A ? 259 ? -4.114 -18.490 -1.753 1.0 98.97 259 A 1 -ATOM 4788 C C . VAL A ? 259 ? -4.991 -18.433 -0.506 1.0 98.97 259 A 1 -ATOM 4789 O O . VAL A ? 259 ? -5.393 -17.355 -0.060 1.0 98.94 259 A 1 -ATOM 4790 C CB . VAL A ? 259 ? -2.616 -18.512 -1.383 1.0 98.92 259 A 1 -ATOM 4791 C CG1 . VAL A ? 259 ? -1.730 -18.708 -2.615 1.0 98.54 259 A 1 -ATOM 4792 C CG2 . VAL A ? 259 ? -2.146 -17.244 -0.653 1.0 98.05 259 A 1 -ATOM 4793 N N . VAL A ? 260 ? -5.270 -19.597 0.070 1.0 98.95 260 A 1 -ATOM 4794 C CA . VAL A ? 260 ? -5.947 -19.735 1.364 1.0 98.95 260 A 1 -ATOM 4795 C C . VAL A ? 260 ? -4.921 -20.201 2.386 1.0 98.95 260 A 1 -ATOM 4796 O O . VAL A ? 260 ? -4.232 -21.202 2.173 1.0 98.89 260 A 1 -ATOM 4797 C CB . VAL A ? 260 ? -7.147 -20.692 1.293 1.0 98.92 260 A 1 -ATOM 4798 C CG1 . VAL A ? 260 ? -7.935 -20.673 2.607 1.0 98.64 260 A 1 -ATOM 4799 C CG2 . VAL A ? 260 ? -8.111 -20.323 0.157 1.0 98.63 260 A 1 -ATOM 4800 N N . MET A ? 261 ? -4.823 -19.464 3.485 1.0 98.94 261 A 1 -ATOM 4801 C CA . MET A ? 261 ? -3.827 -19.657 4.534 1.0 98.93 261 A 1 -ATOM 4802 C C . MET A ? 261 ? -4.502 -19.811 5.899 1.0 98.92 261 A 1 -ATOM 4803 O O . MET A ? 261 ? -5.515 -19.179 6.192 1.0 98.77 261 A 1 -ATOM 4804 C CB . MET A ? 261 ? -2.844 -18.481 4.549 1.0 98.86 261 A 1 -ATOM 4805 C CG . MET A ? 261 ? -2.110 -18.276 3.211 1.0 98.46 261 A 1 -ATOM 4806 S SD . MET A ? 261 ? -1.115 -16.760 3.124 1.0 98.42 261 A 1 -ATOM 4807 C CE . MET A ? 261 ? 0.144 -17.109 4.375 1.0 94.78 261 A 1 -ATOM 4808 N N . THR A ? 262 ? -3.912 -20.651 6.738 1.0 98.84 262 A 1 -ATOM 4809 C CA . THR A ? 262 ? -4.345 -20.859 8.124 1.0 98.83 262 A 1 -ATOM 4810 C C . THR A ? 262 ? -3.143 -21.266 8.980 1.0 98.79 262 A 1 -ATOM 4811 O O . THR A ? 262 ? -1.999 -21.270 8.508 1.0 98.58 262 A 1 -ATOM 4812 C CB . THR A ? 262 ? -5.510 -21.875 8.166 1.0 98.73 262 A 1 -ATOM 4813 O OG1 . THR A ? 262 ? -6.068 -21.957 9.457 1.0 97.72 262 A 1 -ATOM 4814 C CG2 . THR A ? 262 ? -5.110 -23.292 7.750 1.0 97.67 262 A 1 -ATOM 4815 N N . THR A ? 263 ? -3.375 -21.598 10.245 1.0 98.66 263 A 1 -ATOM 4816 C CA . THR A ? 263 ? -2.372 -22.214 11.118 1.0 98.54 263 A 1 -ATOM 4817 C C . THR A ? 263 ? -2.479 -23.741 11.073 1.0 98.57 263 A 1 -ATOM 4818 O O . THR A ? 263 ? -3.498 -24.297 10.645 1.0 98.31 263 A 1 -ATOM 4819 C CB . THR A ? 263 ? -2.496 -21.698 12.558 1.0 98.09 263 A 1 -ATOM 4820 O OG1 . THR A ? 263 ? -3.734 -22.074 13.115 1.0 96.46 263 A 1 -ATOM 4821 C CG2 . THR A ? 263 ? -2.381 -20.174 12.637 1.0 96.17 263 A 1 -ATOM 4822 N N . VAL A ? 264 ? -1.449 -24.437 11.558 1.0 98.36 264 A 1 -ATOM 4823 C CA . VAL A ? 264 ? -1.495 -25.904 11.730 1.0 98.21 264 A 1 -ATOM 4824 C C . VAL A ? 264 ? -2.708 -26.327 12.571 1.0 98.25 264 A 1 -ATOM 4825 O O . VAL A ? 264 ? -3.406 -27.279 12.211 1.0 97.74 264 A 1 -ATOM 4826 C CB . VAL A ? 264 ? -0.183 -26.406 12.368 1.0 97.41 264 A 1 -ATOM 4827 C CG1 . VAL A ? 264 ? -0.244 -27.887 12.755 1.0 90.88 264 A 1 -ATOM 4828 C CG2 . VAL A ? 264 ? 0.987 -26.237 11.390 1.0 91.22 264 A 1 -ATOM 4829 N N . ASP A ? 265 ? -3.012 -25.589 13.642 1.0 98.09 265 A 1 -ATOM 4830 C CA . ASP A ? 265 ? -4.185 -25.848 14.484 1.0 97.87 265 A 1 -ATOM 4831 C C . ASP A ? 265 ? -5.501 -25.571 13.745 1.0 98.22 265 A 1 -ATOM 4832 O O . ASP A ? 265 ? -6.428 -26.381 13.814 1.0 97.8 265 A 1 -ATOM 4833 C CB . ASP A ? 265 ? -4.130 -24.985 15.749 1.0 96.89 265 A 1 -ATOM 4834 C CG . ASP A ? 265 ? -2.971 -25.335 16.674 1.0 94.49 265 A 1 -ATOM 4835 O OD1 . ASP A ? 265 ? -2.628 -26.536 16.765 1.0 90.45 265 A 1 -ATOM 4836 O OD2 . ASP A ? 265 ? -2.454 -24.375 17.287 1.0 89.3 265 A 1 -ATOM 4837 N N . GLY A ? 266 ? -5.571 -24.479 12.989 1.0 98.05 266 A 1 -ATOM 4838 C CA . GLY A ? 266 ? -6.733 -24.137 12.171 1.0 98.23 266 A 1 -ATOM 4839 C C . GLY A ? 266 ? -7.027 -25.197 11.104 1.0 98.47 266 A 1 -ATOM 4840 O O . GLY A ? 266 ? -8.177 -25.604 10.931 1.0 98.3 266 A 1 -ATOM 4841 N N . ALA A ? 267 ? -5.982 -25.723 10.456 1.0 98.52 267 A 1 -ATOM 4842 C CA . ALA A ? 267 ? -6.129 -26.816 9.494 1.0 98.6 267 A 1 -ATOM 4843 C C . ALA A ? 267 ? -6.689 -28.089 10.157 1.0 98.57 267 A 1 -ATOM 4844 O O . ALA A ? 267 ? -7.633 -28.687 9.640 1.0 98.31 267 A 1 -ATOM 4845 C CB . ALA A ? 267 ? -4.778 -27.071 8.818 1.0 98.54 267 A 1 -ATOM 4846 N N . LYS A ? 268 ? -6.171 -28.471 11.335 1.0 98.48 268 A 1 -ATOM 4847 C CA . LYS A ? 268 ? -6.703 -29.602 12.114 1.0 98.36 268 A 1 -ATOM 4848 C C . LYS A ? 268 ? -8.160 -29.393 12.515 1.0 98.37 268 A 1 -ATOM 4849 O O . LYS A ? 268 ? -8.979 -30.279 12.306 1.0 97.72 268 A 1 -ATOM 4850 C CB . LYS A ? 268 ? -5.851 -29.833 13.372 1.0 97.78 268 A 1 -ATOM 4851 C CG . LYS A ? 268 ? -4.808 -30.935 13.173 1.0 84.65 268 A 1 -ATOM 4852 C CD . LYS A ? 268 ? -4.028 -31.145 14.468 1.0 81.9 268 A 1 -ATOM 4853 C CE . LYS A ? 268 ? -3.061 -32.324 14.336 1.0 70.74 268 A 1 -ATOM 4854 N NZ . LYS A ? 268 ? -2.201 -32.443 15.540 1.0 62.4 268 A 1 -ATOM 4855 N N . LYS A ? 269 ? -8.474 -28.231 13.072 1.0 98.16 269 A 1 -ATOM 4856 C CA . LYS A ? 269 ? -9.815 -27.870 13.552 1.0 98.07 269 A 1 -ATOM 4857 C C . LYS A ? 269 ? -10.875 -27.946 12.454 1.0 98.18 269 A 1 -ATOM 4858 O O . LYS A ? 269 ? -11.991 -28.391 12.707 1.0 97.49 269 A 1 -ATOM 4859 C CB . LYS A ? 269 ? -9.717 -26.455 14.134 1.0 97.32 269 A 1 -ATOM 4860 C CG . LYS A ? 269 ? -11.041 -25.860 14.634 1.0 94.04 269 A 1 -ATOM 4861 C CD . LYS A ? 269 ? -10.729 -24.448 15.125 1.0 92.51 269 A 1 -ATOM 4862 C CE . LYS A ? 269 ? -11.952 -23.602 15.448 1.0 85.95 269 A 1 -ATOM 4863 N NZ . LYS A ? 269 ? -11.511 -22.202 15.630 1.0 82.03 269 A 1 -ATOM 4864 N N . HIS A ? 270 ? -10.518 -27.542 11.244 1.0 98.3 270 A 1 -ATOM 4865 C CA . HIS A ? 270 ? -11.423 -27.527 10.092 1.0 98.25 270 A 1 -ATOM 4866 C C . HIS A ? 270 ? -11.297 -28.766 9.187 1.0 98.28 270 A 1 -ATOM 4867 O O . HIS A ? 270 ? -11.969 -28.837 8.161 1.0 97.33 270 A 1 -ATOM 4868 C CB . HIS A ? 270 ? -11.247 -26.202 9.343 1.0 98.06 270 A 1 -ATOM 4869 C CG . HIS A ? 270 ? -11.716 -25.018 10.147 1.0 97.73 270 A 1 -ATOM 4870 N ND1 . HIS A ? 270 ? -13.028 -24.756 10.499 1.0 89.3 270 A 1 -ATOM 4871 C CD2 . HIS A ? 270 ? -10.944 -24.031 10.703 1.0 89.79 270 A 1 -ATOM 4872 C CE1 . HIS A ? 270 ? -13.039 -23.643 11.241 1.0 90.3 270 A 1 -ATOM 4873 N NE2 . HIS A ? 270 ? -11.795 -23.169 11.390 1.0 92.0 270 A 1 -ATOM 4874 N N . GLY A ? 271 ? -10.457 -29.748 9.550 1.0 98.13 271 A 1 -ATOM 4875 C CA . GLY A ? 271 ? -10.254 -30.969 8.760 1.0 98.01 271 A 1 -ATOM 4876 C C . GLY A ? 271 ? -9.619 -30.720 7.390 1.0 98.18 271 A 1 -ATOM 4877 O O . GLY A ? 271 ? -9.879 -31.459 6.442 1.0 97.06 271 A 1 -ATOM 4878 N N . LEU A ? 272 ? -8.801 -29.677 7.277 1.0 98.26 272 A 1 -ATOM 4879 C CA . LEU A ? 272 ? -8.142 -29.289 6.033 1.0 98.35 272 A 1 -ATOM 4880 C C . LEU A ? 272 ? -6.794 -29.993 5.904 1.0 98.29 272 A 1 -ATOM 4881 O O . LEU A ? 272 ? -6.076 -30.192 6.886 1.0 97.58 272 A 1 -ATOM 4882 C CB . LEU A ? 272 ? -7.968 -27.762 5.973 1.0 98.28 272 A 1 -ATOM 4883 C CG . LEU A ? 272 ? -9.252 -26.955 6.221 1.0 97.96 272 A 1 -ATOM 4884 C CD1 . LEU A ? 272 ? -8.922 -25.470 6.249 1.0 97.29 272 A 1 -ATOM 4885 C CD2 . LEU A ? 272 ? -10.307 -27.207 5.143 1.0 97.16 272 A 1 -ATOM 4886 N N . LYS A ? 273 ? -6.413 -30.320 4.667 1.0 97.88 273 A 1 -ATOM 4887 C CA . LYS A ? 273 ? -5.102 -30.894 4.372 1.0 97.55 273 A 1 -ATOM 4888 C C . LYS A ? 273 ? -4.127 -29.778 3.994 1.0 98.09 273 A 1 -ATOM 4889 O O . LYS A ? 273 ? -4.283 -29.206 2.914 1.0 97.38 273 A 1 -ATOM 4890 C CB . LYS A ? 273 ? -5.254 -31.969 3.289 1.0 95.61 273 A 1 -ATOM 4891 C CG . LYS A ? 273 ? -3.971 -32.802 3.178 1.0 87.65 273 A 1 -ATOM 4892 C CD . LYS A ? 273 ? -4.148 -33.933 2.156 1.0 81.84 273 A 1 -ATOM 4893 C CE . LYS A ? 273 ? -2.874 -34.781 2.135 1.0 71.34 273 A 1 -ATOM 4894 N NZ . LYS A ? 273 ? -2.961 -35.888 1.160 1.0 62.38 273 A 1 -ATOM 4895 N N . PRO A ? 274 ? -3.108 -29.474 4.822 1.0 98.4 274 A 1 -ATOM 4896 C CA . PRO A ? 274 ? -2.082 -28.514 4.440 1.0 98.48 274 A 1 -ATOM 4897 C C . PRO A ? 274 ? -1.327 -28.985 3.195 1.0 98.6 274 A 1 -ATOM 4898 O O . PRO A ? 274 ? -0.955 -30.154 3.084 1.0 98.15 274 A 1 -ATOM 4899 C CB . PRO A ? 274 ? -1.166 -28.357 5.655 1.0 97.84 274 A 1 -ATOM 4900 C CG . PRO A ? 274 ? -2.014 -28.857 6.822 1.0 95.24 274 A 1 -ATOM 4901 C CD . PRO A ? 274 ? -2.875 -29.938 6.178 1.0 97.79 274 A 1 -ATOM 4902 N N . LEU A ? 275 ? -1.091 -28.073 2.259 1.0 98.75 275 A 1 -ATOM 4903 C CA . LEU A ? 275 ? -0.354 -28.332 1.019 1.0 98.74 275 A 1 -ATOM 4904 C C . LEU A ? 275 ? 1.132 -27.999 1.171 1.0 98.77 275 A 1 -ATOM 4905 O O . LEU A ? 275 ? 1.985 -28.756 0.716 1.0 98.42 275 A 1 -ATOM 4906 C CB . LEU A ? 275 ? -0.985 -27.522 -0.128 1.0 98.6 275 A 1 -ATOM 4907 C CG . LEU A ? 275 ? -2.467 -27.828 -0.424 1.0 98.11 275 A 1 -ATOM 4908 C CD1 . LEU A ? 275 ? -2.955 -26.915 -1.540 1.0 97.22 275 A 1 -ATOM 4909 C CD2 . LEU A ? 275 ? -2.679 -29.280 -0.857 1.0 96.88 275 A 1 -ATOM 4910 N N . ALA A ? 276 ? 1.426 -26.878 1.824 1.0 98.79 276 A 1 -ATOM 4911 C CA . ALA A ? 276 ? 2.775 -26.422 2.124 1.0 98.86 276 A 1 -ATOM 4912 C C . ALA A ? 276 ? 2.782 -25.569 3.400 1.0 98.9 276 A 1 -ATOM 4913 O O . ALA A ? 276 ? 1.759 -24.985 3.762 1.0 98.81 276 A 1 -ATOM 4914 C CB . ALA A ? 276 ? 3.310 -25.635 0.921 1.0 98.78 276 A 1 -ATOM 4915 N N . ARG A ? 277 ? 3.932 -25.467 4.069 1.0 98.8 277 A 1 -ATOM 4916 C CA . ARG A ? 277 ? 4.168 -24.538 5.185 1.0 98.74 277 A 1 -ATOM 4917 C C . ARG A ? 277 ? 5.083 -23.392 4.761 1.0 98.83 277 A 1 -ATOM 4918 O O . ARG A ? 277 ? 5.940 -23.566 3.897 1.0 98.7 277 A 1 -ATOM 4919 C CB . ARG A ? 277 ? 4.706 -25.286 6.414 1.0 98.05 277 A 1 -ATOM 4920 C CG . ARG A ? 277 ? 6.086 -25.925 6.186 1.0 95.02 277 A 1 -ATOM 4921 C CD . ARG A ? 277 ? 6.591 -26.688 7.417 1.0 93.98 277 A 1 -ATOM 4922 N NE . ARG A ? 277 ? 5.681 -27.799 7.772 1.0 88.66 277 A 1 -ATOM 4923 C CZ . ARG A ? 277 ? 5.868 -28.691 8.722 1.0 87.92 277 A 1 -ATOM 4924 N NH1 . ARG A ? 277 ? 6.937 -28.701 9.455 1.0 79.35 277 A 1 -ATOM 4925 N NH2 . ARG A ? 277 ? 4.967 -29.603 8.945 1.0 79.53 277 A 1 -ATOM 4926 N N . MET A ? 278 ? 4.934 -22.248 5.406 1.0 98.75 278 A 1 -ATOM 4927 C CA . MET A ? 278 ? 5.850 -21.119 5.260 1.0 98.73 278 A 1 -ATOM 4928 C C . MET A ? 278 ? 7.145 -21.404 6.031 1.0 98.66 278 A 1 -ATOM 4929 O O . MET A ? 278 ? 7.096 -21.821 7.186 1.0 98.27 278 A 1 -ATOM 4930 C CB . MET A ? 278 ? 5.148 -19.852 5.772 1.0 98.5 278 A 1 -ATOM 4931 C CG . MET A ? 278 ? 5.931 -18.569 5.470 1.0 96.71 278 A 1 -ATOM 4932 S SD . MET A ? 278 ? 6.023 -18.101 3.719 1.0 96.88 278 A 1 -ATOM 4933 C CE . MET A ? 278 ? 4.342 -17.492 3.472 1.0 93.16 278 A 1 -ATOM 4934 N N . LEU A ? 279 ? 8.304 -21.165 5.422 1.0 98.67 279 A 1 -ATOM 4935 C CA . LEU A ? 279 ? 9.607 -21.229 6.097 1.0 98.6 279 A 1 -ATOM 4936 C C . LEU A ? 279 ? 10.223 -19.844 6.302 1.0 98.39 279 A 1 -ATOM 4937 O O . LEU A ? 279 ? 10.869 -19.602 7.316 1.0 97.8 279 A 1 -ATOM 4938 C CB . LEU A ? 279 ? 10.579 -22.134 5.323 1.0 98.61 279 A 1 -ATOM 4939 C CG . LEU A ? 279 ? 10.155 -23.599 5.140 1.0 98.18 279 A 1 -ATOM 4940 C CD1 . LEU A ? 279 ? 11.297 -24.362 4.465 1.0 97.57 279 A 1 -ATOM 4941 C CD2 . LEU A ? 279 ? 9.829 -24.302 6.456 1.0 97.38 279 A 1 -ATOM 4942 N N . ALA A ? 280 ? 10.032 -18.940 5.346 1.0 98.63 280 A 1 -ATOM 4943 C CA . ALA A ? 280 ? 10.471 -17.555 5.448 1.0 98.66 280 A 1 -ATOM 4944 C C . ALA A ? 280 ? 9.702 -16.655 4.478 1.0 98.76 280 A 1 -ATOM 4945 O O . ALA A ? 280 ? 9.296 -17.080 3.397 1.0 98.64 280 A 1 -ATOM 4946 C CB . ALA A ? 280 ? 11.976 -17.472 5.158 1.0 98.41 280 A 1 -ATOM 4947 N N . TYR A ? 281 ? 9.588 -15.386 4.836 1.0 98.71 281 A 1 -ATOM 4948 C CA . TYR A ? 281 ? 9.196 -14.303 3.935 1.0 98.63 281 A 1 -ATOM 4949 C C . TYR A ? 281 ? 10.032 -13.064 4.245 1.0 98.55 281 A 1 -ATOM 4950 O O . TYR A ? 281 ? 10.495 -12.880 5.373 1.0 98.08 281 A 1 -ATOM 4951 C CB . TYR A ? 281 ? 7.688 -14.032 4.034 1.0 98.46 281 A 1 -ATOM 4952 C CG . TYR A ? 281 ? 7.200 -13.642 5.415 1.0 98.52 281 A 1 -ATOM 4953 C CD1 . TYR A ? 281 ? 6.736 -14.632 6.313 1.0 98.08 281 A 1 -ATOM 4954 C CD2 . TYR A ? 281 ? 7.198 -12.293 5.818 1.0 98.05 281 A 1 -ATOM 4955 C CE1 . TYR A ? 281 ? 6.281 -14.280 7.593 1.0 97.69 281 A 1 -ATOM 4956 C CE2 . TYR A ? 281 ? 6.746 -11.929 7.100 1.0 97.67 281 A 1 -ATOM 4957 C CZ . TYR A ? 281 ? 6.289 -12.928 7.985 1.0 97.86 281 A 1 -ATOM 4958 O OH . TYR A ? 281 ? 5.848 -12.573 9.231 1.0 96.96 281 A 1 -ATOM 4959 N N . GLY A ? 282 ? 10.266 -12.224 3.246 1.0 98.68 282 A 1 -ATOM 4960 C CA . GLY A ? 282 ? 11.074 -11.027 3.421 1.0 98.67 282 A 1 -ATOM 4961 C C . GLY A ? 282 ? 11.079 -10.132 2.193 1.0 98.82 282 A 1 -ATOM 4962 O O . GLY A ? 282 ? 10.578 -10.488 1.127 1.0 98.62 282 A 1 -ATOM 4963 N N . ASP A ? 283 ? 11.678 -8.964 2.370 1.0 98.79 283 A 1 -ATOM 4964 C CA . ASP A ? 283 ? 11.811 -7.953 1.332 1.0 98.74 283 A 1 -ATOM 4965 C C . ASP A ? 283 ? 13.245 -7.407 1.322 1.0 98.75 283 A 1 -ATOM 4966 O O . ASP A ? 283 ? 13.931 -7.346 2.349 1.0 98.31 283 A 1 -ATOM 4967 C CB . ASP A ? 283 ? 10.799 -6.825 1.573 1.0 98.38 283 A 1 -ATOM 4968 C CG . ASP A ? 283 ? 9.330 -7.250 1.468 1.0 97.13 283 A 1 -ATOM 4969 O OD1 . ASP A ? 283 ? 8.811 -7.294 0.329 1.0 92.27 283 A 1 -ATOM 4970 O OD2 . ASP A ? 283 ? 8.665 -7.406 2.512 1.0 91.59 283 A 1 -ATOM 4971 N N . ALA A ? 284 ? 13.693 -6.980 0.147 1.0 98.74 284 A 1 -ATOM 4972 C CA . ALA A ? 284 ? 14.907 -6.203 -0.041 1.0 98.73 284 A 1 -ATOM 4973 C C . ALA A ? 284 ? 14.616 -5.027 -0.978 1.0 98.78 284 A 1 -ATOM 4974 O O . ALA A ? 284 ? 13.662 -5.062 -1.754 1.0 98.37 284 A 1 -ATOM 4975 C CB . ALA A ? 284 ? 16.027 -7.109 -0.571 1.0 98.39 284 A 1 -ATOM 4976 N N . ALA A ? 285 ? 15.435 -3.986 -0.913 1.0 98.62 285 A 1 -ATOM 4977 C CA . ALA A ? 285 ? 15.344 -2.849 -1.816 1.0 98.65 285 A 1 -ATOM 4978 C C . ALA A ? 285 ? 16.724 -2.238 -2.081 1.0 98.65 285 A 1 -ATOM 4979 O O . ALA A ? 285 ? 17.653 -2.385 -1.287 1.0 98.19 285 A 1 -ATOM 4980 C CB . ALA A ? 285 ? 14.338 -1.832 -1.255 1.0 98.36 285 A 1 -ATOM 4981 N N . THR A ? 286 ? 16.842 -1.555 -3.225 1.0 98.48 286 A 1 -ATOM 4982 C CA . THR A ? 286 ? 18.040 -0.848 -3.690 1.0 98.46 286 A 1 -ATOM 4983 C C . THR A ? 286 ? 17.628 0.383 -4.510 1.0 98.5 286 A 1 -ATOM 4984 O O . THR A ? 286 ? 16.470 0.812 -4.450 1.0 98.04 286 A 1 -ATOM 4985 C CB . THR A ? 286 ? 18.949 -1.830 -4.456 1.0 98.01 286 A 1 -ATOM 4986 O OG1 . THR A ? 286 ? 20.184 -1.208 -4.735 1.0 96.27 286 A 1 -ATOM 4987 C CG2 . THR A ? 286 ? 18.361 -2.328 -5.778 1.0 95.91 286 A 1 -ATOM 4988 N N . HIS A ? 287 ? 18.548 0.970 -5.266 1.0 98.36 287 A 1 -ATOM 4989 C CA . HIS A ? 287 ? 18.238 2.094 -6.151 1.0 98.28 287 A 1 -ATOM 4990 C C . HIS A ? 287 ? 17.110 1.739 -7.135 1.0 98.41 287 A 1 -ATOM 4991 O O . HIS A ? 287 ? 17.127 0.651 -7.711 1.0 98.17 287 A 1 -ATOM 4992 C CB . HIS A ? 287 ? 19.496 2.530 -6.905 1.0 98.02 287 A 1 -ATOM 4993 C CG . HIS A ? 287 ? 20.516 3.160 -6.003 1.0 95.47 287 A 1 -ATOM 4994 N ND1 . HIS A ? 287 ? 20.454 4.433 -5.476 1.0 84.3 287 A 1 -ATOM 4995 C CD2 . HIS A ? 287 ? 21.658 2.580 -5.505 1.0 84.43 287 A 1 -ATOM 4996 C CE1 . HIS A ? 287 ? 21.530 4.614 -4.696 1.0 86.93 287 A 1 -ATOM 4997 N NE2 . HIS A ? 287 ? 22.286 3.509 -4.685 1.0 87.94 287 A 1 -ATOM 4998 N N . PRO A ? 288 ? 16.146 2.648 -7.372 1.0 98.27 288 A 1 -ATOM 4999 C CA . PRO A ? 288 ? 14.967 2.371 -8.205 1.0 98.22 288 A 1 -ATOM 5000 C C . PRO A ? 288 ? 15.285 1.774 -9.582 1.0 98.29 288 A 1 -ATOM 5001 O O . PRO A ? 288 ? 14.676 0.780 -9.982 1.0 98.17 288 A 1 -ATOM 5002 C CB . PRO A ? 288 ? 14.253 3.720 -8.318 1.0 98.14 288 A 1 -ATOM 5003 C CG . PRO A ? 288 ? 14.554 4.375 -6.973 1.0 97.71 288 A 1 -ATOM 5004 C CD . PRO A ? 288 ? 15.995 3.939 -6.706 1.0 98.35 288 A 1 -ATOM 5005 N N . ILE A ? 289 ? 16.287 2.327 -10.269 1.0 98.46 289 A 1 -ATOM 5006 C CA . ILE A ? 289 ? 16.712 1.869 -11.599 1.0 98.56 289 A 1 -ATOM 5007 C C . ILE A ? 289 ? 17.272 0.433 -11.593 1.0 98.62 289 A 1 -ATOM 5008 O O . ILE A ? 289 ? 17.291 -0.235 -12.625 1.0 98.35 289 A 1 -ATOM 5009 C CB . ILE A ? 289 ? 17.719 2.888 -12.183 1.0 98.31 289 A 1 -ATOM 5010 C CG1 . ILE A ? 289 ? 17.837 2.717 -13.710 1.0 96.72 289 A 1 -ATOM 5011 C CG2 . ILE A ? 289 ? 19.104 2.803 -11.495 1.0 96.35 289 A 1 -ATOM 5012 C CD1 . ILE A ? 289 ? 18.591 3.852 -14.410 1.0 94.81 289 A 1 -ATOM 5013 N N . ASP A ? 290 ? 17.696 -0.058 -10.434 1.0 98.62 290 A 1 -ATOM 5014 C CA . ASP A ? 290 ? 18.326 -1.364 -10.253 1.0 98.64 290 A 1 -ATOM 5015 C C . ASP A ? 290 ? 17.359 -2.438 -9.733 1.0 98.68 290 A 1 -ATOM 5016 O O . ASP A ? 290 ? 17.801 -3.474 -9.229 1.0 98.36 290 A 1 -ATOM 5017 C CB . ASP A ? 290 ? 19.590 -1.207 -9.386 1.0 98.48 290 A 1 -ATOM 5018 C CG . ASP A ? 290 ? 20.709 -0.493 -10.141 1.0 98.32 290 A 1 -ATOM 5019 O OD1 . ASP A ? 290 ? 20.952 -0.857 -11.313 1.0 96.8 290 A 1 -ATOM 5020 O OD2 . ASP A ? 290 ? 21.356 0.421 -9.599 1.0 96.78 290 A 1 -ATOM 5021 N N . PHE A ? 291 ? 16.039 -2.261 -9.885 1.0 98.7 291 A 1 -ATOM 5022 C CA . PHE A ? 291 ? 15.062 -3.267 -9.432 1.0 98.69 291 A 1 -ATOM 5023 C C . PHE A ? 291 ? 15.372 -4.687 -9.942 1.0 98.77 291 A 1 -ATOM 5024 O O . PHE A ? 291 ? 15.090 -5.667 -9.254 1.0 98.59 291 A 1 -ATOM 5025 C CB . PHE A ? 291 ? 13.635 -2.853 -9.831 1.0 98.45 291 A 1 -ATOM 5026 C CG . PHE A ? 291 ? 13.309 -3.013 -11.305 1.0 98.53 291 A 1 -ATOM 5027 C CD1 . PHE A ? 291 ? 13.333 -1.904 -12.161 1.0 97.35 291 A 1 -ATOM 5028 C CD2 . PHE A ? 291 ? 13.026 -4.286 -11.842 1.0 97.3 291 A 1 -ATOM 5029 C CE1 . PHE A ? 291 ? 13.099 -2.066 -13.538 1.0 96.34 291 A 1 -ATOM 5030 C CE2 . PHE A ? 291 ? 12.803 -4.455 -13.221 1.0 95.97 291 A 1 -ATOM 5031 C CZ . PHE A ? 291 ? 12.845 -3.342 -14.066 1.0 97.17 291 A 1 -ATOM 5032 N N . GLY A ? 292 ? 15.978 -4.805 -11.117 1.0 98.63 292 A 1 -ATOM 5033 C CA . GLY A ? 292 ? 16.318 -6.090 -11.732 1.0 98.65 292 A 1 -ATOM 5034 C C . GLY A ? 292 ? 17.322 -6.929 -10.932 1.0 98.76 292 A 1 -ATOM 5035 O O . GLY A ? 292 ? 17.324 -8.153 -11.052 1.0 98.49 292 A 1 -ATOM 5036 N N . ILE A ? 293 ? 18.134 -6.304 -10.077 1.0 98.81 293 A 1 -ATOM 5037 C CA . ILE A ? 293 ? 19.112 -7.000 -9.222 1.0 98.76 293 A 1 -ATOM 5038 C C . ILE A ? 293 ? 18.555 -7.339 -7.830 1.0 98.8 293 A 1 -ATOM 5039 O O . ILE A ? 293 ? 19.136 -8.153 -7.114 1.0 98.43 293 A 1 -ATOM 5040 C CB . ILE A ? 293 ? 20.454 -6.234 -9.140 1.0 98.4 293 A 1 -ATOM 5041 C CG1 . ILE A ? 293 ? 20.385 -4.991 -8.228 1.0 96.55 293 A 1 -ATOM 5042 C CG2 . ILE A ? 293 ? 20.951 -5.862 -10.554 1.0 95.32 293 A 1 -ATOM 5043 C CD1 . ILE A ? 293 ? 21.734 -4.298 -7.987 1.0 94.17 293 A 1 -ATOM 5044 N N . ALA A ? 294 ? 17.426 -6.742 -7.437 1.0 98.8 294 A 1 -ATOM 5045 C CA . ALA A ? 294 ? 16.874 -6.885 -6.092 1.0 98.83 294 A 1 -ATOM 5046 C C . ALA A ? 294 ? 16.475 -8.332 -5.706 1.0 98.87 294 A 1 -ATOM 5047 O O . ALA A ? 294 ? 16.649 -8.685 -4.536 1.0 98.8 294 A 1 -ATOM 5048 C CB . ALA A ? 294 ? 15.731 -5.876 -5.912 1.0 98.74 294 A 1 -ATOM 5049 N N . PRO A ? 295 ? 16.029 -9.219 -6.624 1.0 98.88 295 A 1 -ATOM 5050 C CA . PRO A ? 295 ? 15.832 -10.638 -6.306 1.0 98.89 295 A 1 -ATOM 5051 C C . PRO A ? 295 ? 17.097 -11.326 -5.779 1.0 98.9 295 A 1 -ATOM 5052 O O . PRO A ? 295 ? 17.022 -12.093 -4.820 1.0 98.85 295 A 1 -ATOM 5053 C CB . PRO A ? 295 ? 15.327 -11.287 -7.597 1.0 98.83 295 A 1 -ATOM 5054 C CG . PRO A ? 295 ? 14.617 -10.137 -8.299 1.0 98.45 295 A 1 -ATOM 5055 C CD . PRO A ? 295 ? 15.505 -8.942 -7.950 1.0 98.83 295 A 1 -ATOM 5056 N N . ALA A ? 296 ? 18.271 -10.993 -6.327 1.0 98.87 296 A 1 -ATOM 5057 C CA . ALA A ? 296 ? 19.548 -11.525 -5.849 1.0 98.84 296 A 1 -ATOM 5058 C C . ALA A ? 296 ? 19.907 -11.051 -4.426 1.0 98.84 296 A 1 -ATOM 5059 O O . ALA A ? 296 ? 20.702 -11.696 -3.748 1.0 98.59 296 A 1 -ATOM 5060 C CB . ALA A ? 296 ? 20.644 -11.158 -6.856 1.0 98.68 296 A 1 -ATOM 5061 N N . SER A ? 297 ? 19.297 -9.964 -3.947 1.0 98.84 297 A 1 -ATOM 5062 C CA . SER A ? 297 ? 19.448 -9.466 -2.574 1.0 98.76 297 A 1 -ATOM 5063 C C . SER A ? 297 ? 18.429 -10.070 -1.604 1.0 98.84 297 A 1 -ATOM 5064 O O . SER A ? 297 ? 18.758 -10.322 -0.447 1.0 98.56 297 A 1 -ATOM 5065 C CB . SER A ? 297 ? 19.328 -7.939 -2.549 1.0 98.27 297 A 1 -ATOM 5066 O OG . SER A ? 297 ? 20.331 -7.353 -3.350 1.0 90.91 297 A 1 -ATOM 5067 N N . VAL A ? 298 ? 17.194 -10.323 -2.048 1.0 98.85 298 A 1 -ATOM 5068 C CA . VAL A ? 298 ? 16.157 -10.891 -1.172 1.0 98.89 298 A 1 -ATOM 5069 C C . VAL A ? 298 ? 16.361 -12.385 -0.919 1.0 98.91 298 A 1 -ATOM 5070 O O . VAL A ? 298 ? 16.130 -12.846 0.196 1.0 98.86 298 A 1 -ATOM 5071 C CB . VAL A ? 298 ? 14.735 -10.566 -1.673 1.0 98.77 298 A 1 -ATOM 5072 C CG1 . VAL A ? 298 ? 14.242 -11.461 -2.803 1.0 98.03 298 A 1 -ATOM 5073 C CG2 . VAL A ? 298 ? 13.730 -10.644 -0.517 1.0 97.05 298 A 1 -ATOM 5074 N N . ILE A ? 299 ? 16.841 -13.136 -1.915 1.0 98.9 299 A 1 -ATOM 5075 C CA . ILE A ? 299 ? 17.052 -14.587 -1.800 1.0 98.91 299 A 1 -ATOM 5076 C C . ILE A ? 299 ? 18.001 -14.942 -0.639 1.0 98.89 299 A 1 -ATOM 5077 O O . ILE A ? 299 ? 17.598 -15.727 0.218 1.0 98.86 299 A 1 -ATOM 5078 C CB . ILE A ? 299 ? 17.463 -15.196 -3.160 1.0 98.91 299 A 1 -ATOM 5079 C CG1 . ILE A ? 299 ? 16.236 -15.248 -4.097 1.0 98.75 299 A 1 -ATOM 5080 C CG2 . ILE A ? 299 ? 18.067 -16.606 -2.989 1.0 98.77 299 A 1 -ATOM 5081 C CD1 . ILE A ? 299 ? 16.589 -15.515 -5.567 1.0 98.43 299 A 1 -ATOM 5082 N N . PRO A ? 300 ? 19.207 -14.353 -0.512 1.0 98.89 300 A 1 -ATOM 5083 C CA . PRO A ? 300 ? 20.075 -14.603 0.647 1.0 98.83 300 A 1 -ATOM 5084 C C . PRO A ? 300 ? 19.423 -14.242 1.987 1.0 98.79 300 A 1 -ATOM 5085 O O . PRO A ? 300 ? 19.655 -14.915 2.993 1.0 98.57 300 A 1 -ATOM 5086 C CB . PRO A ? 300 ? 21.336 -13.765 0.409 1.0 98.66 300 A 1 -ATOM 5087 C CG . PRO A ? 300 ? 21.381 -13.608 -1.108 1.0 97.73 300 A 1 -ATOM 5088 C CD . PRO A ? 300 ? 19.903 -13.517 -1.477 1.0 98.72 300 A 1 -ATOM 5089 N N . LYS A ? 301 ? 18.582 -13.204 2.012 1.0 98.79 301 A 1 -ATOM 5090 C CA . LYS A ? 301 ? 17.853 -12.770 3.210 1.0 98.64 301 A 1 -ATOM 5091 C C . LYS A ? 301 ? 16.869 -13.839 3.687 1.0 98.64 301 A 1 -ATOM 5092 O O . LYS A ? 301 ? 16.901 -14.222 4.853 1.0 98.22 301 A 1 -ATOM 5093 C CB . LYS A ? 301 ? 17.137 -11.435 2.927 1.0 98.14 301 A 1 -ATOM 5094 C CG . LYS A ? 301 ? 17.550 -10.303 3.873 1.0 90.5 301 A 1 -ATOM 5095 C CD . LYS A ? 301 ? 16.775 -9.029 3.524 1.0 90.17 301 A 1 -ATOM 5096 C CE . LYS A ? 301 ? 17.145 -7.854 4.442 1.0 82.51 301 A 1 -ATOM 5097 N NZ . LYS A ? 301 ? 16.352 -6.643 4.111 1.0 75.42 301 A 1 -ATOM 5098 N N . VAL A ? 302 ? 16.026 -14.350 2.782 1.0 98.69 302 A 1 -ATOM 5099 C CA . VAL A ? 302 ? 15.024 -15.371 3.139 1.0 98.75 302 A 1 -ATOM 5100 C C . VAL A ? 302 ? 15.656 -16.743 3.392 1.0 98.73 302 A 1 -ATOM 5101 O O . VAL A ? 302 ? 15.226 -17.440 4.306 1.0 98.61 302 A 1 -ATOM 5102 C CB . VAL A ? 302 ? 13.858 -15.456 2.130 1.0 98.69 302 A 1 -ATOM 5103 C CG1 . VAL A ? 302 ? 13.057 -14.150 2.130 1.0 98.13 302 A 1 -ATOM 5104 C CG2 . VAL A ? 302 ? 14.284 -15.777 0.698 1.0 97.21 302 A 1 -ATOM 5105 N N . LEU A ? 303 ? 16.736 -17.101 2.684 1.0 98.8 303 A 1 -ATOM 5106 C CA . LEU A ? 303 ? 17.524 -18.302 2.991 1.0 98.77 303 A 1 -ATOM 5107 C C . LEU A ? 303 ? 18.063 -18.255 4.426 1.0 98.64 303 A 1 -ATOM 5108 O O . LEU A ? 303 ? 17.876 -19.202 5.190 1.0 98.44 303 A 1 -ATOM 5109 C CB . LEU A ? 303 ? 18.690 -18.440 1.995 1.0 98.81 303 A 1 -ATOM 5110 C CG . LEU A ? 303 ? 18.297 -18.952 0.597 1.0 98.58 303 A 1 -ATOM 5111 C CD1 . LEU A ? 303 ? 19.489 -18.806 -0.347 1.0 98.23 303 A 1 -ATOM 5112 C CD2 . LEU A ? 303 ? 17.898 -20.427 0.618 1.0 98.21 303 A 1 -ATOM 5113 N N . LYS A ? 304 ? 18.662 -17.128 4.825 1.0 98.61 304 A 1 -ATOM 5114 C CA . LYS A ? 304 ? 19.174 -16.941 6.188 1.0 98.43 304 A 1 -ATOM 5115 C C . LYS A ? 304 ? 18.063 -17.016 7.241 1.0 98.24 304 A 1 -ATOM 5116 O O . LYS A ? 304 ? 18.275 -17.615 8.291 1.0 97.77 304 A 1 -ATOM 5117 C CB . LYS A ? 304 ? 19.941 -15.614 6.256 1.0 98.28 304 A 1 -ATOM 5118 C CG . LYS A ? 304 ? 20.656 -15.437 7.605 1.0 94.77 304 A 1 -ATOM 5119 C CD . LYS A ? 304 ? 21.455 -14.131 7.632 1.0 90.11 304 A 1 -ATOM 5120 C CE . LYS A ? 304 ? 22.163 -13.996 8.984 1.0 80.7 304 A 1 -ATOM 5121 N NZ . LYS A ? 304 ? 22.948 -12.742 9.080 1.0 70.96 304 A 1 -ATOM 5122 N N . LEU A ? 305 ? 16.896 -16.433 6.967 1.0 98.2 305 A 1 -ATOM 5123 C CA . LEU A ? 305 ? 15.732 -16.503 7.864 1.0 97.78 305 A 1 -ATOM 5124 C C . LEU A ? 305 ? 15.210 -17.939 8.025 1.0 97.78 305 A 1 -ATOM 5125 O O . LEU A ? 305 ? 14.829 -18.327 9.127 1.0 97.04 305 A 1 -ATOM 5126 C CB . LEU A ? 305 ? 14.614 -15.586 7.332 1.0 97.26 305 A 1 -ATOM 5127 C CG . LEU A ? 305 ? 14.868 -14.076 7.523 1.0 95.82 305 A 1 -ATOM 5128 C CD1 . LEU A ? 305 ? 13.832 -13.279 6.736 1.0 94.15 305 A 1 -ATOM 5129 C CD2 . LEU A ? 305 ? 14.783 -13.658 8.993 1.0 93.96 305 A 1 -ATOM 5130 N N . ALA A ? 306 ? 15.239 -18.735 6.955 1.0 97.99 306 A 1 -ATOM 5131 C CA . ALA A ? 306 ? 14.838 -20.143 6.983 1.0 98.16 306 A 1 -ATOM 5132 C C . ALA A ? 306 ? 15.929 -21.088 7.533 1.0 98.21 306 A 1 -ATOM 5133 O O . ALA A ? 306 ? 15.657 -22.265 7.762 1.0 97.86 306 A 1 -ATOM 5134 C CB . ALA A ? 306 ? 14.413 -20.543 5.565 1.0 98.24 306 A 1 -ATOM 5135 N N . GLY A ? 307 ? 17.158 -20.601 7.727 1.0 98.11 307 A 1 -ATOM 5136 C CA . GLY A ? 307 ? 18.308 -21.434 8.110 1.0 98.13 307 A 1 -ATOM 5137 C C . GLY A ? 307 ? 18.751 -22.395 7.000 1.0 98.42 307 A 1 -ATOM 5138 O O . GLY A ? 307 ? 19.216 -23.494 7.295 1.0 97.95 307 A 1 -ATOM 5139 N N . LEU A ? 308 ? 18.594 -21.996 5.741 1.0 98.46 308 A 1 -ATOM 5140 C CA . LEU A ? 308 ? 18.860 -22.818 4.560 1.0 98.65 308 A 1 -ATOM 5141 C C . LEU A ? 308 ? 19.997 -22.249 3.702 1.0 98.72 308 A 1 -ATOM 5142 O O . LEU A ? 308 ? 20.370 -21.079 3.791 1.0 98.5 308 A 1 -ATOM 5143 C CB . LEU A ? 308 ? 17.566 -22.975 3.740 1.0 98.59 308 A 1 -ATOM 5144 C CG . LEU A ? 308 ? 16.416 -23.705 4.453 1.0 98.27 308 A 1 -ATOM 5145 C CD1 . LEU A ? 308 ? 15.190 -23.710 3.542 1.0 97.65 308 A 1 -ATOM 5146 C CD2 . LEU A ? 308 ? 16.758 -25.156 4.803 1.0 97.6 308 A 1 -ATOM 5147 N N . GLN A ? 309 ? 20.517 -23.089 2.815 1.0 98.71 309 A 1 -ATOM 5148 C CA . GLN A ? 309 ? 21.452 -22.722 1.756 1.0 98.7 309 A 1 -ATOM 5149 C C . GLN A ? 309 ? 20.797 -22.918 0.384 1.0 98.81 309 A 1 -ATOM 5150 O O . GLN A ? 309 ? 19.776 -23.591 0.257 1.0 98.56 309 A 1 -ATOM 5151 C CB . GLN A ? 309 ? 22.738 -23.554 1.879 1.0 98.29 309 A 1 -ATOM 5152 C CG . GLN A ? 309 ? 23.463 -23.318 3.213 1.0 94.91 309 A 1 -ATOM 5153 C CD . GLN A ? 309 ? 24.826 -24.010 3.296 1.0 87.88 309 A 1 -ATOM 5154 O OE1 . GLN A ? 309 ? 25.244 -24.796 2.457 1.0 76.53 309 A 1 -ATOM 5155 N NE2 . GLN A ? 309 ? 25.587 -23.733 4.330 1.0 73.39 309 A 1 -ATOM 5156 N N . ILE A ? 310 ? 21.421 -22.376 -0.665 1.0 98.77 310 A 1 -ATOM 5157 C CA . ILE A ? 310 ? 20.942 -22.512 -2.056 1.0 98.77 310 A 1 -ATOM 5158 C C . ILE A ? 310 ? 20.687 -23.984 -2.435 1.0 98.77 310 A 1 -ATOM 5159 O O . ILE A ? 310 ? 19.664 -24.299 -3.034 1.0 98.51 310 A 1 -ATOM 5160 C CB . ILE A ? 310 ? 21.958 -21.842 -3.013 1.0 98.56 310 A 1 -ATOM 5161 C CG1 . ILE A ? 310 ? 21.879 -20.308 -2.845 1.0 97.38 310 A 1 -ATOM 5162 C CG2 . ILE A ? 310 ? 21.724 -22.239 -4.484 1.0 97.75 310 A 1 -ATOM 5163 C CD1 . ILE A ? 310 ? 23.030 -19.542 -3.500 1.0 93.79 310 A 1 -ATOM 5164 N N . LYS A ? 311 ? 21.587 -24.894 -2.035 1.0 98.64 311 A 1 -ATOM 5165 C CA . LYS A ? 311 ? 21.490 -26.336 -2.326 1.0 98.49 311 A 1 -ATOM 5166 C C . LYS A ? 311 ? 20.258 -27.025 -1.723 1.0 98.61 311 A 1 -ATOM 5167 O O . LYS A ? 311 ? 19.901 -28.104 -2.180 1.0 98.16 311 A 1 -ATOM 5168 C CB . LYS A ? 311 ? 22.782 -27.036 -1.867 1.0 97.88 311 A 1 -ATOM 5169 C CG . LYS A ? 311 ? 22.930 -27.028 -0.336 1.0 91.96 311 A 1 -ATOM 5170 C CD . LYS A ? 311 ? 24.192 -27.760 0.134 1.0 87.77 311 A 1 -ATOM 5171 C CE . LYS A ? 311 ? 24.131 -27.769 1.660 1.0 76.02 311 A 1 -ATOM 5172 N NZ . LYS A ? 311 ? 25.306 -28.428 2.272 1.0 68.23 311 A 1 -ATOM 5173 N N . ASP A ? 312 ? 19.643 -26.425 -0.700 1.0 98.69 312 A 1 -ATOM 5174 C CA . ASP A ? 312 ? 18.481 -26.992 -0.004 1.0 98.72 312 A 1 -ATOM 5175 C C . ASP A ? 312 ? 17.156 -26.671 -0.718 1.0 98.81 312 A 1 -ATOM 5176 O O . ASP A ? 312 ? 16.105 -27.206 -0.341 1.0 98.61 312 A 1 -ATOM 5177 C CB . ASP A ? 312 ? 18.450 -26.485 1.449 1.0 98.61 312 A 1 -ATOM 5178 C CG . ASP A ? 312 ? 19.736 -26.773 2.232 1.0 98.41 312 A 1 -ATOM 5179 O OD1 . ASP A ? 312 ? 20.238 -27.920 2.168 1.0 96.98 312 A 1 -ATOM 5180 O OD2 . ASP A ? 312 ? 20.240 -25.834 2.890 1.0 96.98 312 A 1 -ATOM 5181 N N . ILE A ? 313 ? 17.204 -25.810 -1.737 1.0 98.82 313 A 1 -ATOM 5182 C CA . ILE A ? 313 ? 16.049 -25.444 -2.558 1.0 98.88 313 A 1 -ATOM 5183 C C . ILE A ? 313 ? 15.959 -26.377 -3.772 1.0 98.88 313 A 1 -ATOM 5184 O O . ILE A ? 313 ? 16.887 -26.475 -4.575 1.0 98.77 313 A 1 -ATOM 5185 C CB . ILE A ? 313 ? 16.112 -23.960 -2.972 1.0 98.86 313 A 1 -ATOM 5186 C CG1 . ILE A ? 313 ? 16.248 -22.998 -1.768 1.0 98.53 313 A 1 -ATOM 5187 C CG2 . ILE A ? 313 ? 14.884 -23.575 -3.821 1.0 98.68 313 A 1 -ATOM 5188 C CD1 . ILE A ? 313 ? 15.123 -23.081 -0.715 1.0 98.25 313 A 1 -ATOM 5189 N N . ASP A ? 314 ? 14.821 -27.032 -3.916 1.0 98.86 314 A 1 -ATOM 5190 C CA . ASP A ? 314 ? 14.543 -27.961 -5.016 1.0 98.83 314 A 1 -ATOM 5191 C C . ASP A ? 314 ? 14.071 -27.238 -6.284 1.0 98.84 314 A 1 -ATOM 5192 O O . ASP A ? 314 ? 14.454 -27.627 -7.390 1.0 98.53 314 A 1 -ATOM 5193 C CB . ASP A ? 314 ? 13.479 -28.963 -4.564 1.0 98.72 314 A 1 -ATOM 5194 C CG . ASP A ? 314 ? 13.970 -29.835 -3.412 1.0 98.29 314 A 1 -ATOM 5195 O OD1 . ASP A ? 314 ? 14.683 -30.826 -3.712 1.0 95.12 314 A 1 -ATOM 5196 O OD2 . ASP A ? 314 ? 13.603 -29.540 -2.254 1.0 95.5 314 A 1 -ATOM 5197 N N . LEU A ? 315 ? 13.240 -26.199 -6.121 1.0 98.9 315 A 1 -ATOM 5198 C CA . LEU A ? 315 ? 12.673 -25.395 -7.205 1.0 98.91 315 A 1 -ATOM 5199 C C . LEU A ? 315 ? 12.699 -23.903 -6.869 1.0 98.94 315 A 1 -ATOM 5200 O O . LEU A ? 315 ? 12.420 -23.485 -5.741 1.0 98.87 315 A 1 -ATOM 5201 C CB . LEU A ? 315 ? 11.230 -25.836 -7.511 1.0 98.78 315 A 1 -ATOM 5202 C CG . LEU A ? 315 ? 11.064 -27.265 -8.065 1.0 97.81 315 A 1 -ATOM 5203 C CD1 . LEU A ? 315 ? 9.581 -27.544 -8.298 1.0 96.49 315 A 1 -ATOM 5204 C CD2 . LEU A ? 315 ? 11.794 -27.474 -9.392 1.0 96.65 315 A 1 -ATOM 5205 N N . TRP A ? 316 ? 12.967 -23.100 -7.887 1.0 98.95 316 A 1 -ATOM 5206 C CA . TRP A ? 316 ? 12.980 -21.644 -7.841 1.0 98.95 316 A 1 -ATOM 5207 C C . TRP A ? 316 ? 11.933 -21.076 -8.795 1.0 98.94 316 A 1 -ATOM 5208 O O . TRP A ? 316 ? 11.880 -21.458 -9.964 1.0 98.84 316 A 1 -ATOM 5209 C CB . TRP A ? 316 ? 14.369 -21.122 -8.217 1.0 98.92 316 A 1 -ATOM 5210 C CG . TRP A ? 316 ? 15.502 -21.629 -7.381 1.0 98.93 316 A 1 -ATOM 5211 C CD1 . TRP A ? 316 ? 16.170 -22.788 -7.586 1.0 98.72 316 A 1 -ATOM 5212 C CD2 . TRP A ? 316 ? 16.094 -21.013 -6.197 1.0 98.91 316 A 1 -ATOM 5213 N NE1 . TRP A ? 316 ? 17.148 -22.933 -6.610 1.0 98.76 316 A 1 -ATOM 5214 C CE2 . TRP A ? 316 ? 17.139 -21.864 -5.738 1.0 98.85 316 A 1 -ATOM 5215 C CE3 . TRP A ? 316 ? 15.851 -19.818 -5.482 1.0 98.83 316 A 1 -ATOM 5216 C CZ2 . TRP A ? 316 ? 17.915 -21.546 -4.602 1.0 98.68 316 A 1 -ATOM 5217 C CZ3 . TRP A ? 316 ? 16.624 -19.500 -4.349 1.0 98.54 316 A 1 -ATOM 5218 C CH2 . TRP A ? 316 ? 17.647 -20.359 -3.914 1.0 98.49 316 A 1 -ATOM 5219 N N . GLU A ? 317 ? 11.166 -20.118 -8.314 1.0 98.97 317 A 1 -ATOM 5220 C CA . GLU A ? 317 ? 10.314 -19.254 -9.121 1.0 98.97 317 A 1 -ATOM 5221 C C . GLU A ? 317 ? 10.832 -17.819 -8.998 1.0 98.97 317 A 1 -ATOM 5222 O O . GLU A ? 317 ? 10.635 -17.153 -7.984 1.0 98.91 317 A 1 -ATOM 5223 C CB . GLU A ? 317 ? 8.855 -19.380 -8.668 1.0 98.91 317 A 1 -ATOM 5224 C CG . GLU A ? 317 ? 8.141 -20.600 -9.275 1.0 97.66 317 A 1 -ATOM 5225 C CD . GLU A ? 317 ? 7.820 -20.434 -10.764 1.0 98.46 317 A 1 -ATOM 5226 O OE1 . GLU A ? 317 ? 7.751 -21.462 -11.471 1.0 96.26 317 A 1 -ATOM 5227 O OE2 . GLU A ? 317 ? 7.613 -19.282 -11.217 1.0 96.71 317 A 1 -ATOM 5228 N N . ILE A ? 318 ? 11.533 -17.350 -10.021 1.0 98.95 318 A 1 -ATOM 5229 C CA . ILE A ? 318 ? 12.038 -15.973 -10.104 1.0 98.95 318 A 1 -ATOM 5230 C C . ILE A ? 318 ? 11.242 -15.270 -11.198 1.0 98.95 318 A 1 -ATOM 5231 O O . ILE A ? 318 ? 11.388 -15.600 -12.374 1.0 98.84 318 A 1 -ATOM 5232 C CB . ILE A ? 318 ? 13.559 -15.936 -10.363 1.0 98.87 318 A 1 -ATOM 5233 C CG1 . ILE A ? 318 ? 14.328 -16.708 -9.260 1.0 98.03 318 A 1 -ATOM 5234 C CG2 . ILE A ? 318 ? 14.036 -14.468 -10.431 1.0 98.57 318 A 1 -ATOM 5235 C CD1 . ILE A ? 318 ? 15.820 -16.882 -9.556 1.0 94.85 318 A 1 -ATOM 5236 N N . ASN A ? 319 ? 10.393 -14.320 -10.830 1.0 98.9 319 A 1 -ATOM 5237 C CA . ASN A ? 319 ? 9.479 -13.713 -11.790 1.0 98.9 319 A 1 -ATOM 5238 C C . ASN A ? 319 ? 10.228 -13.023 -12.939 1.0 98.89 319 A 1 -ATOM 5239 O O . ASN A ? 319 ? 11.014 -12.103 -12.724 1.0 98.81 319 A 1 -ATOM 5240 C CB . ASN A ? 319 ? 8.512 -12.759 -11.084 1.0 98.87 319 A 1 -ATOM 5241 C CG . ASN A ? 319 ? 7.447 -12.260 -12.048 1.0 98.82 319 A 1 -ATOM 5242 O OD1 . ASN A ? 319 ? 6.633 -13.012 -12.553 1.0 92.47 319 A 1 -ATOM 5243 N ND2 . ASN A ? 319 ? 7.435 -10.985 -12.351 1.0 92.49 319 A 1 -ATOM 5244 N N . GLU A ? 320 ? 9.929 -13.433 -14.160 1.0 98.92 320 A 1 -ATOM 5245 C CA . GLU A ? 320 ? 10.580 -12.997 -15.399 1.0 98.9 320 A 1 -ATOM 5246 C C . GLU A ? 320 ? 10.035 -11.645 -15.892 1.0 98.9 320 A 1 -ATOM 5247 O O . GLU A ? 320 ? 9.585 -11.531 -17.034 1.0 98.7 320 A 1 -ATOM 5248 C CB . GLU A ? 320 ? 10.415 -14.087 -16.478 1.0 98.79 320 A 1 -ATOM 5249 C CG . GLU A ? 320 ? 11.004 -15.449 -16.092 1.0 98.72 320 A 1 -ATOM 5250 C CD . GLU A ? 320 ? 10.703 -16.556 -17.117 1.0 98.86 320 A 1 -ATOM 5251 O OE1 . GLU A ? 320 ? 11.267 -17.663 -16.962 1.0 98.14 320 A 1 -ATOM 5252 O OE2 . GLU A ? 320 ? 9.890 -16.349 -18.047 1.0 98.39 320 A 1 -ATOM 5253 N N . ALA A ? 321 ? 10.075 -10.604 -15.057 1.0 98.91 321 A 1 -ATOM 5254 C CA . ALA A ? 321 ? 9.681 -9.257 -15.493 1.0 98.88 321 A 1 -ATOM 5255 C C . ALA A ? 321 ? 10.375 -8.866 -16.812 1.0 98.9 321 A 1 -ATOM 5256 O O . ALA A ? 321 ? 9.759 -8.324 -17.728 1.0 98.69 321 A 1 -ATOM 5257 C CB . ALA A ? 321 ? 10.027 -8.277 -14.369 1.0 98.67 321 A 1 -ATOM 5258 N N . PHE A ? 322 ? 11.642 -9.211 -16.896 1.0 98.94 322 A 1 -ATOM 5259 C CA . PHE A ? 322 ? 12.462 -9.246 -18.106 1.0 98.94 322 A 1 -ATOM 5260 C C . PHE A ? 322 ? 13.414 -10.438 -17.978 1.0 98.94 322 A 1 -ATOM 5261 O O . PHE A ? 322 ? 13.813 -10.764 -16.861 1.0 98.81 322 A 1 -ATOM 5262 C CB . PHE A ? 322 ? 13.247 -7.934 -18.240 1.0 98.88 322 A 1 -ATOM 5263 C CG . PHE A ? 322 ? 12.380 -6.691 -18.234 1.0 98.91 322 A 1 -ATOM 5264 C CD1 . PHE A ? 322 ? 11.790 -6.242 -19.424 1.0 98.58 322 A 1 -ATOM 5265 C CD2 . PHE A ? 322 ? 12.091 -6.021 -17.030 1.0 98.6 322 A 1 -ATOM 5266 C CE1 . PHE A ? 322 ? 10.911 -5.148 -19.417 1.0 98.52 322 A 1 -ATOM 5267 C CE2 . PHE A ? 322 ? 11.207 -4.925 -17.014 1.0 98.44 322 A 1 -ATOM 5268 C CZ . PHE A ? 322 ? 10.613 -4.497 -18.210 1.0 98.68 322 A 1 -ATOM 5269 N N . ALA A ? 323 ? 13.826 -11.066 -19.094 1.0 98.9 323 A 1 -ATOM 5270 C CA . ALA A ? 323 ? 14.757 -12.204 -19.068 1.0 98.9 323 A 1 -ATOM 5271 C C . ALA A ? 323 ? 16.067 -11.892 -18.318 1.0 98.91 323 A 1 -ATOM 5272 O O . ALA A ? 323 ? 16.642 -12.767 -17.669 1.0 98.82 323 A 1 -ATOM 5273 C CB . ALA A ? 323 ? 15.046 -12.628 -20.511 1.0 98.85 323 A 1 -ATOM 5274 N N . VAL A ? 324 ? 16.506 -10.639 -18.328 1.0 98.87 324 A 1 -ATOM 5275 C CA . VAL A ? 324 ? 17.694 -10.178 -17.589 1.0 98.8 324 A 1 -ATOM 5276 C C . VAL A ? 324 ? 17.602 -10.436 -16.079 1.0 98.88 324 A 1 -ATOM 5277 O O . VAL A ? 324 ? 18.622 -10.679 -15.444 1.0 98.66 324 A 1 -ATOM 5278 C CB . VAL A ? 324 ? 17.970 -8.689 -17.901 1.0 97.57 324 A 1 -ATOM 5279 C CG1 . VAL A ? 324 ? 17.012 -7.718 -17.203 1.0 90.42 324 A 1 -ATOM 5280 C CG2 . VAL A ? 324 ? 19.399 -8.288 -17.530 1.0 91.8 324 A 1 -ATOM 5281 N N . VAL A ? 325 ? 16.401 -10.431 -15.495 1.0 98.88 325 A 1 -ATOM 5282 C CA . VAL A ? 325 ? 16.196 -10.564 -14.040 1.0 98.9 325 A 1 -ATOM 5283 C C . VAL A ? 325 ? 16.578 -11.965 -13.535 1.0 98.92 325 A 1 -ATOM 5284 O O . VAL A ? 325 ? 17.460 -12.059 -12.680 1.0 98.86 325 A 1 -ATOM 5285 C CB . VAL A ? 325 ? 14.763 -10.166 -13.626 1.0 98.83 325 A 1 -ATOM 5286 C CG1 . VAL A ? 325 ? 14.547 -10.331 -12.116 1.0 98.47 325 A 1 -ATOM 5287 C CG2 . VAL A ? 325 ? 14.459 -8.706 -13.992 1.0 98.45 325 A 1 -ATOM 5288 N N . PRO A ? 326 ? 15.993 -13.068 -14.040 1.0 98.94 326 A 1 -ATOM 5289 C CA . PRO A ? 326 ? 16.428 -14.409 -13.648 1.0 98.93 326 A 1 -ATOM 5290 C C . PRO A ? 326 ? 17.869 -14.695 -14.084 1.0 98.93 326 A 1 -ATOM 5291 O O . PRO A ? 326 ? 18.610 -15.292 -13.310 1.0 98.86 326 A 1 -ATOM 5292 C CB . PRO A ? 326 ? 15.419 -15.376 -14.271 1.0 98.82 326 A 1 -ATOM 5293 C CG . PRO A ? 326 ? 14.862 -14.593 -15.458 1.0 98.17 326 A 1 -ATOM 5294 C CD . PRO A ? 326 ? 14.858 -13.159 -14.948 1.0 98.81 326 A 1 -ATOM 5295 N N . LEU A ? 327 ? 18.315 -14.210 -15.253 1.0 98.9 327 A 1 -ATOM 5296 C CA . LEU A ? 327 ? 19.699 -14.394 -15.717 1.0 98.88 327 A 1 -ATOM 5297 C C . LEU A ? 327 ? 20.720 -13.783 -14.753 1.0 98.84 327 A 1 -ATOM 5298 O O . LEU A ? 327 ? 21.667 -14.460 -14.352 1.0 98.72 327 A 1 -ATOM 5299 C CB . LEU A ? 327 ? 19.874 -13.780 -17.116 1.0 98.86 327 A 1 -ATOM 5300 C CG . LEU A ? 327 ? 19.248 -14.599 -18.257 1.0 98.61 327 A 1 -ATOM 5301 C CD1 . LEU A ? 327 ? 19.278 -13.770 -19.539 1.0 98.08 327 A 1 -ATOM 5302 C CD2 . LEU A ? 327 ? 20.010 -15.899 -18.509 1.0 98.14 327 A 1 -ATOM 5303 N N . TYR A ? 328 ? 20.522 -12.522 -14.349 1.0 98.89 328 A 1 -ATOM 5304 C CA . TYR A ? 328 ? 21.375 -11.869 -13.353 1.0 98.87 328 A 1 -ATOM 5305 C C . TYR A ? 328 ? 21.364 -12.635 -12.028 1.0 98.87 328 A 1 -ATOM 5306 O O . TYR A ? 328 ? 22.417 -12.893 -11.445 1.0 98.78 328 A 1 -ATOM 5307 C CB . TYR A ? 328 ? 20.915 -10.422 -13.142 1.0 98.84 328 A 1 -ATOM 5308 C CG . TYR A ? 328 ? 21.700 -9.723 -12.048 1.0 98.77 328 A 1 -ATOM 5309 C CD1 . TYR A ? 328 ? 21.253 -9.759 -10.712 1.0 98.41 328 A 1 -ATOM 5310 C CD2 . TYR A ? 328 ? 22.930 -9.103 -12.347 1.0 98.44 328 A 1 -ATOM 5311 C CE1 . TYR A ? 328 ? 22.023 -9.181 -9.685 1.0 98.04 328 A 1 -ATOM 5312 C CE2 . TYR A ? 328 ? 23.706 -8.519 -11.329 1.0 98.03 328 A 1 -ATOM 5313 C CZ . TYR A ? 328 ? 23.249 -8.565 -9.999 1.0 98.15 328 A 1 -ATOM 5314 O OH . TYR A ? 328 ? 24.012 -8.013 -9.002 1.0 97.3 328 A 1 -ATOM 5315 N N . THR A ? 329 ? 20.179 -13.040 -11.575 1.0 98.9 329 A 1 -ATOM 5316 C CA . THR A ? 329 ? 20.006 -13.746 -10.299 1.0 98.88 329 A 1 -ATOM 5317 C C . THR A ? 329 ? 20.719 -15.098 -10.310 1.0 98.87 329 A 1 -ATOM 5318 O O . THR A ? 329 ? 21.477 -15.397 -9.389 1.0 98.78 329 A 1 -ATOM 5319 C CB . THR A ? 329 ? 18.519 -13.927 -9.969 1.0 98.85 329 A 1 -ATOM 5320 O OG1 . THR A ? 329 ? 17.839 -12.695 -10.040 1.0 97.9 329 A 1 -ATOM 5321 C CG2 . THR A ? 329 ? 18.324 -14.451 -8.550 1.0 97.94 329 A 1 -ATOM 5322 N N . MET A ? 330 ? 20.552 -15.891 -11.368 1.0 98.88 330 A 1 -ATOM 5323 C CA . MET A ? 330 ? 21.229 -17.184 -11.535 1.0 98.81 330 A 1 -ATOM 5324 C C . MET A ? 330 ? 22.754 -17.029 -11.576 1.0 98.78 330 A 1 -ATOM 5325 O O . MET A ? 330 ? 23.451 -17.738 -10.851 1.0 98.47 330 A 1 -ATOM 5326 C CB . MET A ? 330 ? 20.749 -17.880 -12.812 1.0 98.61 330 A 1 -ATOM 5327 C CG . MET A ? 330 ? 19.309 -18.393 -12.700 1.0 97.28 330 A 1 -ATOM 5328 S SD . MET A ? 330 ? 18.774 -19.425 -14.098 1.0 97.0 330 A 1 -ATOM 5329 C CE . MET A ? 330 ? 18.843 -18.256 -15.468 1.0 90.3 330 A 1 -ATOM 5330 N N . LYS A ? 331 ? 23.280 -16.084 -12.366 1.0 98.71 331 A 1 -ATOM 5331 C CA . LYS A ? 331 ? 24.727 -15.819 -12.454 1.0 98.46 331 A 1 -ATOM 5332 C C . LYS A ? 331 ? 25.309 -15.369 -11.114 1.0 98.54 331 A 1 -ATOM 5333 O O . LYS A ? 331 ? 26.369 -15.837 -10.719 1.0 98.0 331 A 1 -ATOM 5334 C CB . LYS A ? 331 ? 25.020 -14.754 -13.529 1.0 97.54 331 A 1 -ATOM 5335 C CG . LYS A ? 331 ? 25.016 -15.321 -14.960 1.0 83.42 331 A 1 -ATOM 5336 C CD . LYS A ? 331 ? 25.405 -14.229 -15.974 1.0 81.97 331 A 1 -ATOM 5337 C CE . LYS A ? 331 ? 25.551 -14.821 -17.378 1.0 71.21 331 A 1 -ATOM 5338 N NZ . LYS A ? 331 ? 25.952 -13.807 -18.394 1.0 64.71 331 A 1 -ATOM 5339 N N . THR A ? 332 ? 24.622 -14.473 -10.422 1.0 98.67 332 A 1 -ATOM 5340 C CA . THR A ? 332 ? 25.115 -13.863 -9.177 1.0 98.66 332 A 1 -ATOM 5341 C C . THR A ? 332 ? 25.105 -14.845 -8.010 1.0 98.7 332 A 1 -ATOM 5342 O O . THR A ? 332 ? 26.023 -14.841 -7.193 1.0 98.29 332 A 1 -ATOM 5343 C CB . THR A ? 332 ? 24.281 -12.623 -8.821 1.0 98.38 332 A 1 -ATOM 5344 O OG1 . THR A ? 332 ? 24.338 -11.707 -9.892 1.0 95.54 332 A 1 -ATOM 5345 C CG2 . THR A ? 332 ? 24.807 -11.877 -7.594 1.0 95.21 332 A 1 -ATOM 5346 N N . LEU A ? 333 ? 24.094 -15.702 -7.922 1.0 98.74 333 A 1 -ATOM 5347 C CA . LEU A ? 333 ? 23.927 -16.656 -6.819 1.0 98.76 333 A 1 -ATOM 5348 C C . LEU A ? 333 ? 24.403 -18.078 -7.156 1.0 98.72 333 A 1 -ATOM 5349 O O . LEU A ? 333 ? 24.455 -18.921 -6.261 1.0 98.28 333 A 1 -ATOM 5350 C CB . LEU A ? 333 ? 22.462 -16.646 -6.359 1.0 98.74 333 A 1 -ATOM 5351 C CG . LEU A ? 333 ? 21.933 -15.285 -5.863 1.0 98.42 333 A 1 -ATOM 5352 C CD1 . LEU A ? 333 ? 20.484 -15.453 -5.406 1.0 97.88 333 A 1 -ATOM 5353 C CD2 . LEU A ? 333 ? 22.734 -14.729 -4.681 1.0 97.75 333 A 1 -ATOM 5354 N N . GLY A ? 334 ? 24.747 -18.354 -8.421 1.0 98.54 334 A 1 -ATOM 5355 C CA . GLY A ? 334 ? 25.123 -19.696 -8.876 1.0 98.43 334 A 1 -ATOM 5356 C C . GLY A ? 334 ? 23.951 -20.685 -8.828 1.0 98.55 334 A 1 -ATOM 5357 O O . GLY A ? 334 ? 24.112 -21.804 -8.350 1.0 97.56 334 A 1 -ATOM 5358 N N . LEU A ? 335 ? 22.770 -20.264 -9.279 1.0 98.62 335 A 1 -ATOM 5359 C CA . LEU A ? 335 ? 21.586 -21.129 -9.304 1.0 98.65 335 A 1 -ATOM 5360 C C . LEU A ? 335 ? 21.625 -22.073 -10.508 1.0 98.54 335 A 1 -ATOM 5361 O O . LEU A ? 335 ? 22.029 -21.689 -11.604 1.0 98.02 335 A 1 -ATOM 5362 C CB . LEU A ? 335 ? 20.286 -20.305 -9.293 1.0 98.62 335 A 1 -ATOM 5363 C CG . LEU A ? 335 ? 20.168 -19.262 -8.169 1.0 98.18 335 A 1 -ATOM 5364 C CD1 . LEU A ? 335 ? 18.796 -18.590 -8.239 1.0 97.71 335 A 1 -ATOM 5365 C CD2 . LEU A ? 335 ? 20.333 -19.870 -6.774 1.0 97.69 335 A 1 -ATOM 5366 N N . ASP A ? 336 ? 21.143 -23.293 -10.312 1.0 98.34 336 A 1 -ATOM 5367 C CA . ASP A ? 336 ? 20.979 -24.283 -11.379 1.0 98.31 336 A 1 -ATOM 5368 C C . ASP A ? 336 ? 19.754 -23.937 -12.241 1.0 98.5 336 A 1 -ATOM 5369 O O . ASP A ? 336 ? 18.610 -24.040 -11.787 1.0 98.13 336 A 1 -ATOM 5370 C CB . ASP A ? 336 ? 20.873 -25.674 -10.739 1.0 97.75 336 A 1 -ATOM 5371 C CG . ASP A ? 336 ? 20.655 -26.816 -11.733 1.0 97.18 336 A 1 -ATOM 5372 O OD1 . ASP A ? 336 ? 20.604 -26.573 -12.960 1.0 95.59 336 A 1 -ATOM 5373 O OD2 . ASP A ? 336 ? 20.495 -27.956 -11.250 1.0 94.17 336 A 1 -ATOM 5374 N N . GLU A ? 337 ? 19.987 -23.567 -13.502 1.0 98.32 337 A 1 -ATOM 5375 C CA . GLU A ? 337 ? 18.930 -23.211 -14.458 1.0 98.26 337 A 1 -ATOM 5376 C C . GLU A ? 337 ? 17.883 -24.329 -14.640 1.0 98.51 337 A 1 -ATOM 5377 O O . GLU A ? 337 ? 16.721 -24.052 -14.925 1.0 98.17 337 A 1 -ATOM 5378 C CB . GLU A ? 337 ? 19.575 -22.844 -15.806 1.0 97.18 337 A 1 -ATOM 5379 C CG . GLU A ? 337 ? 18.559 -22.253 -16.802 1.0 90.74 337 A 1 -ATOM 5380 C CD . GLU A ? 337 ? 19.190 -21.862 -18.148 1.0 87.73 337 A 1 -ATOM 5381 O OE1 . GLU A ? 337 ? 18.961 -20.714 -18.596 1.0 80.64 337 A 1 -ATOM 5382 O OE2 . GLU A ? 337 ? 19.871 -22.720 -18.751 1.0 81.61 337 A 1 -ATOM 5383 N N . SER A ? 338 ? 18.263 -25.596 -14.436 1.0 98.56 338 A 1 -ATOM 5384 C CA . SER A ? 338 ? 17.327 -26.725 -14.525 1.0 98.55 338 A 1 -ATOM 5385 C C . SER A ? 338 ? 16.278 -26.747 -13.403 1.0 98.69 338 A 1 -ATOM 5386 O O . SER A ? 338 ? 15.275 -27.445 -13.520 1.0 98.28 338 A 1 -ATOM 5387 C CB . SER A ? 338 ? 18.090 -28.052 -14.570 1.0 98.18 338 A 1 -ATOM 5388 O OG . SER A ? 338 ? 18.567 -28.445 -13.302 1.0 93.79 338 A 1 -ATOM 5389 N N . LYS A ? 339 ? 16.488 -25.963 -12.344 1.0 98.72 339 A 1 -ATOM 5390 C CA . LYS A ? 339 ? 15.578 -25.813 -11.201 1.0 98.81 339 A 1 -ATOM 5391 C C . LYS A ? 339 ? 14.832 -24.479 -11.179 1.0 98.88 339 A 1 -ATOM 5392 O O . LYS A ? 339 ? 13.932 -24.304 -10.359 1.0 98.72 339 A 1 -ATOM 5393 C CB . LYS A ? 339 ? 16.365 -25.986 -9.900 1.0 98.62 339 A 1 -ATOM 5394 C CG . LYS A ? 339 ? 17.016 -27.370 -9.776 1.0 97.72 339 A 1 -ATOM 5395 C CD . LYS A ? 339 ? 17.677 -27.479 -8.406 1.0 95.65 339 A 1 -ATOM 5396 C CE . LYS A ? 339 ? 18.297 -28.861 -8.214 1.0 89.57 339 A 1 -ATOM 5397 N NZ . LYS A ? 339 ? 18.808 -28.991 -6.834 1.0 81.7 339 A 1 -ATOM 5398 N N . VAL A ? 340 ? 15.212 -23.529 -12.030 1.0 98.86 340 A 1 -ATOM 5399 C CA . VAL A ? 340 ? 14.630 -22.180 -12.070 1.0 98.89 340 A 1 -ATOM 5400 C C . VAL A ? 340 ? 13.536 -22.116 -13.128 1.0 98.9 340 A 1 -ATOM 5401 O O . VAL A ? 340 ? 13.795 -22.412 -14.290 1.0 98.77 340 A 1 -ATOM 5402 C CB . VAL A ? 340 ? 15.710 -21.108 -12.323 1.0 98.81 340 A 1 -ATOM 5403 C CG1 . VAL A ? 340 ? 15.105 -19.700 -12.356 1.0 98.36 340 A 1 -ATOM 5404 C CG2 . VAL A ? 340 ? 16.783 -21.127 -11.230 1.0 98.35 340 A 1 -ATOM 5405 N N . ASN A ? 341 ? 12.344 -21.691 -12.734 1.0 98.88 341 A 1 -ATOM 5406 C CA . ASN A ? 341 ? 11.188 -21.479 -13.622 1.0 98.89 341 A 1 -ATOM 5407 C C . ASN A ? 341 ? 10.946 -22.667 -14.572 1.0 98.87 341 A 1 -ATOM 5408 O O . ASN A ? 341 ? 10.826 -22.500 -15.786 1.0 98.57 341 A 1 -ATOM 5409 C CB . ASN A ? 341 ? 11.326 -20.135 -14.366 1.0 98.82 341 A 1 -ATOM 5410 C CG . ASN A ? 341 ? 11.435 -18.921 -13.461 1.0 98.85 341 A 1 -ATOM 5411 O OD1 . ASN A ? 341 ? 11.272 -18.962 -12.256 1.0 95.11 341 A 1 -ATOM 5412 N ND2 . ASN A ? 341 ? 11.730 -17.776 -14.033 1.0 94.17 341 A 1 -ATOM 5413 N N . ILE A ? 342 ? 10.889 -23.882 -14.025 1.0 98.92 342 A 1 -ATOM 5414 C CA . ILE A ? 342 ? 10.847 -25.124 -14.818 1.0 98.88 342 A 1 -ATOM 5415 C C . ILE A ? 342 ? 9.627 -25.242 -15.744 1.0 98.9 342 A 1 -ATOM 5416 O O . ILE A ? 342 ? 9.670 -25.969 -16.731 1.0 98.66 342 A 1 -ATOM 5417 C CB . ILE A ? 342 ? 10.956 -26.366 -13.913 1.0 98.68 342 A 1 -ATOM 5418 C CG1 . ILE A ? 342 ? 9.798 -26.473 -12.898 1.0 97.01 342 A 1 -ATOM 5419 C CG2 . ILE A ? 342 ? 12.333 -26.382 -13.210 1.0 95.53 342 A 1 -ATOM 5420 C CD1 . ILE A ? 342 ? 9.687 -27.865 -12.259 1.0 94.76 342 A 1 -ATOM 5421 N N . HIS A ? 343 ? 8.567 -24.502 -15.449 1.0 98.83 343 A 1 -ATOM 5422 C CA . HIS A ? 343 ? 7.338 -24.447 -16.248 1.0 98.84 343 A 1 -ATOM 5423 C C . HIS A ? 343 ? 7.162 -23.111 -16.992 1.0 98.83 343 A 1 -ATOM 5424 O O . HIS A ? 343 ? 6.047 -22.739 -17.361 1.0 98.47 343 A 1 -ATOM 5425 C CB . HIS A ? 343 ? 6.145 -24.798 -15.352 1.0 98.72 343 A 1 -ATOM 5426 C CG . HIS A ? 343 ? 6.254 -26.141 -14.677 1.0 98.79 343 A 1 -ATOM 5427 N ND1 . HIS A ? 343 ? 5.922 -26.416 -13.371 1.0 91.93 343 A 1 -ATOM 5428 C CD2 . HIS A ? 343 ? 6.695 -27.323 -15.219 1.0 92.82 343 A 1 -ATOM 5429 C CE1 . HIS A ? 343 ? 6.146 -27.715 -13.139 1.0 94.58 343 A 1 -ATOM 5430 N NE2 . HIS A ? 343 ? 6.626 -28.308 -14.241 1.0 95.67 343 A 1 -ATOM 5431 N N . GLY A ? 344 ? 8.271 -22.401 -17.239 1.0 98.77 344 A 1 -ATOM 5432 C CA . GLY A ? 344 ? 8.266 -21.054 -17.806 1.0 98.77 344 A 1 -ATOM 5433 C C . GLY A ? 344 ? 8.001 -19.988 -16.746 1.0 98.84 344 A 1 -ATOM 5434 O O . GLY A ? 344 ? 7.955 -20.259 -15.547 1.0 98.37 344 A 1 -ATOM 5435 N N . GLY A ? 345 ? 7.839 -18.749 -17.200 1.0 98.86 345 A 1 -ATOM 5436 C CA . GLY A ? 345 ? 7.613 -17.611 -16.327 1.0 98.88 345 A 1 -ATOM 5437 C C . GLY A ? 345 ? 6.977 -16.442 -17.071 1.0 98.93 345 A 1 -ATOM 5438 O O . GLY A ? 345 ? 6.430 -16.601 -18.164 1.0 98.78 345 A 1 -ATOM 5439 N N . ALA A ? 346 ? 7.048 -15.252 -16.486 1.0 98.92 346 A 1 -ATOM 5440 C CA . ALA A ? 346 ? 6.312 -14.083 -16.966 1.0 98.93 346 A 1 -ATOM 5441 C C . ALA A ? 346 ? 6.642 -13.657 -18.408 1.0 98.92 346 A 1 -ATOM 5442 O O . ALA A ? 346 ? 5.781 -13.084 -19.065 1.0 98.74 346 A 1 -ATOM 5443 C CB . ALA A ? 346 ? 6.540 -12.933 -15.982 1.0 98.86 346 A 1 -ATOM 5444 N N . VAL A ? 347 ? 7.831 -13.960 -18.932 1.0 98.94 347 A 1 -ATOM 5445 C CA . VAL A ? 347 ? 8.174 -13.696 -20.346 1.0 98.93 347 A 1 -ATOM 5446 C C . VAL A ? 347 ? 7.231 -14.447 -21.294 1.0 98.92 347 A 1 -ATOM 5447 O O . VAL A ? 347 ? 6.796 -13.888 -22.298 1.0 98.75 347 A 1 -ATOM 5448 C CB . VAL A ? 347 ? 9.647 -14.055 -20.634 1.0 98.82 347 A 1 -ATOM 5449 C CG1 . VAL A ? 347 ? 9.982 -14.122 -22.130 1.0 97.64 347 A 1 -ATOM 5450 C CG2 . VAL A ? 347 ? 10.581 -13.002 -20.020 1.0 97.47 347 A 1 -ATOM 5451 N N . SER A ? 348 ? 6.892 -15.694 -20.981 1.0 98.9 348 A 1 -ATOM 5452 C CA . SER A ? 348 ? 6.075 -16.558 -21.844 1.0 98.88 348 A 1 -ATOM 5453 C C . SER A ? 348 ? 4.635 -16.752 -21.365 1.0 98.84 348 A 1 -ATOM 5454 O O . SER A ? 348 ? 3.757 -17.020 -22.179 1.0 98.5 348 A 1 -ATOM 5455 C CB . SER A ? 348 ? 6.758 -17.914 -22.014 1.0 98.77 348 A 1 -ATOM 5456 O OG . SER A ? 348 ? 6.885 -18.594 -20.780 1.0 98.48 348 A 1 -ATOM 5457 N N . LEU A ? 349 ? 4.376 -16.608 -20.070 1.0 98.91 349 A 1 -ATOM 5458 C CA . LEU A ? 349 ? 3.031 -16.713 -19.487 1.0 98.88 349 A 1 -ATOM 5459 C C . LEU A ? 349 ? 2.314 -15.358 -19.412 1.0 98.85 349 A 1 -ATOM 5460 O O . LEU A ? 349 ? 1.087 -15.307 -19.432 1.0 98.52 349 A 1 -ATOM 5461 C CB . LEU A ? 349 ? 3.122 -17.354 -18.093 1.0 98.79 349 A 1 -ATOM 5462 C CG . LEU A ? 349 ? 3.618 -18.811 -18.074 1.0 98.54 349 A 1 -ATOM 5463 C CD1 . LEU A ? 349 ? 3.811 -19.271 -16.631 1.0 97.98 349 A 1 -ATOM 5464 C CD2 . LEU A ? 349 ? 2.622 -19.764 -18.745 1.0 97.81 349 A 1 -ATOM 5465 N N . GLY A ? 350 ? 3.067 -14.262 -19.325 1.0 98.87 350 A 1 -ATOM 5466 C CA . GLY A ? 350 ? 2.560 -12.914 -19.095 1.0 98.89 350 A 1 -ATOM 5467 C C . GLY A ? 350 ? 2.731 -12.443 -17.651 1.0 98.93 350 A 1 -ATOM 5468 O O . GLY A ? 350 ? 3.037 -13.218 -16.739 1.0 98.8 350 A 1 -ATOM 5469 N N . HIS A ? 351 ? 2.530 -11.136 -17.444 1.0 98.88 351 A 1 -ATOM 5470 C CA . HIS A ? 351 ? 2.760 -10.471 -16.165 1.0 98.91 351 A 1 -ATOM 5471 C C . HIS A ? 351 ? 1.674 -9.437 -15.814 1.0 98.93 351 A 1 -ATOM 5472 O O . HIS A ? 351 ? 1.896 -8.231 -15.954 1.0 98.82 351 A 1 -ATOM 5473 C CB . HIS A ? 351 ? 4.181 -9.880 -16.167 1.0 98.79 351 A 1 -ATOM 5474 C CG . HIS A ? 351 ? 4.589 -9.258 -14.855 1.0 98.79 351 A 1 -ATOM 5475 N ND1 . HIS A ? 351 ? 4.093 -9.565 -13.604 1.0 96.42 351 A 1 -ATOM 5476 C CD2 . HIS A ? 351 ? 5.558 -8.303 -14.671 1.0 96.33 351 A 1 -ATOM 5477 C CE1 . HIS A ? 351 ? 4.733 -8.805 -12.701 1.0 97.22 351 A 1 -ATOM 5478 N NE2 . HIS A ? 351 ? 5.635 -8.035 -13.311 1.0 97.41 351 A 1 -ATOM 5479 N N . PRO A ? 352 ? 0.511 -9.861 -15.314 1.0 98.94 352 A 1 -ATOM 5480 C CA . PRO A ? 352 ? -0.400 -8.973 -14.600 1.0 98.94 352 A 1 -ATOM 5481 C C . PRO A ? 352 ? 0.308 -8.555 -13.304 1.0 98.93 352 A 1 -ATOM 5482 O O . PRO A ? 352 ? 0.537 -9.383 -12.421 1.0 98.84 352 A 1 -ATOM 5483 C CB . PRO A ? 352 ? -1.683 -9.771 -14.352 1.0 98.9 352 A 1 -ATOM 5484 C CG . PRO A ? 352 ? -1.520 -11.057 -15.175 1.0 98.58 352 A 1 -ATOM 5485 C CD . PRO A ? 352 ? -0.007 -11.214 -15.308 1.0 98.91 352 A 1 -ATOM 5486 N N . ILE A ? 353 ? 0.738 -7.295 -13.206 1.0 98.94 353 A 1 -ATOM 5487 C CA . ILE A ? 353 ? 1.793 -6.878 -12.269 1.0 98.92 353 A 1 -ATOM 5488 C C . ILE A ? 353 ? 1.455 -7.116 -10.790 1.0 98.93 353 A 1 -ATOM 5489 O O . ILE A ? 353 ? 2.300 -7.594 -10.041 1.0 98.8 353 A 1 -ATOM 5490 C CB . ILE A ? 353 ? 2.268 -5.430 -12.561 1.0 98.79 353 A 1 -ATOM 5491 C CG1 . ILE A ? 353 ? 1.101 -4.417 -12.612 1.0 98.31 353 A 1 -ATOM 5492 C CG2 . ILE A ? 353 ? 3.080 -5.414 -13.876 1.0 98.1 353 A 1 -ATOM 5493 C CD1 . ILE A ? 353 ? 1.531 -2.958 -12.856 1.0 97.74 353 A 1 -ATOM 5494 N N . GLY A ? 354 ? 0.208 -6.877 -10.373 1.0 98.91 354 A 1 -ATOM 5495 C CA . GLY A ? 354 ? -0.248 -7.186 -9.012 1.0 98.92 354 A 1 -ATOM 5496 C C . GLY A ? 354 ? -0.421 -8.685 -8.736 1.0 98.94 354 A 1 -ATOM 5497 O O . GLY A ? 354 ? -0.247 -9.126 -7.599 1.0 98.83 354 A 1 -ATOM 5498 N N . MET A ? 355 ? -0.710 -9.480 -9.764 1.0 98.93 355 A 1 -ATOM 5499 C CA . MET A ? 355 ? -0.960 -10.927 -9.651 1.0 98.94 355 A 1 -ATOM 5500 C C . MET A ? 355 ? 0.316 -11.746 -9.440 1.0 98.95 355 A 1 -ATOM 5501 O O . MET A ? 355 ? 0.331 -12.687 -8.647 1.0 98.85 355 A 1 -ATOM 5502 C CB . MET A ? 355 ? -1.677 -11.408 -10.928 1.0 98.79 355 A 1 -ATOM 5503 C CG . MET A ? 355 ? -1.840 -12.930 -11.048 1.0 98.54 355 A 1 -ATOM 5504 S SD . MET A ? 355 ? -2.428 -13.446 -12.682 1.0 98.25 355 A 1 -ATOM 5505 C CE . MET A ? 355 ? -2.469 -15.239 -12.514 1.0 95.93 355 A 1 -ATOM 5506 N N . SER A ? 356 ? 1.373 -11.437 -10.182 1.0 98.94 356 A 1 -ATOM 5507 C CA . SER A ? 356 ? 2.496 -12.358 -10.404 1.0 98.94 356 A 1 -ATOM 5508 C C . SER A ? 356 ? 3.176 -12.855 -9.126 1.0 98.94 356 A 1 -ATOM 5509 O O . SER A ? 356 ? 3.516 -14.031 -9.040 1.0 98.9 356 A 1 -ATOM 5510 C CB . SER A ? 356 ? 3.527 -11.708 -11.323 1.0 98.89 356 A 1 -ATOM 5511 O OG . SER A ? 356 ? 2.970 -11.569 -12.619 1.0 98.48 356 A 1 -ATOM 5512 N N . GLY A ? 357 ? 3.320 -12.007 -8.111 1.0 98.94 357 A 1 -ATOM 5513 C CA . GLY A ? 357 ? 3.902 -12.398 -6.825 1.0 98.94 357 A 1 -ATOM 5514 C C . GLY A ? 357 ? 3.119 -13.493 -6.092 1.0 98.96 357 A 1 -ATOM 5515 O O . GLY A ? 357 ? 3.719 -14.320 -5.410 1.0 98.88 357 A 1 -ATOM 5516 N N . ALA A ? 358 ? 1.798 -13.540 -6.260 1.0 98.96 358 A 1 -ATOM 5517 C CA . ALA A ? 358 ? 0.972 -14.622 -5.719 1.0 98.97 358 A 1 -ATOM 5518 C C . ALA A ? 358 ? 0.955 -15.851 -6.641 1.0 98.97 358 A 1 -ATOM 5519 O O . ALA A ? 358 ? 0.981 -16.977 -6.150 1.0 98.93 358 A 1 -ATOM 5520 C CB . ALA A ? 358 ? -0.438 -14.089 -5.459 1.0 98.94 358 A 1 -ATOM 5521 N N . ARG A ? 359 ? 0.969 -15.645 -7.972 1.0 98.98 359 A 1 -ATOM 5522 C CA . ARG A ? 359 ? 0.997 -16.730 -8.966 1.0 98.97 359 A 1 -ATOM 5523 C C . ARG A ? 359 ? 2.167 -17.683 -8.740 1.0 98.97 359 A 1 -ATOM 5524 O O . ARG A ? 359 ? 1.963 -18.886 -8.684 1.0 98.93 359 A 1 -ATOM 5525 C CB . ARG A ? 359 ? 1.047 -16.142 -10.388 1.0 98.92 359 A 1 -ATOM 5526 C CG . ARG A ? 359 ? 0.961 -17.247 -11.458 1.0 98.42 359 A 1 -ATOM 5527 C CD . ARG A ? 359 ? 1.216 -16.725 -12.884 1.0 97.43 359 A 1 -ATOM 5528 N NE . ARG A ? 359 ? 2.579 -16.223 -13.100 1.0 95.53 359 A 1 -ATOM 5529 C CZ . ARG A ? 359 ? 3.685 -16.948 -13.254 1.0 96.14 359 A 1 -ATOM 5530 N NH1 . ARG A ? 359 ? 3.685 -18.251 -13.219 1.0 90.26 359 A 1 -ATOM 5531 N NH2 . ARG A ? 359 ? 4.824 -16.357 -13.461 1.0 92.25 359 A 1 -ATOM 5532 N N . ILE A ? 360 ? 3.375 -17.137 -8.584 1.0 98.97 360 A 1 -ATOM 5533 C CA . ILE A ? 360 ? 4.589 -17.959 -8.445 1.0 98.97 360 A 1 -ATOM 5534 C C . ILE A ? 360 ? 4.616 -18.741 -7.123 1.0 98.97 360 A 1 -ATOM 5535 O O . ILE A ? 360 ? 5.068 -19.878 -7.095 1.0 98.92 360 A 1 -ATOM 5536 C CB . ILE A ? 360 ? 5.869 -17.116 -8.652 1.0 98.93 360 A 1 -ATOM 5537 C CG1 . ILE A ? 360 ? 6.048 -16.023 -7.580 1.0 98.63 360 A 1 -ATOM 5538 C CG2 . ILE A ? 360 ? 5.894 -16.527 -10.081 1.0 98.36 360 A 1 -ATOM 5539 C CD1 . ILE A ? 360 ? 7.343 -15.211 -7.711 1.0 98.33 360 A 1 -ATOM 5540 N N . VAL A ? 361 ? 4.069 -18.181 -6.039 1.0 98.97 361 A 1 -ATOM 5541 C CA . VAL A ? 361 ? 3.933 -18.900 -4.760 1.0 98.97 361 A 1 -ATOM 5542 C C . VAL A ? 361 ? 2.895 -20.020 -4.883 1.0 98.96 361 A 1 -ATOM 5543 O O . VAL A ? 361 ? 3.172 -21.153 -4.501 1.0 98.9 361 A 1 -ATOM 5544 C CB . VAL A ? 361 ? 3.583 -17.941 -3.604 1.0 98.93 361 A 1 -ATOM 5545 C CG1 . VAL A ? 361 ? 3.356 -18.686 -2.283 1.0 98.58 361 A 1 -ATOM 5546 C CG2 . VAL A ? 361 ? 4.716 -16.931 -3.369 1.0 98.56 361 A 1 -ATOM 5547 N N . GLY A ? 362 ? 1.734 -19.730 -5.464 1.0 98.95 362 A 1 -ATOM 5548 C CA . GLY A ? 362 ? 0.693 -20.734 -5.708 1.0 98.92 362 A 1 -ATOM 5549 C C . GLY A ? 362 ? 1.173 -21.878 -6.607 1.0 98.91 362 A 1 -ATOM 5550 O O . GLY A ? 362 ? 0.879 -23.042 -6.341 1.0 98.73 362 A 1 -ATOM 5551 N N . HIS A ? 363 ? 1.990 -21.562 -7.612 1.0 98.92 363 A 1 -ATOM 5552 C CA . HIS A ? 363 ? 2.595 -22.563 -8.490 1.0 98.9 363 A 1 -ATOM 5553 C C . HIS A ? 363 ? 3.523 -23.516 -7.725 1.0 98.88 363 A 1 -ATOM 5554 O O . HIS A ? 363 ? 3.404 -24.735 -7.863 1.0 98.71 363 A 1 -ATOM 5555 C CB . HIS A ? 363 ? 3.330 -21.866 -9.637 1.0 98.83 363 A 1 -ATOM 5556 C CG . HIS A ? 363 ? 3.775 -22.853 -10.680 1.0 98.76 363 A 1 -ATOM 5557 N ND1 . HIS A ? 363 ? 2.932 -23.678 -11.399 1.0 96.04 363 A 1 -ATOM 5558 C CD2 . HIS A ? 363 ? 5.061 -23.161 -11.036 1.0 96.66 363 A 1 -ATOM 5559 C CE1 . HIS A ? 363 ? 3.693 -24.457 -12.168 1.0 97.25 363 A 1 -ATOM 5560 N NE2 . HIS A ? 363 ? 4.986 -24.172 -11.984 1.0 97.28 363 A 1 -ATOM 5561 N N . LEU A ? 364 ? 4.388 -22.984 -6.848 1.0 98.92 364 A 1 -ATOM 5562 C CA . LEU A ? 364 ? 5.221 -23.819 -5.972 1.0 98.92 364 A 1 -ATOM 5563 C C . LEU A ? 364 ? 4.378 -24.687 -5.029 1.0 98.9 364 A 1 -ATOM 5564 O O . LEU A ? 364 ? 4.667 -25.872 -4.873 1.0 98.78 364 A 1 -ATOM 5565 C CB . LEU A ? 364 ? 6.191 -22.944 -5.165 1.0 98.88 364 A 1 -ATOM 5566 C CG . LEU A ? 364 ? 7.342 -22.323 -5.977 1.0 98.6 364 A 1 -ATOM 5567 C CD1 . LEU A ? 364 ? 8.138 -21.394 -5.062 1.0 98.36 364 A 1 -ATOM 5568 C CD2 . LEU A ? 364 ? 8.300 -23.377 -6.535 1.0 98.35 364 A 1 -ATOM 5569 N N . VAL A ? 365 ? 3.303 -24.144 -4.441 1.0 98.91 365 A 1 -ATOM 5570 C CA . VAL A ? 365 ? 2.386 -24.897 -3.559 1.0 98.88 365 A 1 -ATOM 5571 C C . VAL A ? 365 ? 1.819 -26.144 -4.252 1.0 98.8 365 A 1 -ATOM 5572 O O . VAL A ? 365 ? 1.642 -27.185 -3.607 1.0 98.43 365 A 1 -ATOM 5573 C CB . VAL A ? 365 ? 1.243 -23.982 -3.055 1.0 98.75 365 A 1 -ATOM 5574 C CG1 . VAL A ? 365 ? 0.094 -24.738 -2.378 1.0 98.02 365 A 1 -ATOM 5575 C CG2 . VAL A ? 365 ? 1.765 -22.970 -2.024 1.0 98.13 365 A 1 -ATOM 5576 N N . HIS A ? 366 ? 1.569 -26.080 -5.564 1.0 98.78 366 A 1 -ATOM 5577 C CA . HIS A ? 366 ? 1.043 -27.209 -6.338 1.0 98.64 366 A 1 -ATOM 5578 C C . HIS A ? 366 ? 2.126 -28.105 -6.951 1.0 98.47 366 A 1 -ATOM 5579 O O . HIS A ? 366 ? 1.912 -29.314 -7.085 1.0 97.68 366 A 1 -ATOM 5580 C CB . HIS A ? 366 ? 0.083 -26.679 -7.406 1.0 98.39 366 A 1 -ATOM 5581 C CG . HIS A ? 366 ? -1.239 -26.259 -6.819 1.0 98.41 366 A 1 -ATOM 5582 N ND1 . HIS A ? 366 ? -2.112 -27.088 -6.126 1.0 93.04 366 A 1 -ATOM 5583 C CD2 . HIS A ? 366 ? -1.794 -25.005 -6.858 1.0 93.13 366 A 1 -ATOM 5584 C CE1 . HIS A ? 366 ? -3.166 -26.347 -5.768 1.0 95.16 366 A 1 -ATOM 5585 N NE2 . HIS A ? 366 ? -3.012 -25.080 -6.188 1.0 95.63 366 A 1 -ATOM 5586 N N . THR A ? 367 ? 3.281 -27.531 -7.298 1.0 98.73 367 A 1 -ATOM 5587 C CA . THR A ? 367 ? 4.321 -28.205 -8.094 1.0 98.61 367 A 1 -ATOM 5588 C C . THR A ? 367 ? 5.327 -28.990 -7.255 1.0 98.66 367 A 1 -ATOM 5589 O O . THR A ? 367 ? 5.755 -30.072 -7.662 1.0 98.04 367 A 1 -ATOM 5590 C CB . THR A ? 367 ? 5.047 -27.176 -8.969 1.0 97.79 367 A 1 -ATOM 5591 O OG1 . THR A ? 367 ? 4.101 -26.585 -9.833 1.0 87.46 367 A 1 -ATOM 5592 C CG2 . THR A ? 367 ? 6.124 -27.802 -9.855 1.0 85.59 367 A 1 -ATOM 5593 N N . LEU A ? 368 ? 5.708 -28.469 -6.085 1.0 98.72 368 A 1 -ATOM 5594 C CA . LEU A ? 368 ? 6.641 -29.155 -5.192 1.0 98.74 368 A 1 -ATOM 5595 C C . LEU A ? 368 ? 6.112 -30.546 -4.809 1.0 98.65 368 A 1 -ATOM 5596 O O . LEU A ? 368 ? 4.909 -30.755 -4.610 1.0 98.36 368 A 1 -ATOM 5597 C CB . LEU A ? 368 ? 6.897 -28.309 -3.935 1.0 98.73 368 A 1 -ATOM 5598 C CG . LEU A ? 368 ? 7.727 -27.033 -4.157 1.0 98.49 368 A 1 -ATOM 5599 C CD1 . LEU A ? 368 ? 7.631 -26.151 -2.910 1.0 98.27 368 A 1 -ATOM 5600 C CD2 . LEU A ? 368 ? 9.200 -27.339 -4.412 1.0 98.26 368 A 1 -ATOM 5601 N N . LYS A ? 369 ? 7.034 -31.502 -4.649 1.0 98.71 369 A 1 -ATOM 5602 C CA . LYS A ? 369 ? 6.746 -32.827 -4.090 1.0 98.66 369 A 1 -ATOM 5603 C C . LYS A ? 369 ? 6.882 -32.788 -2.564 1.0 98.76 369 A 1 -ATOM 5604 O O . LYS A ? 369 ? 7.633 -31.955 -2.053 1.0 98.43 369 A 1 -ATOM 5605 C CB . LYS A ? 369 ? 7.672 -33.874 -4.714 1.0 98.25 369 A 1 -ATOM 5606 C CG . LYS A ? 369 ? 7.443 -34.012 -6.227 1.0 95.95 369 A 1 -ATOM 5607 C CD . LYS A ? 369 ? 8.396 -35.054 -6.817 1.0 89.8 369 A 1 -ATOM 5608 C CE . LYS A ? 369 ? 8.205 -35.113 -8.335 1.0 82.56 369 A 1 -ATOM 5609 N NZ . LYS A ? 369 ? 9.196 -36.015 -8.972 1.0 71.37 369 A 1 -ATOM 5610 N N . PRO A ? 370 ? 6.213 -33.686 -1.820 1.0 98.55 370 A 1 -ATOM 5611 C CA . PRO A ? 370 ? 6.332 -33.749 -0.363 1.0 98.53 370 A 1 -ATOM 5612 C C . PRO A ? 370 ? 7.792 -33.754 0.111 1.0 98.55 370 A 1 -ATOM 5613 O O . PRO A ? 370 ? 8.609 -34.504 -0.417 1.0 97.82 370 A 1 -ATOM 5614 C CB . PRO A ? 370 ? 5.594 -35.024 0.048 1.0 98.17 370 A 1 -ATOM 5615 C CG . PRO A ? 370 ? 4.526 -35.167 -1.037 1.0 97.12 370 A 1 -ATOM 5616 C CD . PRO A ? 370 ? 5.248 -34.680 -2.289 1.0 98.29 370 A 1 -ATOM 5617 N N . GLY A ? 371 ? 8.110 -32.898 1.090 1.0 98.24 371 A 1 -ATOM 5618 C CA . GLY A ? 371 ? 9.455 -32.702 1.638 1.0 98.14 371 A 1 -ATOM 5619 C C . GLY A ? 371 ? 10.357 -31.753 0.838 1.0 98.46 371 A 1 -ATOM 5620 O O . GLY A ? 371 ? 11.382 -31.320 1.365 1.0 97.51 371 A 1 -ATOM 5621 N N . GLN A ? 372 ? 9.999 -31.399 -0.394 1.0 98.7 372 A 1 -ATOM 5622 C CA . GLN A ? 372 ? 10.762 -30.428 -1.181 1.0 98.77 372 A 1 -ATOM 5623 C C . GLN A ? 372 ? 10.542 -28.993 -0.692 1.0 98.84 372 A 1 -ATOM 5624 O O . GLN A ? 372 ? 9.461 -28.630 -0.224 1.0 98.68 372 A 1 -ATOM 5625 C CB . GLN A ? 372 ? 10.426 -30.527 -2.676 1.0 98.61 372 A 1 -ATOM 5626 C CG . GLN A ? 372 ? 10.912 -31.841 -3.303 1.0 98.11 372 A 1 -ATOM 5627 C CD . GLN A ? 372 ? 10.811 -31.811 -4.829 1.0 98.08 372 A 1 -ATOM 5628 O OE1 . GLN A ? 372 ? 9.811 -31.435 -5.423 1.0 94.86 372 A 1 -ATOM 5629 N NE2 . GLN A ? 372 ? 11.851 -32.210 -5.519 1.0 94.5 372 A 1 -ATOM 5630 N N . LYS A ? 373 ? 11.571 -28.152 -0.874 1.0 98.88 373 A 1 -ATOM 5631 C CA . LYS A ? 373 ? 11.536 -26.719 -0.584 1.0 98.92 373 A 1 -ATOM 5632 C C . LYS A ? 373 ? 11.543 -25.907 -1.873 1.0 98.94 373 A 1 -ATOM 5633 O O . LYS A ? 373 ? 12.282 -26.215 -2.807 1.0 98.83 373 A 1 -ATOM 5634 C CB . LYS A ? 373 ? 12.701 -26.335 0.332 1.0 98.79 373 A 1 -ATOM 5635 C CG . LYS A ? 373 ? 12.676 -27.112 1.656 1.0 97.95 373 A 1 -ATOM 5636 C CD . LYS A ? 373 ? 13.853 -26.718 2.543 1.0 96.44 373 A 1 -ATOM 5637 C CE . LYS A ? 373 ? 13.960 -27.639 3.765 1.0 91.93 373 A 1 -ATOM 5638 N NZ . LYS A ? 373 ? 14.508 -28.967 3.401 1.0 86.87 373 A 1 -ATOM 5639 N N . GLY A ? 374 ? 10.746 -24.863 -1.912 1.0 98.94 374 A 1 -ATOM 5640 C CA . GLY A ? 374 ? 10.686 -23.927 -3.027 1.0 98.95 374 A 1 -ATOM 5641 C C . GLY A ? 374 ? 10.962 -22.501 -2.577 1.0 98.96 374 A 1 -ATOM 5642 O O . GLY A ? 374 ? 10.520 -22.091 -1.506 1.0 98.88 374 A 1 -ATOM 5643 N N . CYS A ? 375 ? 11.677 -21.743 -3.392 1.0 98.94 375 A 1 -ATOM 5644 C CA . CYS A ? 375 ? 11.898 -20.315 -3.173 1.0 98.96 375 A 1 -ATOM 5645 C C . CYS A ? 375 ? 11.270 -19.503 -4.309 1.0 98.96 375 A 1 -ATOM 5646 O O . CYS A ? 375 ? 11.582 -19.718 -5.478 1.0 98.92 375 A 1 -ATOM 5647 C CB . CYS A ? 375 ? 13.401 -20.047 -3.021 1.0 98.92 375 A 1 -ATOM 5648 S SG . CYS A ? 375 ? 13.710 -18.284 -2.675 1.0 98.76 375 A 1 -ATOM 5649 N N . ALA A ? 376 ? 10.417 -18.555 -3.961 1.0 98.97 376 A 1 -ATOM 5650 C CA . ALA A ? 376 ? 9.852 -17.585 -4.886 1.0 98.97 376 A 1 -ATOM 5651 C C . ALA A ? 376 ? 10.481 -16.208 -4.652 1.0 98.97 376 A 1 -ATOM 5652 O O . ALA A ? 376 ? 10.602 -15.769 -3.508 1.0 98.91 376 A 1 -ATOM 5653 C CB . ALA A ? 376 ? 8.328 -17.557 -4.726 1.0 98.91 376 A 1 -ATOM 5654 N N . ALA A ? 377 ? 10.860 -15.507 -5.718 1.0 98.96 377 A 1 -ATOM 5655 C CA . ALA A ? 377 ? 11.351 -14.138 -5.654 1.0 98.97 377 A 1 -ATOM 5656 C C . ALA A ? 377 ? 10.793 -13.296 -6.809 1.0 98.97 377 A 1 -ATOM 5657 O O . ALA A ? 377 ? 10.659 -13.762 -7.935 1.0 98.91 377 A 1 -ATOM 5658 C CB . ALA A ? 377 ? 12.887 -14.141 -5.632 1.0 98.92 377 A 1 -ATOM 5659 N N . ILE A ? 378 ? 10.477 -12.035 -6.527 1.0 98.95 378 A 1 -ATOM 5660 C CA . ILE A ? 378 ? 9.903 -11.119 -7.514 1.0 98.96 378 A 1 -ATOM 5661 C C . ILE A ? 378 ? 10.443 -9.705 -7.305 1.0 98.95 378 A 1 -ATOM 5662 O O . ILE A ? 378 ? 10.338 -9.151 -6.216 1.0 98.83 378 A 1 -ATOM 5663 C CB . ILE A ? 378 ? 8.359 -11.205 -7.502 1.0 98.92 378 A 1 -ATOM 5664 C CG1 . ILE A ? 378 ? 7.747 -10.287 -8.582 1.0 98.78 378 A 1 -ATOM 5665 C CG2 . ILE A ? 378 ? 7.745 -10.904 -6.116 1.0 98.74 378 A 1 -ATOM 5666 C CD1 . ILE A ? 378 ? 6.281 -10.598 -8.898 1.0 98.37 378 A 1 -ATOM 5667 N N . CYS A ? 379 ? 11.008 -9.106 -8.359 1.0 98.9 379 A 1 -ATOM 5668 C CA . CYS A ? 379 ? 11.389 -7.698 -8.339 1.0 98.86 379 A 1 -ATOM 5669 C C . CYS A ? 379 ? 10.150 -6.792 -8.404 1.0 98.86 379 A 1 -ATOM 5670 O O . CYS A ? 379 ? 9.090 -7.192 -8.886 1.0 98.69 379 A 1 -ATOM 5671 C CB . CYS A ? 379 ? 12.382 -7.401 -9.474 1.0 98.55 379 A 1 -ATOM 5672 S SG . CYS A ? 379 ? 11.659 -7.741 -11.104 1.0 97.97 379 A 1 -ATOM 5673 N N . ASN A ? 380 ? 10.298 -5.551 -7.951 1.0 98.76 380 A 1 -ATOM 5674 C CA . ASN A ? 380 ? 9.258 -4.538 -8.085 1.0 98.73 380 A 1 -ATOM 5675 C C . ASN A ? 380 ? 9.841 -3.164 -8.413 1.0 98.73 380 A 1 -ATOM 5676 O O . ASN A ? 380 ? 10.951 -2.842 -7.991 1.0 98.23 380 A 1 -ATOM 5677 C CB . ASN A ? 380 ? 8.361 -4.541 -6.835 1.0 98.33 380 A 1 -ATOM 5678 C CG . ASN A ? 380 ? 9.061 -4.170 -5.534 1.0 98.45 380 A 1 -ATOM 5679 O OD1 . ASN A ? 380 ? 9.301 -5.011 -4.680 1.0 93.73 380 A 1 -ATOM 5680 N ND2 . ASN A ? 380 ? 9.321 -2.909 -5.291 1.0 92.71 380 A 1 -ATOM 5681 N N . GLY A ? 381 ? 9.081 -2.336 -9.135 1.0 98.34 381 A 1 -ATOM 5682 C CA . GLY A ? 381 ? 9.455 -0.954 -9.406 1.0 98.11 381 A 1 -ATOM 5683 C C . GLY A ? 381 ? 9.797 -0.187 -8.116 1.0 98.19 381 A 1 -ATOM 5684 O O . GLY A ? 381 ? 9.367 -0.553 -7.022 1.0 97.42 381 A 1 -ATOM 5685 N N . GLY A ? 382 ? 10.614 0.853 -8.231 1.0 97.93 382 A 1 -ATOM 5686 C CA . GLY A ? 382 ? 11.176 1.534 -7.062 1.0 98.04 382 A 1 -ATOM 5687 C C . GLY A ? 382 ? 12.357 0.791 -6.414 1.0 98.38 382 A 1 -ATOM 5688 O O . GLY A ? 382 ? 12.767 1.151 -5.315 1.0 97.34 382 A 1 -ATOM 5689 N N . GLY A ? 383 ? 12.906 -0.229 -7.079 1.0 98.43 383 A 1 -ATOM 5690 C CA . GLY A ? 383 ? 14.155 -0.890 -6.676 1.0 98.52 383 A 1 -ATOM 5691 C C . GLY A ? 383 ? 14.004 -2.016 -5.653 1.0 98.64 383 A 1 -ATOM 5692 O O . GLY A ? 383 ? 14.990 -2.407 -5.032 1.0 97.91 383 A 1 -ATOM 5693 N N . GLY A ? 384 ? 12.798 -2.552 -5.454 1.0 98.59 384 A 1 -ATOM 5694 C CA . GLY A ? 384 ? 12.539 -3.583 -4.456 1.0 98.65 384 A 1 -ATOM 5695 C C . GLY A ? 384 ? 12.440 -5.010 -5.005 1.0 98.8 384 A 1 -ATOM 5696 O O . GLY A ? 384 ? 12.377 -5.249 -6.210 1.0 98.57 384 A 1 -ATOM 5697 N N . ALA A ? 385 ? 12.375 -5.961 -4.076 1.0 98.84 385 A 1 -ATOM 5698 C CA . ALA A ? 385 ? 11.956 -7.331 -4.332 1.0 98.89 385 A 1 -ATOM 5699 C C . ALA A ? 385 ? 11.265 -7.932 -3.103 1.0 98.89 385 A 1 -ATOM 5700 O O . ALA A ? 385 ? 11.557 -7.562 -1.966 1.0 98.77 385 A 1 -ATOM 5701 C CB . ALA A ? 385 ? 13.159 -8.181 -4.751 1.0 98.78 385 A 1 -ATOM 5702 N N . GLY A ? 386 ? 10.366 -8.888 -3.339 1.0 98.9 386 A 1 -ATOM 5703 C CA . GLY A ? 386 ? 9.843 -9.797 -2.321 1.0 98.92 386 A 1 -ATOM 5704 C C . GLY A ? 386 ? 10.424 -11.198 -2.500 1.0 98.94 386 A 1 -ATOM 5705 O O . GLY A ? 386 ? 10.742 -11.605 -3.622 1.0 98.88 386 A 1 -ATOM 5706 N N . GLY A ? 387 ? 10.539 -11.943 -1.407 1.0 98.93 387 A 1 -ATOM 5707 C CA . GLY A ? 387 ? 10.991 -13.327 -1.408 1.0 98.93 387 A 1 -ATOM 5708 C C . GLY A ? 387 ? 10.241 -14.177 -0.385 1.0 98.93 387 A 1 -ATOM 5709 O O . GLY A ? 387 ? 9.872 -13.704 0.686 1.0 98.76 387 A 1 -ATOM 5710 N N . MET A ? 388 ? 10.023 -15.452 -0.729 1.0 98.9 388 A 1 -ATOM 5711 C CA . MET A ? 388 ? 9.409 -16.445 0.154 1.0 98.88 388 A 1 -ATOM 5712 C C . MET A ? 388 ? 10.070 -17.806 -0.020 1.0 98.94 388 A 1 -ATOM 5713 O O . MET A ? 388 ? 10.454 -18.175 -1.122 1.0 98.82 388 A 1 -ATOM 5714 C CB . MET A ? 388 ? 7.904 -16.576 -0.125 1.0 97.91 388 A 1 -ATOM 5715 C CG . MET A ? 388 ? 7.126 -15.429 0.500 1.0 88.65 388 A 1 -ATOM 5716 S SD . MET A ? 388 ? 5.334 -15.546 0.336 1.0 93.95 388 A 1 -ATOM 5717 C CE . MET A ? 388 ? 4.899 -14.206 1.455 1.0 90.03 388 A 1 -ATOM 5718 N N . ILE A ? 389 ? 10.142 -18.568 1.067 1.0 98.87 389 A 1 -ATOM 5719 C CA . ILE A ? 389 ? 10.517 -19.984 1.038 1.0 98.89 389 A 1 -ATOM 5720 C C . ILE A ? 389 ? 9.389 -20.784 1.678 1.0 98.87 389 A 1 -ATOM 5721 O O . ILE A ? 389 ? 8.922 -20.456 2.766 1.0 98.77 389 A 1 -ATOM 5722 C CB . ILE A ? 389 ? 11.880 -20.250 1.707 1.0 98.87 389 A 1 -ATOM 5723 C CG1 . ILE A ? 389 ? 12.986 -19.398 1.040 1.0 98.49 389 A 1 -ATOM 5724 C CG2 . ILE A ? 389 ? 12.234 -21.749 1.618 1.0 98.65 389 A 1 -ATOM 5725 C CD1 . ILE A ? 389 ? 14.357 -19.518 1.701 1.0 97.91 389 A 1 -ATOM 5726 N N . ILE A ? 390 ? 8.967 -21.839 0.997 1.0 98.9 390 A 1 -ATOM 5727 C CA . ILE A ? 390 ? 7.945 -22.774 1.466 1.0 98.91 390 A 1 -ATOM 5728 C C . ILE A ? 390 ? 8.464 -24.210 1.402 1.0 98.91 390 A 1 -ATOM 5729 O O . ILE A ? 390 ? 9.367 -24.527 0.632 1.0 98.84 390 A 1 -ATOM 5730 C CB . ILE A ? 390 ? 6.613 -22.602 0.696 1.0 98.83 390 A 1 -ATOM 5731 C CG1 . ILE A ? 390 ? 6.727 -23.025 -0.783 1.0 98.16 390 A 1 -ATOM 5732 C CG2 . ILE A ? 390 ? 6.104 -21.154 0.824 1.0 97.92 390 A 1 -ATOM 5733 C CD1 . ILE A ? 390 ? 5.380 -23.056 -1.516 1.0 97.59 390 A 1 -ATOM 5734 N N . GLU A ? 391 ? 7.867 -25.093 2.200 1.0 98.87 391 A 1 -ATOM 5735 C CA . GLU A ? 391 ? 8.118 -26.537 2.173 1.0 98.85 391 A 1 -ATOM 5736 C C . GLU A ? 391 ? 6.814 -27.279 1.889 1.0 98.86 391 A 1 -ATOM 5737 O O . GLU A ? 391 ? 5.801 -27.041 2.549 1.0 98.7 391 A 1 -ATOM 5738 C CB . GLU A ? 391 ? 8.741 -26.964 3.507 1.0 98.67 391 A 1 -ATOM 5739 C CG . GLU A ? 391 ? 9.009 -28.469 3.614 1.0 97.96 391 A 1 -ATOM 5740 C CD . GLU A ? 391 ? 9.665 -28.851 4.949 1.0 97.54 391 A 1 -ATOM 5741 O OE1 . GLU A ? 391 ? 10.484 -29.794 4.953 1.0 93.87 391 A 1 -ATOM 5742 O OE2 . GLU A ? 391 ? 9.354 -28.206 5.978 1.0 93.98 391 A 1 -ATOM 5743 N N . LYS A ? 392 ? 6.843 -28.187 0.915 1.0 98.83 392 A 1 -ATOM 5744 C CA . LYS A ? 392 ? 5.693 -29.027 0.566 1.0 98.79 392 A 1 -ATOM 5745 C C . LYS A ? 392 ? 5.439 -30.056 1.664 1.0 98.76 392 A 1 -ATOM 5746 O O . LYS A ? 392 ? 6.368 -30.710 2.131 1.0 98.17 392 A 1 -ATOM 5747 C CB . LYS A ? 392 ? 5.931 -29.696 -0.788 1.0 98.44 392 A 1 -ATOM 5748 C CG . LYS A ? 392 ? 4.711 -30.456 -1.331 1.0 96.47 392 A 1 -ATOM 5749 C CD . LYS A ? 392 ? 3.609 -29.509 -1.796 1.0 94.43 392 A 1 -ATOM 5750 C CE . LYS A ? 392 ? 2.481 -30.285 -2.475 1.0 92.4 392 A 1 -ATOM 5751 N NZ . LYS A ? 392 ? 1.620 -29.384 -3.277 1.0 90.18 392 A 1 -ATOM 5752 N N . LEU A ? 393 ? 4.179 -30.214 2.036 1.0 97.88 393 A 1 -ATOM 5753 C CA . LEU A ? 393 ? 3.718 -31.184 3.018 1.0 97.54 393 A 1 -ATOM 5754 C C . LEU A ? 393 ? 3.135 -32.445 2.365 1.0 95.84 393 A 1 -ATOM 5755 O O . LEU A ? 393 ? 2.644 -32.382 1.226 1.0 90.07 393 A 1 -ATOM 5756 C CB . LEU A ? 393 ? 2.735 -30.504 3.984 1.0 96.55 393 A 1 -ATOM 5757 C CG . LEU A ? 393 ? 3.346 -29.357 4.818 1.0 96.7 393 A 1 -ATOM 5758 C CD1 . LEU A ? 393 ? 2.265 -28.691 5.661 1.0 94.56 393 A 1 -ATOM 5759 C CD2 . LEU A ? 393 ? 4.446 -29.854 5.759 1.0 94.26 393 A 1 -ATOM 5760 O OXT . LEU A ? 393 ? 3.175 -33.514 3.047 1.0 91.88 393 A 1 -HETATM 5761 N N1A . ACO D ? . ? -21.543 26.149 7.498 1.0 95.23 1 D 1 -HETATM 5762 C C2A . ACO D ? . ? -22.587 26.718 6.864 1.0 95.71 1 D 1 -HETATM 5763 N N3A . ACO D ? . ? -22.885 26.515 5.586 1.0 96.29 1 D 1 -HETATM 5764 C C4A . ACO D ? . ? -22.097 25.680 4.897 1.0 96.68 1 D 1 -HETATM 5765 C C5A . ACO D ? . ? -21.001 25.042 5.467 1.0 96.61 1 D 1 -HETATM 5766 C C6A . ACO D ? . ? -20.734 25.303 6.833 1.0 96.21 1 D 1 -HETATM 5767 N N6A . ACO D ? . ? -19.708 24.739 7.475 1.0 94.9 1 D 1 -HETATM 5768 N N7A . ACO D ? . ? -20.409 24.267 4.524 1.0 95.6 1 D 1 -HETATM 5769 C C8A . ACO D ? . ? -21.119 24.425 3.410 1.0 96.06 1 D 1 -HETATM 5770 N N9A . ACO D ? . ? -22.152 25.282 3.630 1.0 96.49 1 D 1 -HETATM 5771 C C1B . ACO D ? . ? -23.160 25.719 2.689 1.0 96.61 1 D 1 -HETATM 5772 C C2B . ACO D ? . ? -22.565 26.495 1.540 1.0 96.09 1 D 1 -HETATM 5773 O O2B . ACO D ? . ? -22.387 27.856 1.863 1.0 94.05 1 D 1 -HETATM 5774 C C3B . ACO D ? . ? -23.582 26.254 0.458 1.0 95.82 1 D 1 -HETATM 5775 O O3B . ACO D ? . ? -24.667 27.142 0.669 1.0 93.4 1 D 1 -HETATM 5776 P P3B . ACO D ? . ? -25.459 27.752 -0.562 1.0 88.87 1 D 1 -HETATM 5777 O O7A . ACO D ? . ? -24.462 28.583 -1.314 1.0 75.45 1 D 1 -HETATM 5778 O O8A . ACO D ? . ? -25.976 26.592 -1.389 1.0 78.02 1 D 1 -HETATM 5779 O O9A . ACO D ? . ? -26.569 28.541 0.081 1.0 76.6 1 D 1 -HETATM 5780 C C4B . ACO D ? . ? -24.057 24.840 0.740 1.0 95.81 1 D 1 -HETATM 5781 O O4B . ACO D ? . ? -23.786 24.597 2.107 1.0 96.1 1 D 1 -HETATM 5782 C C5B . ACO D ? . ? -23.345 23.813 -0.090 1.0 92.97 1 D 1 -HETATM 5783 O O5B . ACO D ? . ? -21.941 23.994 0.116 1.0 92.21 1 D 1 -HETATM 5784 P P1A . ACO D ? . ? -20.878 23.650 -0.973 1.0 91.62 1 D 1 -HETATM 5785 O O1A . ACO D ? . ? -19.534 24.075 -0.500 1.0 76.25 1 D 1 -HETATM 5786 O O2A . ACO D ? . ? -21.312 24.190 -2.311 1.0 75.47 1 D 1 -HETATM 5787 O O3A . ACO D ? . ? -20.960 22.073 -0.968 1.0 90.95 1 D 1 -HETATM 5788 P P2A . ACO D ? . ? -20.804 21.069 -2.139 1.0 91.36 1 D 1 -HETATM 5789 O O4A . ACO D ? . ? -22.163 20.856 -2.733 1.0 77.61 1 D 1 -HETATM 5790 O O5A . ACO D ? . ? -19.699 21.518 -3.039 1.0 76.78 1 D 1 -HETATM 5791 O O6A . ACO D ? . ? -20.323 19.745 -1.387 1.0 93.23 1 D 1 -HETATM 5792 C CBP . ACO D ? . ? -20.714 17.850 0.021 1.0 96.88 1 D 1 -HETATM 5793 C CCP . ACO D ? . ? -20.917 19.339 -0.197 1.0 93.2 1 D 1 -HETATM 5794 C CDP . ACO D ? . ? -21.268 17.517 1.392 1.0 88.92 1 D 1 -HETATM 5795 C CEP . ACO D ? . ? -21.496 17.083 -1.044 1.0 87.13 1 D 1 -HETATM 5796 C CAP . ACO D ? . ? -19.213 17.485 -0.054 1.0 97.01 1 D 1 -HETATM 5797 O OAP . ACO D ? . ? -18.464 18.193 0.903 1.0 95.48 1 D 1 -HETATM 5798 C C9P . ACO D ? . ? -19.005 16.003 0.189 1.0 97.5 1 D 1 -HETATM 5799 O O9P . ACO D ? . ? -19.115 15.218 -0.750 1.0 96.07 1 D 1 -HETATM 5800 N N8P . ACO D ? . ? -18.730 15.612 1.450 1.0 96.94 1 D 1 -HETATM 5801 C C7P . ACO D ? . ? -18.641 14.217 1.802 1.0 96.77 1 D 1 -HETATM 5802 C C6P . ACO D ? . ? -17.237 13.693 1.624 1.0 96.73 1 D 1 -HETATM 5803 C C5P . ACO D ? . ? -17.180 12.206 1.953 1.0 97.83 1 D 1 -HETATM 5804 O O5P . ACO D ? . ? -18.066 11.449 1.597 1.0 96.78 1 D 1 -HETATM 5805 N N4P . ACO D ? . ? -16.103 11.782 2.637 1.0 96.8 1 D 1 -HETATM 5806 C C3P . ACO D ? . ? -15.911 10.404 3.010 1.0 92.69 1 D 1 -HETATM 5807 C C2P . ACO D ? . ? -16.630 10.100 4.327 1.0 89.22 1 D 1 -HETATM 5808 S S1P . ACO D ? . ? -17.020 8.384 4.374 1.0 92.29 1 D 1 -HETATM 5809 C C . ACO D ? . ? -15.913 7.664 5.410 1.0 94.67 1 D 1 -HETATM 5810 O O . ACO D ? . ? -14.991 8.262 5.889 1.0 90.68 1 D 1 -HETATM 5811 C CH3 . ACO D ? . ? -16.152 6.197 5.685 1.0 87.94 1 D 1 -HETATM 5812 N N1A . ACO C ? . ? 8.227 -13.871 -30.484 1.0 95.33 1 C 1 -HETATM 5813 C C2A . ACO C ? . ? 8.573 -13.270 -31.634 1.0 95.8 1 C 1 -HETATM 5814 N N3A . ACO C ? . ? 8.244 -12.020 -31.943 1.0 96.37 1 C 1 -HETATM 5815 C C4A . ACO C ? . ? 7.539 -11.329 -31.046 1.0 96.82 1 C 1 -HETATM 5816 C C5A . ACO C ? . ? 7.146 -11.863 -29.831 1.0 96.7 1 C 1 -HETATM 5817 C C6A . ACO C ? . ? 7.523 -13.200 -29.560 1.0 96.34 1 C 1 -HETATM 5818 N N6A . ACO C ? . ? 7.204 -13.804 -28.415 1.0 95.14 1 C 1 -HETATM 5819 N N7A . ACO C ? . ? 6.458 -10.921 -29.142 1.0 95.72 1 C 1 -HETATM 5820 C C8A . ACO C ? . ? 6.426 -9.839 -29.909 1.0 96.13 1 C 1 -HETATM 5821 N N9A . ACO C ? . ? 7.086 -10.082 -31.074 1.0 96.56 1 C 1 -HETATM 5822 C C1B . ACO C ? . ? 7.285 -9.172 -32.180 1.0 96.56 1 C 1 -HETATM 5823 C C2B . ACO C ? . ? 5.986 -8.771 -32.831 1.0 96.19 1 C 1 -HETATM 5824 O O2B . ACO C ? . ? 5.570 -9.711 -33.790 1.0 94.03 1 C 1 -HETATM 5825 C C3B . ACO C ? . ? 6.341 -7.435 -33.425 1.0 95.88 1 C 1 -HETATM 5826 O O3B . ACO C ? . ? 7.031 -7.654 -34.641 1.0 93.33 1 C 1 -HETATM 5827 P P3B . ACO C ? . ? 6.866 -6.643 -35.866 1.0 88.67 1 C 1 -HETATM 5828 O O7A . ACO C ? . ? 5.418 -6.717 -36.270 1.0 74.43 1 C 1 -HETATM 5829 O O8A . ACO C ? . ? 7.243 -5.264 -35.374 1.0 77.51 1 C 1 -HETATM 5830 O O9A . ACO C ? . ? 7.820 -7.172 -36.899 1.0 75.8 1 C 1 -HETATM 5831 C C4B . ACO C ? . ? 7.321 -6.867 -32.411 1.0 95.61 1 C 1 -HETATM 5832 O O4B . ACO C ? . ? 7.865 -7.976 -31.716 1.0 96.04 1 C 1 -HETATM 5833 C C5B . ACO C ? . ? 6.667 -5.941 -31.425 1.0 92.76 1 C 1 -HETATM 5834 O O5B . ACO C ? . ? 5.592 -6.656 -30.834 1.0 91.93 1 C 1 -HETATM 5835 P P1A . ACO C ? . ? 4.309 -5.936 -30.305 1.0 91.23 1 C 1 -HETATM 5836 O O1A . ACO C ? . ? 3.321 -6.958 -29.863 1.0 75.61 1 C 1 -HETATM 5837 O O2A . ACO C ? . ? 3.822 -4.932 -31.316 1.0 74.42 1 C 1 -HETATM 5838 O O3A . ACO C ? . ? 4.891 -5.193 -29.041 1.0 90.64 1 C 1 -HETATM 5839 P P2A . ACO C ? . ? 4.507 -3.813 -28.437 1.0 90.84 1 C 1 -HETATM 5840 O O4A . ACO C ? . ? 5.366 -2.775 -29.088 1.0 76.6 1 C 1 -HETATM 5841 O O5A . ACO C ? . ? 3.019 -3.634 -28.495 1.0 76.14 1 C 1 -HETATM 5842 O O6A . ACO C ? . ? 4.914 -3.987 -26.895 1.0 92.89 1 C 1 -HETATM 5843 C CBP . ACO C ? . ? 6.539 -4.170 -25.139 1.0 96.54 1 C 1 -HETATM 5844 C CCP . ACO C ? . ? 6.115 -4.601 -26.533 1.0 92.66 1 C 1 -HETATM 5845 C CDP . ACO C ? . ? 7.773 -4.973 -24.769 1.0 88.2 1 C 1 -HETATM 5846 C CEP . ACO C ? . ? 6.897 -2.675 -25.161 1.0 86.24 1 C 1 -HETATM 5847 C CAP . ACO C ? . ? 5.410 -4.424 -24.114 1.0 96.78 1 C 1 -HETATM 5848 O OAP . ACO C ? . ? 5.057 -5.779 -24.078 1.0 95.12 1 C 1 -HETATM 5849 C C9P . ACO C ? . ? 5.842 -4.017 -22.718 1.0 97.26 1 C 1 -HETATM 5850 O O9P . ACO C ? . ? 5.716 -2.843 -22.360 1.0 95.39 1 C 1 -HETATM 5851 N N8P . ACO C ? . ? 6.380 -4.969 -21.928 1.0 96.54 1 C 1 -HETATM 5852 C C7P . ACO C ? . ? 6.928 -4.656 -20.631 1.0 96.58 1 C 1 -HETATM 5853 C C6P . ACO C ? . ? 5.883 -4.720 -19.548 1.0 96.59 1 C 1 -HETATM 5854 C C5P . ACO C ? . ? 6.477 -4.343 -18.201 1.0 97.71 1 C 1 -HETATM 5855 O O5P . ACO C ? . ? 7.257 -3.405 -18.099 1.0 96.49 1 C 1 -HETATM 5856 N N4P . ACO C ? . ? 6.082 -5.061 -17.144 1.0 96.7 1 C 1 -HETATM 5857 C C3P . ACO C ? . ? 6.558 -4.808 -15.810 1.0 92.51 1 C 1 -HETATM 5858 C C2P . ACO C ? . ? 7.880 -5.524 -15.557 1.0 89.16 1 C 1 -HETATM 5859 S S1P . ACO C ? . ? 8.787 -4.650 -14.314 1.0 91.42 1 C 1 -HETATM 5860 C C . ACO C ? . ? 8.635 -5.565 -12.908 1.0 94.25 1 C 1 -HETATM 5861 O O . ACO C ? . ? 7.934 -6.533 -12.820 1.0 90.69 1 C 1 -HETATM 5862 C CH3 . ACO C ? . ? 9.450 -5.050 -11.733 1.0 88.39 1 C 1 +ATOM 1 N N . GLY A ? 1 ? -3.189 -18.010 22.096 1.0 34.03 1 A 1 +ATOM 2 C CA . GLY A ? 1 ? -2.047 -18.148 23.028 1.0 34.48 1 A 1 +ATOM 3 C C . GLY A ? 1 ? -1.344 -16.817 23.158 1.0 36.73 1 A 1 +ATOM 4 O O . GLY A ? 1 ? -1.497 -15.976 22.291 1.0 34.54 1 A 1 +ATOM 5 N N . THR A ? 2 ? -0.593 -16.621 24.250 1.0 41.54 2 A 1 +ATOM 6 C CA . THR A ? 2 ? 0.079 -15.335 24.530 1.0 41.55 2 A 1 +ATOM 7 C C . THR A ? 2 ? 1.374 -15.109 23.741 1.0 43.63 2 A 1 +ATOM 8 O O . THR A ? 2 ? 1.932 -14.017 23.787 1.0 40.57 2 A 1 +ATOM 9 C CB . THR A ? 2 ? 0.398 -15.225 26.030 1.0 37.29 2 A 1 +ATOM 10 O OG1 . THR A ? 2 ? 0.980 -16.438 26.482 1.0 34.86 2 A 1 +ATOM 11 C CG2 . THR A ? 2 ? -0.857 -14.995 26.876 1.0 33.89 2 A 1 +ATOM 12 N N . GLY A ? 3 ? 1.884 -16.131 23.059 1.0 56.15 3 A 1 +ATOM 13 C CA . GLY A ? 3 ? 3.089 -16.048 22.236 1.0 58.46 3 A 1 +ATOM 14 C C . GLY A ? 3 ? 2.765 -16.065 20.746 1.0 63.8 3 A 1 +ATOM 15 O O . GLY A ? 3 ? 1.715 -16.568 20.343 1.0 59.43 3 A 1 +ATOM 16 N N . SER A ? 4 ? 3.688 -15.573 19.927 1.0 76.4 4 A 1 +ATOM 17 C CA . SER A ? 4 ? 3.600 -15.762 18.478 1.0 82.26 4 A 1 +ATOM 18 C C . SER A ? 4 ? 3.821 -17.216 18.114 1.0 87.63 4 A 1 +ATOM 19 O O . SER A ? 4 ? 4.668 -17.900 18.693 1.0 83.61 4 A 1 +ATOM 20 C CB . SER A ? 4 ? 4.628 -14.943 17.705 1.0 72.49 4 A 1 +ATOM 21 O OG . SER A ? 4 ? 5.930 -15.174 18.206 1.0 63.85 4 A 1 +ATOM 22 N N . ARG A ? 5 ? 3.144 -17.643 17.071 1.0 89.58 5 A 1 +ATOM 23 C CA . ARG A ? 5 ? 3.431 -18.919 16.421 1.0 92.16 5 A 1 +ATOM 24 C C . ARG A ? 5 ? 4.751 -18.834 15.655 1.0 94.13 5 A 1 +ATOM 25 O O . ARG A ? 5 ? 5.066 -17.785 15.080 1.0 92.93 5 A 1 +ATOM 26 C CB . ARG A ? 5 ? 2.270 -19.291 15.502 1.0 90.55 5 A 1 +ATOM 27 C CG . ARG A ? 5 ? 0.992 -19.555 16.306 1.0 88.06 5 A 1 +ATOM 28 C CD . ARG A ? 5 ? -0.171 -19.831 15.370 1.0 85.23 5 A 1 +ATOM 29 N NE . ARG A ? 5 ? -1.392 -20.104 16.137 1.0 85.67 5 A 1 +ATOM 30 C CZ . ARG A ? 5 ? -1.835 -21.284 16.532 1.0 87.0 5 A 1 +ATOM 31 N NH1 . ARG A ? 5 ? -1.264 -22.402 16.186 1.0 79.23 5 A 1 +ATOM 32 N NH2 . ARG A ? 5 ? -2.878 -21.344 17.293 1.0 82.13 5 A 1 +ATOM 33 N N . PRO A ? 6 ? 5.529 -19.930 15.604 1.0 93.57 6 A 1 +ATOM 34 C CA . PRO A ? 6 ? 6.645 -19.998 14.675 1.0 94.73 6 A 1 +ATOM 35 C C . PRO A ? 6 ? 6.125 -19.871 13.237 1.0 96.14 6 A 1 +ATOM 36 O O . PRO A ? 6 ? 4.998 -20.265 12.926 1.0 95.47 6 A 1 +ATOM 37 C CB . PRO A ? 6 ? 7.317 -21.346 14.941 1.0 92.86 6 A 1 +ATOM 38 C CG . PRO A ? 6 ? 6.167 -22.216 15.465 1.0 91.36 6 A 1 +ATOM 39 C CD . PRO A ? 6 ? 5.305 -21.221 16.241 1.0 93.57 6 A 1 +ATOM 40 N N . ILE A ? 7 ? 6.960 -19.371 12.337 1.0 95.88 7 A 1 +ATOM 41 C CA . ILE A ? 7 ? 6.599 -19.210 10.919 1.0 96.98 7 A 1 +ATOM 42 C C . ILE A ? 7 ? 6.100 -20.522 10.285 1.0 97.66 7 A 1 +ATOM 43 O O . ILE A ? 7 ? 5.215 -20.509 9.434 1.0 97.04 7 A 1 +ATOM 44 C CB . ILE A ? 7 ? 7.799 -18.617 10.153 1.0 96.11 7 A 1 +ATOM 45 C CG1 . ILE A ? 7 ? 7.473 -18.236 8.690 1.0 90.85 7 A 1 +ATOM 46 C CG2 . ILE A ? 7 ? 9.028 -19.562 10.146 1.0 90.21 7 A 1 +ATOM 47 C CD1 . ILE A ? 7 ? 6.417 -17.161 8.549 1.0 84.49 7 A 1 +ATOM 48 N N . THR A ? 8 ? 6.611 -21.666 10.762 1.0 95.41 8 A 1 +ATOM 49 C CA . THR A ? 8 ? 6.250 -23.012 10.287 1.0 95.84 8 A 1 +ATOM 50 C C . THR A ? 8 ? 4.831 -23.453 10.662 1.0 97.08 8 A 1 +ATOM 51 O O . THR A ? 8 ? 4.352 -24.446 10.115 1.0 96.26 8 A 1 +ATOM 52 C CB . THR A ? 8 ? 7.250 -24.047 10.820 1.0 94.26 8 A 1 +ATOM 53 O OG1 . THR A ? 8 ? 7.394 -23.920 12.221 1.0 91.28 8 A 1 +ATOM 54 C CG2 . THR A ? 8 ? 8.635 -23.860 10.201 1.0 90.28 8 A 1 +ATOM 55 N N . ASP A ? 9 ? 4.140 -22.733 11.548 1.0 96.65 9 A 1 +ATOM 56 C CA . ASP A ? 9 ? 2.719 -22.954 11.838 1.0 97.38 9 A 1 +ATOM 57 C C . ASP A ? 9 ? 1.800 -22.342 10.773 1.0 98.12 9 A 1 +ATOM 58 O O . ASP A ? 9 ? 0.623 -22.696 10.705 1.0 97.64 9 A 1 +ATOM 59 C CB . ASP A ? 9 ? 2.356 -22.386 13.217 1.0 96.14 9 A 1 +ATOM 60 C CG . ASP A ? 9 ? 2.625 -23.328 14.388 1.0 91.51 9 A 1 +ATOM 61 O OD1 . ASP A ? 9 ? 3.300 -24.365 14.201 1.0 87.29 9 A 1 +ATOM 62 O OD2 . ASP A ? 9 ? 2.110 -23.004 15.485 1.0 87.05 9 A 1 +ATOM 63 N N . VAL A ? 10 ? 2.324 -21.449 9.934 1.0 98.33 10 A 1 +ATOM 64 C CA . VAL A ? 10 ? 1.585 -20.878 8.803 1.0 98.59 10 A 1 +ATOM 65 C C . VAL A ? 10 ? 1.593 -21.872 7.644 1.0 98.73 10 A 1 +ATOM 66 O O . VAL A ? 10 ? 2.647 -22.229 7.120 1.0 98.65 10 A 1 +ATOM 67 C CB . VAL A ? 10 ? 2.161 -19.517 8.368 1.0 98.44 10 A 1 +ATOM 68 C CG1 . VAL A ? 10 ? 1.389 -18.940 7.176 1.0 97.85 10 A 1 +ATOM 69 C CG2 . VAL A ? 10 ? 2.096 -18.496 9.511 1.0 97.87 10 A 1 +ATOM 70 N N . VAL A ? 11 ? 0.408 -22.291 7.220 1.0 98.78 11 A 1 +ATOM 71 C CA . VAL A ? 11 ? 0.230 -23.267 6.142 1.0 98.84 11 A 1 +ATOM 72 C C . VAL A ? 11 ? -0.670 -22.738 5.027 1.0 98.9 11 A 1 +ATOM 73 O O . VAL A ? 11 ? -1.643 -22.026 5.268 1.0 98.86 11 A 1 +ATOM 74 C CB . VAL A ? 11 ? -0.271 -24.629 6.663 1.0 98.67 11 A 1 +ATOM 75 C CG1 . VAL A ? 11 ? 0.766 -25.290 7.576 1.0 97.83 11 A 1 +ATOM 76 C CG2 . VAL A ? 11 ? -1.604 -24.552 7.420 1.0 97.44 11 A 1 +ATOM 77 N N . PHE A ? 12 ? -0.356 -23.131 3.801 1.0 98.91 12 A 1 +ATOM 78 C CA . PHE A ? 12 ? -1.226 -22.987 2.640 1.0 98.93 12 A 1 +ATOM 79 C C . PHE A ? 12 ? -2.134 -24.215 2.553 1.0 98.91 12 A 1 +ATOM 80 O O . PHE A ? 12 ? -1.651 -25.348 2.586 1.0 98.77 12 A 1 +ATOM 81 C CB . PHE A ? 12 ? -0.390 -22.838 1.368 1.0 98.91 12 A 1 +ATOM 82 C CG . PHE A ? 12 ? 0.533 -21.637 1.374 1.0 98.91 12 A 1 +ATOM 83 C CD1 . PHE A ? 12 ? 0.076 -20.398 0.898 1.0 98.7 12 A 1 +ATOM 84 C CD2 . PHE A ? 12 ? 1.845 -21.747 1.873 1.0 98.66 12 A 1 +ATOM 85 C CE1 . PHE A ? 12 ? 0.921 -19.279 0.911 1.0 98.54 12 A 1 +ATOM 86 C CE2 . PHE A ? 12 ? 2.694 -20.627 1.893 1.0 98.52 12 A 1 +ATOM 87 C CZ . PHE A ? 12 ? 2.230 -19.394 1.409 1.0 98.72 12 A 1 +ATOM 88 N N . VAL A ? 13 ? -3.434 -23.990 2.432 1.0 98.91 13 A 1 +ATOM 89 C CA . VAL A ? 13 ? -4.436 -25.058 2.278 1.0 98.88 13 A 1 +ATOM 90 C C . VAL A ? 13 ? -5.111 -25.044 0.907 1.0 98.85 13 A 1 +ATOM 91 O O . VAL A ? 13 ? -5.748 -26.021 0.529 1.0 98.5 13 A 1 +ATOM 92 C CB . VAL A ? 13 ? -5.475 -25.032 3.414 1.0 98.75 13 A 1 +ATOM 93 C CG1 . VAL A ? 13 ? -4.826 -25.374 4.760 1.0 98.03 13 A 1 +ATOM 94 C CG2 . VAL A ? 13 ? -6.195 -23.681 3.547 1.0 97.66 13 A 1 +ATOM 95 N N . GLY A ? 14 ? -4.939 -23.974 0.140 1.0 98.81 14 A 1 +ATOM 96 C CA . GLY A ? 14 ? -5.429 -23.869 -1.231 1.0 98.83 14 A 1 +ATOM 97 C C . GLY A ? 14 ? -4.732 -22.763 -2.007 1.0 98.92 14 A 1 +ATOM 98 O O . GLY A ? 14 ? -4.271 -21.779 -1.433 1.0 98.83 14 A 1 +ATOM 99 N N . ALA A ? 15 ? -4.669 -22.933 -3.321 1.0 98.88 15 A 1 +ATOM 100 C CA . ALA A ? 15 ? -4.192 -21.923 -4.247 1.0 98.89 15 A 1 +ATOM 101 C C . ALA A ? 15 ? -4.881 -22.102 -5.603 1.0 98.89 15 A 1 +ATOM 102 O O . ALA A ? 15 ? -5.074 -23.230 -6.060 1.0 98.69 15 A 1 +ATOM 103 C CB . ALA A ? 15 ? -2.666 -22.022 -4.373 1.0 98.77 15 A 1 +ATOM 104 N N . ALA A ? 16 ? -5.240 -20.999 -6.246 1.0 98.91 16 A 1 +ATOM 105 C CA . ALA A ? 16 ? -5.779 -21.001 -7.600 1.0 98.93 16 A 1 +ATOM 106 C C . ALA A ? 16 ? -5.506 -19.665 -8.293 1.0 98.95 16 A 1 +ATOM 107 O O . ALA A ? 16 ? -5.292 -18.639 -7.642 1.0 98.88 16 A 1 +ATOM 108 C CB . ALA A ? 16 ? -7.280 -21.303 -7.561 1.0 98.79 16 A 1 +ATOM 109 N N . ARG A ? 17 ? -5.564 -19.666 -9.611 1.0 98.93 17 A 1 +ATOM 110 C CA . ARG A ? 17 ? -5.447 -18.468 -10.438 1.0 98.92 17 A 1 +ATOM 111 C C . ARG A ? 17 ? -6.385 -18.515 -11.638 1.0 98.91 17 A 1 +ATOM 112 O O . ARG A ? 17 ? -6.781 -19.590 -12.081 1.0 98.74 17 A 1 +ATOM 113 C CB . ARG A ? 17 ? -3.986 -18.264 -10.860 1.0 98.7 17 A 1 +ATOM 114 C CG . ARG A ? 17 ? -3.465 -19.311 -11.861 1.0 98.34 17 A 1 +ATOM 115 C CD . ARG A ? 17 ? -2.041 -18.953 -12.268 1.0 98.28 17 A 1 +ATOM 116 N NE . ARG A ? 17 ? -1.466 -19.847 -13.267 1.0 98.1 17 A 1 +ATOM 117 C CZ . ARG A ? 17 ? -1.543 -19.731 -14.587 1.0 98.46 17 A 1 +ATOM 118 N NH1 . ARG A ? 17 ? -2.310 -18.870 -15.177 1.0 95.92 17 A 1 +ATOM 119 N NH2 . ARG A ? 17 ? -0.812 -20.492 -15.351 1.0 96.3 17 A 1 +ATOM 120 N N . THR A ? 18 ? -6.678 -17.362 -12.198 1.0 98.92 18 A 1 +ATOM 121 C CA . THR A ? 18 ? -7.260 -17.281 -13.543 1.0 98.91 18 A 1 +ATOM 122 C C . THR A ? 18 ? -6.201 -17.652 -14.591 1.0 98.9 18 A 1 +ATOM 123 O O . THR A ? 18 ? -4.998 -17.606 -14.293 1.0 98.81 18 A 1 +ATOM 124 C CB . THR A ? 18 ? -7.797 -15.874 -13.837 1.0 98.82 18 A 1 +ATOM 125 O OG1 . THR A ? 18 ? -6.760 -14.930 -13.944 1.0 98.32 18 A 1 +ATOM 126 C CG2 . THR A ? 18 ? -8.758 -15.384 -12.758 1.0 97.93 18 A 1 +ATOM 127 N N . PRO A ? 19 ? -6.594 -17.961 -15.829 1.0 98.89 19 A 1 +ATOM 128 C CA . PRO A ? 19 ? -5.691 -17.788 -16.960 1.0 98.86 19 A 1 +ATOM 129 C C . PRO A ? 19 ? -5.145 -16.356 -16.994 1.0 98.89 19 A 1 +ATOM 130 O O . PRO A ? 19 ? -5.752 -15.429 -16.441 1.0 98.79 19 A 1 +ATOM 131 C CB . PRO A ? 19 ? -6.512 -18.114 -18.209 1.0 98.63 19 A 1 +ATOM 132 C CG . PRO A ? 19 ? -7.673 -18.947 -17.670 1.0 97.42 19 A 1 +ATOM 133 C CD . PRO A ? 19 ? -7.903 -18.366 -16.282 1.0 98.58 19 A 1 +ATOM 134 N N . ILE A ? 20 ? -4.006 -16.178 -17.643 1.0 98.9 20 A 1 +ATOM 135 C CA . ILE A ? 20 ? -3.442 -14.857 -17.920 1.0 98.91 20 A 1 +ATOM 136 C C . ILE A ? 20 ? -3.876 -14.446 -19.325 1.0 98.87 20 A 1 +ATOM 137 O O . ILE A ? 20 ? -3.476 -15.062 -20.316 1.0 98.72 20 A 1 +ATOM 138 C CB . ILE A ? 20 ? -1.914 -14.846 -17.725 1.0 98.9 20 A 1 +ATOM 139 C CG1 . ILE A ? 20 ? -1.553 -15.171 -16.253 1.0 98.7 20 A 1 +ATOM 140 C CG2 . ILE A ? 20 ? -1.343 -13.473 -18.125 1.0 98.74 20 A 1 +ATOM 141 C CD1 . ILE A ? 20 ? -0.054 -15.374 -16.004 1.0 97.93 20 A 1 +ATOM 142 N N . GLY A ? 21 ? -4.695 -13.405 -19.410 1.0 98.74 21 A 1 +ATOM 143 C CA . GLY A ? 21 ? -5.115 -12.817 -20.674 1.0 98.71 21 A 1 +ATOM 144 C C . GLY A ? 21 ? -4.035 -11.916 -21.263 1.0 98.81 21 A 1 +ATOM 145 O O . GLY A ? 21 ? -3.338 -11.200 -20.538 1.0 98.68 21 A 1 +ATOM 146 N N . SER A ? 22 ? -3.919 -11.914 -22.584 1.0 98.65 22 A 1 +ATOM 147 C CA . SER A ? 22 ? -3.137 -10.900 -23.292 1.0 98.57 22 A 1 +ATOM 148 C C . SER A ? 22 ? -3.824 -9.535 -23.223 1.0 98.46 22 A 1 +ATOM 149 O O . SER A ? 22 ? -5.041 -9.441 -23.081 1.0 98.0 22 A 1 +ATOM 150 C CB . SER A ? 22 ? -2.932 -11.291 -24.749 1.0 98.37 22 A 1 +ATOM 151 O OG . SER A ? 22 ? -2.142 -12.454 -24.853 1.0 96.64 22 A 1 +ATOM 152 N N . PHE A ? 23 ? -3.051 -8.462 -23.369 1.0 98.35 23 A 1 +ATOM 153 C CA . PHE A ? 23 ? -3.569 -7.096 -23.305 1.0 98.16 23 A 1 +ATOM 154 C C . PHE A ? 23 ? -4.698 -6.861 -24.316 1.0 97.84 23 A 1 +ATOM 155 O O . PHE A ? 23 ? -4.524 -7.086 -25.513 1.0 97.1 23 A 1 +ATOM 156 C CB . PHE A ? 23 ? -2.425 -6.106 -23.522 1.0 97.97 23 A 1 +ATOM 157 C CG . PHE A ? 23 ? -2.824 -4.649 -23.358 1.0 98.28 23 A 1 +ATOM 158 C CD1 . PHE A ? 23 ? -2.643 -3.736 -24.416 1.0 97.76 23 A 1 +ATOM 159 C CD2 . PHE A ? 23 ? -3.366 -4.199 -22.143 1.0 97.59 23 A 1 +ATOM 160 C CE1 . PHE A ? 23 ? -2.982 -2.381 -24.250 1.0 96.91 23 A 1 +ATOM 161 C CE2 . PHE A ? 23 ? -3.714 -2.843 -21.976 1.0 96.85 23 A 1 +ATOM 162 C CZ . PHE A ? 23 ? -3.514 -1.935 -23.029 1.0 97.63 23 A 1 +ATOM 163 N N . ARG A ? 24 ? -5.846 -6.392 -23.818 1.0 97.78 24 A 1 +ATOM 164 C CA . ARG A ? 24 ? -7.058 -6.106 -24.607 1.0 97.18 24 A 1 +ATOM 165 C C . ARG A ? 24 ? -7.536 -7.301 -25.446 1.0 96.61 24 A 1 +ATOM 166 O O . ARG A ? 24 ? -8.025 -7.125 -26.556 1.0 94.53 24 A 1 +ATOM 167 C CB . ARG A ? 24 ? -6.891 -4.826 -25.438 1.0 96.54 24 A 1 +ATOM 168 C CG . ARG A ? 24 ? -6.517 -3.597 -24.591 1.0 93.77 24 A 1 +ATOM 169 C CD . ARG A ? 24 ? -6.507 -2.329 -25.445 1.0 88.64 24 A 1 +ATOM 170 N NE . ARG A ? 24 ? -7.874 -1.950 -25.848 1.0 82.67 24 A 1 +ATOM 171 C CZ . ARG A ? 24 ? -8.220 -1.075 -26.785 1.0 76.48 24 A 1 +ATOM 172 N NH1 . ARG A ? 24 ? -7.333 -0.422 -27.475 1.0 71.58 24 A 1 +ATOM 173 N NH2 . ARG A ? 24 ? -9.480 -0.841 -27.026 1.0 70.82 24 A 1 +ATOM 174 N N . SER A ? 25 ? -7.409 -8.511 -24.906 1.0 97.28 25 A 1 +ATOM 175 C CA . SER A ? 25 ? -7.821 -9.763 -25.540 1.0 96.93 25 A 1 +ATOM 176 C C . SER A ? 25 ? -8.985 -10.412 -24.779 1.0 96.66 25 A 1 +ATOM 177 O O . SER A ? 25 ? -10.022 -9.761 -24.602 1.0 95.37 25 A 1 +ATOM 178 C CB . SER A ? 25 ? -6.589 -10.653 -25.711 1.0 96.6 25 A 1 +ATOM 179 O OG . SER A ? 25 ? -6.888 -11.776 -26.492 1.0 93.86 25 A 1 +ATOM 180 N N . ALA A ? 26 ? -8.846 -11.644 -24.333 1.0 96.89 26 A 1 +ATOM 181 C CA . ALA A ? 26 ? -9.917 -12.415 -23.693 1.0 96.71 26 A 1 +ATOM 182 C C . ALA A ? 26 ? -10.579 -11.689 -22.508 1.0 97.08 26 A 1 +ATOM 183 O O . ALA A ? 26 ? -11.799 -11.724 -22.361 1.0 96.22 26 A 1 +ATOM 184 C CB . ALA A ? 26 ? -9.337 -13.755 -23.243 1.0 95.79 26 A 1 +ATOM 185 N N . PHE A ? 27 ? -9.790 -10.980 -21.694 1.0 97.75 27 A 1 +ATOM 186 C CA . PHE A ? 27 ? -10.269 -10.266 -20.508 1.0 97.91 27 A 1 +ATOM 187 C C . PHE A ? 27 ? -10.394 -8.747 -20.699 1.0 97.58 27 A 1 +ATOM 188 O O . PHE A ? 27 ? -10.513 -8.017 -19.721 1.0 96.8 27 A 1 +ATOM 189 C CB . PHE A ? 27 ? -9.412 -10.648 -19.293 1.0 98.07 27 A 1 +ATOM 190 C CG . PHE A ? 27 ? -9.346 -12.131 -18.959 1.0 98.37 27 A 1 +ATOM 191 C CD1 . PHE A ? 27 ? -10.434 -12.991 -19.206 1.0 97.94 27 A 1 +ATOM 192 C CD2 . PHE A ? 27 ? -8.186 -12.654 -18.356 1.0 97.92 27 A 1 +ATOM 193 C CE1 . PHE A ? 27 ? -10.359 -14.357 -18.883 1.0 97.68 27 A 1 +ATOM 194 C CE2 . PHE A ? 27 ? -8.107 -14.017 -18.023 1.0 97.63 27 A 1 +ATOM 195 C CZ . PHE A ? 27 ? -9.190 -14.869 -18.296 1.0 98.09 27 A 1 +ATOM 196 N N . ASN A ? 28 ? -10.424 -8.259 -21.934 1.0 97.16 28 A 1 +ATOM 197 C CA . ASN A ? 28 ? -10.458 -6.826 -22.263 1.0 95.98 28 A 1 +ATOM 198 C C . ASN A ? 28 ? -11.528 -6.015 -21.508 1.0 95.4 28 A 1 +ATOM 199 O O . ASN A ? 28 ? -11.303 -4.860 -21.156 1.0 91.89 28 A 1 +ATOM 200 C CB . ASN A ? 28 ? -10.696 -6.714 -23.774 1.0 93.77 28 A 1 +ATOM 201 C CG . ASN A ? 28 ? -10.687 -5.277 -24.272 1.0 89.87 28 A 1 +ATOM 202 O OD1 . ASN A ? 28 ? -9.850 -4.473 -23.924 1.0 81.94 28 A 1 +ATOM 203 N ND2 . ASN A ? 28 ? -11.608 -4.926 -25.138 1.0 80.22 28 A 1 +ATOM 204 N N . ASN A ? 29 ? -12.691 -6.625 -21.269 1.0 95.51 29 A 1 +ATOM 205 C CA . ASN A ? 29 ? -13.827 -5.991 -20.595 1.0 94.56 29 A 1 +ATOM 206 C C . ASN A ? 29 ? -14.145 -6.632 -19.237 1.0 95.74 29 A 1 +ATOM 207 O O . ASN A ? 29 ? -15.229 -6.419 -18.697 1.0 93.91 29 A 1 +ATOM 208 C CB . ASN A ? 29 ? -15.035 -6.008 -21.544 1.0 91.02 29 A 1 +ATOM 209 C CG . ASN A ? 29 ? -14.816 -5.188 -22.803 1.0 81.29 29 A 1 +ATOM 210 O OD1 . ASN A ? 29 ? -14.165 -4.164 -22.822 1.0 69.55 29 A 1 +ATOM 211 N ND2 . ASN A ? 29 ? -15.382 -5.617 -23.906 1.0 70.91 29 A 1 +ATOM 212 N N . VAL A ? 30 ? -13.238 -7.430 -18.687 1.0 97.0 30 A 1 +ATOM 213 C CA . VAL A ? 30 ? -13.427 -8.093 -17.391 1.0 97.81 30 A 1 +ATOM 214 C C . VAL A ? 30 ? -12.797 -7.232 -16.298 1.0 98.22 30 A 1 +ATOM 215 O O . VAL A ? 30 ? -11.571 -7.132 -16.241 1.0 98.19 30 A 1 +ATOM 216 C CB . VAL A ? 30 ? -12.856 -9.522 -17.387 1.0 97.84 30 A 1 +ATOM 217 C CG1 . VAL A ? 30 ? -13.192 -10.226 -16.068 1.0 97.39 30 A 1 +ATOM 218 C CG2 . VAL A ? 30 ? -13.439 -10.360 -18.530 1.0 97.3 30 A 1 +ATOM 219 N N . PRO A ? 31 ? -13.593 -6.620 -15.400 1.0 98.27 31 A 1 +ATOM 220 C CA . PRO A ? 31 ? -13.048 -5.828 -14.303 1.0 98.42 31 A 1 +ATOM 221 C C . PRO A ? 31 ? -12.084 -6.644 -13.439 1.0 98.72 31 A 1 +ATOM 222 O O . PRO A ? 31 ? -12.326 -7.826 -13.174 1.0 98.69 31 A 1 +ATOM 223 C CB . PRO A ? 31 ? -14.257 -5.352 -13.495 1.0 97.81 31 A 1 +ATOM 224 C CG . PRO A ? 31 ? -15.402 -5.385 -14.508 1.0 96.15 31 A 1 +ATOM 225 C CD . PRO A ? 31 ? -15.044 -6.581 -15.385 1.0 97.85 31 A 1 +ATOM 226 N N . VAL A ? 32 ? -11.039 -5.997 -12.913 1.0 98.71 32 A 1 +ATOM 227 C CA . VAL A ? 32 ? -10.061 -6.647 -12.021 1.0 98.86 32 A 1 +ATOM 228 C C . VAL A ? 32 ? -10.731 -7.327 -10.820 1.0 98.9 32 A 1 +ATOM 229 O O . VAL A ? 32 ? -10.321 -8.405 -10.399 1.0 98.85 32 A 1 +ATOM 230 C CB . VAL A ? 32 ? -8.994 -5.631 -11.572 1.0 98.73 32 A 1 +ATOM 231 C CG1 . VAL A ? 32 ? -9.531 -4.531 -10.642 1.0 97.91 32 A 1 +ATOM 232 C CG2 . VAL A ? 32 ? -7.819 -6.337 -10.892 1.0 97.56 32 A 1 +ATOM 233 N N . THR A ? 33 ? -11.829 -6.752 -10.323 1.0 98.81 33 A 1 +ATOM 234 C CA . THR A ? 33 ? -12.617 -7.311 -9.218 1.0 98.83 33 A 1 +ATOM 235 C C . THR A ? 33 ? -13.316 -8.621 -9.585 1.0 98.86 33 A 1 +ATOM 236 O O . THR A ? 33 ? -13.537 -9.453 -8.710 1.0 98.73 33 A 1 +ATOM 237 C CB . THR A ? 33 ? -13.669 -6.303 -8.748 1.0 98.67 33 A 1 +ATOM 238 O OG1 . THR A ? 33 ? -14.465 -5.874 -9.834 1.0 97.16 33 A 1 +ATOM 239 C CG2 . THR A ? 33 ? -13.020 -5.059 -8.137 1.0 96.69 33 A 1 +ATOM 240 N N . VAL A ? 34 ? -13.640 -8.846 -10.857 1.0 98.69 34 A 1 +ATOM 241 C CA . VAL A ? 34 ? -14.190 -10.119 -11.346 1.0 98.59 34 A 1 +ATOM 242 C C . VAL A ? 34 ? -13.087 -11.169 -11.434 1.0 98.73 34 A 1 +ATOM 243 O O . VAL A ? 34 ? -13.275 -12.273 -10.931 1.0 98.67 34 A 1 +ATOM 244 C CB . VAL A ? 34 ? -14.915 -9.950 -12.694 1.0 98.23 34 A 1 +ATOM 245 C CG1 . VAL A ? 34 ? -15.385 -11.291 -13.271 1.0 97.34 34 A 1 +ATOM 246 C CG2 . VAL A ? 34 ? -16.147 -9.049 -12.534 1.0 97.47 34 A 1 +ATOM 247 N N . LEU A ? 35 ? -11.924 -10.821 -11.978 1.0 98.73 35 A 1 +ATOM 248 C CA . LEU A ? 35 ? -10.752 -11.705 -12.017 1.0 98.84 35 A 1 +ATOM 249 C C . LEU A ? 35 ? -10.372 -12.167 -10.599 1.0 98.9 35 A 1 +ATOM 250 O O . LEU A ? 35 ? -10.280 -13.365 -10.335 1.0 98.88 35 A 1 +ATOM 251 C CB . LEU A ? 35 ? -9.572 -10.979 -12.691 1.0 98.8 35 A 1 +ATOM 252 C CG . LEU A ? 35 ? -9.795 -10.560 -14.160 1.0 98.6 35 A 1 +ATOM 253 C CD1 . LEU A ? 35 ? -8.626 -9.702 -14.635 1.0 98.35 35 A 1 +ATOM 254 C CD2 . LEU A ? 35 ? -9.913 -11.773 -15.080 1.0 98.17 35 A 1 +ATOM 255 N N . GLY A ? 36 ? -10.238 -11.219 -9.671 1.0 98.89 36 A 1 +ATOM 256 C CA . GLY A ? 36 ? -9.921 -11.516 -8.275 1.0 98.93 36 A 1 +ATOM 257 C C . GLY A ? 36 ? -10.984 -12.374 -7.583 1.0 98.95 36 A 1 +ATOM 258 O O . GLY A ? 36 ? -10.649 -13.332 -6.890 1.0 98.92 36 A 1 +ATOM 259 N N . ARG A ? 37 ? -12.267 -12.070 -7.795 1.0 98.9 37 A 1 +ATOM 260 C CA . ARG A ? 37 ? -13.403 -12.832 -7.253 1.0 98.86 37 A 1 +ATOM 261 C C . ARG A ? 37 ? -13.366 -14.300 -7.679 1.0 98.9 37 A 1 +ATOM 262 O O . ARG A ? 37 ? -13.526 -15.182 -6.841 1.0 98.78 37 A 1 +ATOM 263 C CB . ARG A ? 37 ? -14.708 -12.169 -7.718 1.0 98.45 37 A 1 +ATOM 264 C CG . ARG A ? 37 ? -15.966 -12.888 -7.214 1.0 97.13 37 A 1 +ATOM 265 C CD . ARG A ? 37 ? -17.219 -12.309 -7.879 1.0 94.95 37 A 1 +ATOM 266 N NE . ARG A ? 37 ? -17.352 -12.779 -9.258 1.0 91.48 37 A 1 +ATOM 267 C CZ . ARG A ? 37 ? -18.050 -12.235 -10.234 1.0 91.76 37 A 1 +ATOM 268 N NH1 . ARG A ? 37 ? -18.738 -11.137 -10.069 1.0 84.25 37 A 1 +ATOM 269 N NH2 . ARG A ? 37 ? -18.066 -12.802 -11.395 1.0 87.38 37 A 1 +ATOM 270 N N . GLU A ? 38 ? -13.166 -14.548 -8.967 1.0 98.81 38 A 1 +ATOM 271 C CA . GLU A ? 38 ? -13.153 -15.915 -9.490 1.0 98.77 38 A 1 +ATOM 272 C C . GLU A ? 38 ? -11.903 -16.681 -9.031 1.0 98.84 38 A 1 +ATOM 273 O O . GLU A ? 38 ? -12.026 -17.823 -8.589 1.0 98.74 38 A 1 +ATOM 274 C CB . GLU A ? 38 ? -13.313 -15.908 -11.015 1.0 98.57 38 A 1 +ATOM 275 C CG . GLU A ? 38 ? -14.681 -15.376 -11.506 1.0 97.67 38 A 1 +ATOM 276 C CD . GLU A ? 38 ? -15.885 -15.998 -10.779 1.0 97.05 38 A 1 +ATOM 277 O OE1 . GLU A ? 38 ? -16.780 -15.230 -10.342 1.0 93.72 38 A 1 +ATOM 278 O OE2 . GLU A ? 38 ? -15.915 -17.227 -10.593 1.0 93.94 38 A 1 +ATOM 279 N N . ALA A ? 39 ? -10.729 -16.038 -9.010 1.0 98.86 39 A 1 +ATOM 280 C CA . ALA A ? 39 ? -9.522 -16.647 -8.448 1.0 98.92 39 A 1 +ATOM 281 C C . ALA A ? 39 ? -9.698 -17.011 -6.964 1.0 98.94 39 A 1 +ATOM 282 O O . ALA A ? 39 ? -9.311 -18.103 -6.546 1.0 98.92 39 A 1 +ATOM 283 C CB . ALA A ? 39 ? -8.340 -15.696 -8.651 1.0 98.91 39 A 1 +ATOM 284 N N . LEU A ? 40 ? -10.341 -16.146 -6.169 1.0 98.94 40 A 1 +ATOM 285 C CA . LEU A ? 40 ? -10.608 -16.415 -4.755 1.0 98.95 40 A 1 +ATOM 286 C C . LEU A ? 40 ? -11.602 -17.565 -4.571 1.0 98.94 40 A 1 +ATOM 287 O O . LEU A ? 40 ? -11.350 -18.459 -3.760 1.0 98.91 40 A 1 +ATOM 288 C CB . LEU A ? 40 ? -11.070 -15.124 -4.058 1.0 98.95 40 A 1 +ATOM 289 C CG . LEU A ? 40 ? -11.358 -15.307 -2.553 1.0 98.82 40 A 1 +ATOM 290 C CD1 . LEU A ? 40 ? -10.176 -15.892 -1.780 1.0 98.54 40 A 1 +ATOM 291 C CD2 . LEU A ? 40 ? -11.700 -13.960 -1.921 1.0 98.54 40 A 1 +ATOM 292 N N . LYS A ? 41 ? -12.692 -17.605 -5.335 1.0 98.91 41 A 1 +ATOM 293 C CA . LYS A ? 41 ? -13.613 -18.754 -5.335 1.0 98.87 41 A 1 +ATOM 294 C C . LYS A ? 41 ? -12.884 -20.055 -5.678 1.0 98.87 41 A 1 +ATOM 295 O O . LYS A ? 41 ? -13.098 -21.069 -5.017 1.0 98.73 41 A 1 +ATOM 296 C CB . LYS A ? 41 ? -14.739 -18.534 -6.349 1.0 98.75 41 A 1 +ATOM 297 C CG . LYS A ? 41 ? -15.804 -17.521 -5.891 1.0 97.57 41 A 1 +ATOM 298 C CD . LYS A ? 41 ? -16.786 -17.360 -7.051 1.0 95.86 41 A 1 +ATOM 299 C CE . LYS A ? 41 ? -17.923 -16.393 -6.751 1.0 89.67 41 A 1 +ATOM 300 N NZ . LYS A ? 41 ? -18.682 -16.159 -8.002 1.0 84.04 41 A 1 +ATOM 301 N N . GLY A ? 42 ? -12.006 -20.010 -6.679 1.0 98.84 42 A 1 +ATOM 302 C CA . GLY A ? 42 ? -11.186 -21.148 -7.076 1.0 98.82 42 A 1 +ATOM 303 C C . GLY A ? 42 ? -10.256 -21.622 -5.960 1.0 98.87 42 A 1 +ATOM 304 O O . GLY A ? 42 ? -10.232 -22.814 -5.656 1.0 98.74 42 A 1 +ATOM 305 N N . ALA A ? 43 ? -9.558 -20.709 -5.293 1.0 98.86 43 A 1 +ATOM 306 C CA . ALA A ? 43 ? -8.666 -21.035 -4.179 1.0 98.9 43 A 1 +ATOM 307 C C . ALA A ? 43 ? -9.425 -21.622 -2.974 1.0 98.89 43 A 1 +ATOM 308 O O . ALA A ? 43 ? -8.992 -22.618 -2.394 1.0 98.8 43 A 1 +ATOM 309 C CB . ALA A ? 43 ? -7.879 -19.778 -3.798 1.0 98.9 43 A 1 +ATOM 310 N N . LEU A ? 44 ? -10.590 -21.058 -2.630 1.0 98.9 44 A 1 +ATOM 311 C CA . LEU A ? 44 ? -11.457 -21.577 -1.565 1.0 98.88 44 A 1 +ATOM 312 C C . LEU A ? 44 ? -11.984 -22.979 -1.897 1.0 98.77 44 A 1 +ATOM 313 O O . LEU A ? 44 ? -11.972 -23.861 -1.038 1.0 98.56 44 A 1 +ATOM 314 C CB . LEU A ? 44 ? -12.622 -20.598 -1.335 1.0 98.89 44 A 1 +ATOM 315 C CG . LEU A ? 44 ? -12.215 -19.274 -0.658 1.0 98.79 44 A 1 +ATOM 316 C CD1 . LEU A ? 44 ? -13.380 -18.287 -0.723 1.0 98.61 44 A 1 +ATOM 317 C CD2 . LEU A ? 44 ? -11.841 -19.472 0.813 1.0 98.57 44 A 1 +ATOM 318 N N . LYS A ? 45 ? -12.377 -23.213 -3.151 1.0 98.77 45 A 1 +ATOM 319 C CA . LYS A ? 45 ? -12.808 -24.532 -3.629 1.0 98.63 45 A 1 +ATOM 320 C C . LYS A ? 45 ? -11.658 -25.544 -3.606 1.0 98.61 45 A 1 +ATOM 321 O O . LYS A ? 45 ? -11.864 -26.676 -3.180 1.0 98.14 45 A 1 +ATOM 322 C CB . LYS A ? 45 ? -13.418 -24.373 -5.030 1.0 98.26 45 A 1 +ATOM 323 C CG . LYS A ? 45 ? -14.131 -25.649 -5.510 1.0 88.72 45 A 1 +ATOM 324 C CD . LYS A ? 45 ? -14.738 -25.418 -6.899 1.0 83.28 45 A 1 +ATOM 325 C CE . LYS A ? 45 ? -15.494 -26.665 -7.382 1.0 70.78 45 A 1 +ATOM 326 N NZ . LYS A ? 45 ? -16.028 -26.478 -8.755 1.0 62.28 45 A 1 +ATOM 327 N N . ASN A ? 46 ? -10.450 -25.130 -4.007 1.0 98.48 46 A 1 +ATOM 328 C CA . ASN A ? 46 ? -9.240 -25.959 -3.943 1.0 98.36 46 A 1 +ATOM 329 C C . ASN A ? 46 ? -8.885 -26.348 -2.501 1.0 98.38 46 A 1 +ATOM 330 O O . ASN A ? 46 ? -8.496 -27.487 -2.252 1.0 98.01 46 A 1 +ATOM 331 C CB . ASN A ? 46 ? -8.088 -25.195 -4.621 1.0 98.08 46 A 1 +ATOM 332 C CG . ASN A ? 46 ? -6.795 -25.997 -4.643 1.0 97.42 46 A 1 +ATOM 333 O OD1 . ASN A ? 46 ? -5.865 -25.759 -3.892 1.0 91.21 46 A 1 +ATOM 334 N ND2 . ASN A ? 46 ? -6.711 -26.985 -5.504 1.0 89.91 46 A 1 +ATOM 335 N N . ALA A ? 47 ? -9.090 -25.435 -1.555 1.0 98.59 47 A 1 +ATOM 336 C CA . ALA A ? 47 ? -8.862 -25.663 -0.132 1.0 98.6 47 A 1 +ATOM 337 C C . ALA A ? 47 ? -9.972 -26.470 0.567 1.0 98.51 47 A 1 +ATOM 338 O O . ALA A ? 47 ? -9.782 -26.887 1.708 1.0 97.83 47 A 1 +ATOM 339 C CB . ALA A ? 47 ? -8.703 -24.292 0.535 1.0 98.52 47 A 1 +ATOM 340 N N . ASN A ? 48 ? -11.137 -26.664 -0.065 1.0 98.38 48 A 1 +ATOM 341 C CA . ASN A ? 48 ? -12.362 -27.133 0.600 1.0 98.19 48 A 1 +ATOM 342 C C . ASN A ? 48 ? -12.791 -26.246 1.789 1.0 98.42 48 A 1 +ATOM 343 O O . ASN A ? 48 ? -13.362 -26.729 2.766 1.0 97.45 48 A 1 +ATOM 344 C CB . ASN A ? 48 ? -12.259 -28.637 0.924 1.0 97.16 48 A 1 +ATOM 345 C CG . ASN A ? 48 ? -12.991 -29.535 -0.047 1.0 87.7 48 A 1 +ATOM 346 O OD1 . ASN A ? 48 ? -13.913 -29.155 -0.742 1.0 78.97 48 A 1 +ATOM 347 N ND2 . ASN A ? 48 ? -12.620 -30.797 -0.089 1.0 75.1 48 A 1 +ATOM 348 N N . VAL A ? 49 ? -12.524 -24.947 1.712 1.0 98.56 49 A 1 +ATOM 349 C CA . VAL A ? 49 ? -12.887 -23.958 2.734 1.0 98.72 49 A 1 +ATOM 350 C C . VAL A ? 49 ? -14.160 -23.227 2.320 1.0 98.78 49 A 1 +ATOM 351 O O . VAL A ? 49 ? -14.252 -22.668 1.229 1.0 98.65 49 A 1 +ATOM 352 C CB . VAL A ? 49 ? -11.718 -22.990 2.999 1.0 98.63 49 A 1 +ATOM 353 C CG1 . VAL A ? 49 ? -12.101 -21.808 3.899 1.0 98.09 49 A 1 +ATOM 354 C CG2 . VAL A ? 49 ? -10.574 -23.730 3.703 1.0 97.92 49 A 1 +ATOM 355 N N . LYS A ? 50 ? -15.153 -23.196 3.218 1.0 98.64 50 A 1 +ATOM 356 C CA . LYS A ? 50 ? -16.340 -22.361 3.002 1.0 98.61 50 A 1 +ATOM 357 C C . LYS A ? 50 ? -15.951 -20.882 3.072 1.0 98.78 50 A 1 +ATOM 358 O O . LYS A ? 50 ? -15.257 -20.502 4.017 1.0 98.59 50 A 1 +ATOM 359 C CB . LYS A ? 50 ? -17.432 -22.666 4.035 1.0 97.95 50 A 1 +ATOM 360 C CG . LYS A ? 50 ? -18.131 -24.005 3.761 1.0 85.26 50 A 1 +ATOM 361 C CD . LYS A ? 50 ? -19.288 -24.196 4.751 1.0 79.73 50 A 1 +ATOM 362 C CE . LYS A ? 50 ? -20.031 -25.500 4.454 1.0 68.41 50 A 1 +ATOM 363 N NZ . LYS A ? 50 ? -21.169 -25.699 5.387 1.0 58.69 50 A 1 +ATOM 364 N N . PRO A ? 51 ? -16.458 -20.036 2.169 1.0 98.74 51 A 1 +ATOM 365 C CA . PRO A ? 51 ? -16.147 -18.598 2.177 1.0 98.75 51 A 1 +ATOM 366 C C . PRO A ? 51 ? -16.410 -17.908 3.523 1.0 98.78 51 A 1 +ATOM 367 O O . PRO A ? 51 ? -15.657 -17.030 3.929 1.0 98.62 51 A 1 +ATOM 368 C CB . PRO A ? 51 ? -17.014 -18.000 1.067 1.0 98.59 51 A 1 +ATOM 369 C CG . PRO A ? 51 ? -17.198 -19.156 0.086 1.0 97.47 51 A 1 +ATOM 370 C CD . PRO A ? 51 ? -17.260 -20.375 1.006 1.0 98.62 51 A 1 +ATOM 371 N N . SER A ? 52 ? -17.426 -18.362 4.260 1.0 98.73 52 A 1 +ATOM 372 C CA . SER A ? 52 ? -17.789 -17.827 5.580 1.0 98.58 52 A 1 +ATOM 373 C C . SER A ? 52 ? -16.761 -18.081 6.692 1.0 98.63 52 A 1 +ATOM 374 O O . SER A ? 52 ? -16.898 -17.515 7.771 1.0 98.0 52 A 1 +ATOM 375 C CB . SER A ? 52 ? -19.138 -18.409 6.007 1.0 97.98 52 A 1 +ATOM 376 O OG . SER A ? 52 ? -19.085 -19.827 6.052 1.0 93.53 52 A 1 +ATOM 377 N N . LEU A ? 53 ? -15.755 -18.930 6.477 1.0 98.72 53 A 1 +ATOM 378 C CA . LEU A ? 53 ? -14.663 -19.147 7.435 1.0 98.68 53 A 1 +ATOM 379 C C . LEU A ? 53 ? -13.556 -18.093 7.324 1.0 98.76 53 A 1 +ATOM 380 O O . LEU A ? 53 ? -12.754 -17.955 8.246 1.0 98.42 53 A 1 +ATOM 381 C CB . LEU A ? 53 ? -14.070 -20.556 7.249 1.0 98.28 53 A 1 +ATOM 382 C CG . LEU A ? 53 ? -15.012 -21.712 7.621 1.0 93.69 53 A 1 +ATOM 383 C CD1 . LEU A ? 53 ? -14.314 -23.042 7.337 1.0 88.91 53 A 1 +ATOM 384 C CD2 . LEU A ? 53 ? -15.401 -21.692 9.104 1.0 88.99 53 A 1 +ATOM 385 N N . VAL A ? 54 ? -13.499 -17.367 6.218 1.0 98.81 54 A 1 +ATOM 386 C CA . VAL A ? 54 ? -12.490 -16.325 5.994 1.0 98.87 54 A 1 +ATOM 387 C C . VAL A ? 54 ? -12.742 -15.164 6.952 1.0 98.86 54 A 1 +ATOM 388 O O . VAL A ? 54 ? -13.849 -14.638 7.024 1.0 98.76 54 A 1 +ATOM 389 C CB . VAL A ? 54 ? -12.488 -15.850 4.531 1.0 98.84 54 A 1 +ATOM 390 C CG1 . VAL A ? 54 ? -11.417 -14.782 4.290 1.0 98.55 54 A 1 +ATOM 391 C CG2 . VAL A ? 54 ? -12.214 -17.014 3.570 1.0 98.47 54 A 1 +ATOM 392 N N . GLN A ? 55 ? -11.703 -14.746 7.667 1.0 98.86 55 A 1 +ATOM 393 C CA . GLN A ? 55 ? -11.767 -13.673 8.670 1.0 98.81 55 A 1 +ATOM 394 C C . GLN A ? 55 ? -11.098 -12.379 8.199 1.0 98.82 55 A 1 +ATOM 395 O O . GLN A ? 55 ? -11.554 -11.287 8.526 1.0 98.58 55 A 1 +ATOM 396 C CB . GLN A ? 55 ? -11.110 -14.180 9.957 1.0 98.64 55 A 1 +ATOM 397 C CG . GLN A ? 55 ? -11.878 -15.336 10.611 1.0 98.27 55 A 1 +ATOM 398 C CD . GLN A ? 55 ? -11.076 -16.000 11.728 1.0 97.88 55 A 1 +ATOM 399 O OE1 . GLN A ? 55 ? -9.874 -16.184 11.640 1.0 93.54 55 A 1 +ATOM 400 N NE2 . GLN A ? 55 ? -11.711 -16.404 12.801 1.0 92.7 55 A 1 +ATOM 401 N N . GLU A ? 56 ? -10.019 -12.508 7.426 1.0 98.83 56 A 1 +ATOM 402 C CA . GLU A ? 56 ? -9.272 -11.363 6.891 1.0 98.86 56 A 1 +ATOM 403 C C . GLU A ? 56 ? -8.690 -11.684 5.508 1.0 98.91 56 A 1 +ATOM 404 O O . GLU A ? 56 ? -8.440 -12.846 5.165 1.0 98.87 56 A 1 +ATOM 405 C CB . GLU A ? 56 ? -8.209 -10.918 7.916 1.0 98.74 56 A 1 +ATOM 406 C CG . GLU A ? 56 ? -7.542 -9.580 7.561 1.0 98.37 56 A 1 +ATOM 407 C CD . GLU A ? 56 ? -6.881 -8.842 8.737 1.0 98.56 56 A 1 +ATOM 408 O OE1 . GLU A ? 56 ? -6.357 -7.723 8.494 1.0 97.24 56 A 1 +ATOM 409 O OE2 . GLU A ? 56 ? -6.923 -9.328 9.884 1.0 97.46 56 A 1 +ATOM 410 N N . ALA A ? 57 ? -8.494 -10.654 4.694 1.0 98.93 57 A 1 +ATOM 411 C CA . ALA A ? 57 ? -7.925 -10.757 3.359 1.0 98.94 57 A 1 +ATOM 412 C C . ALA A ? 57 ? -6.934 -9.625 3.073 1.0 98.94 57 A 1 +ATOM 413 O O . ALA A ? 57 ? -7.201 -8.460 3.368 1.0 98.85 57 A 1 +ATOM 414 C CB . ALA A ? 57 ? -9.058 -10.759 2.329 1.0 98.89 57 A 1 +ATOM 415 N N . PHE A ? 58 ? -5.825 -9.967 2.424 1.0 98.97 58 A 1 +ATOM 416 C CA . PHE A ? 58 ? -4.888 -9.010 1.832 1.0 98.96 58 A 1 +ATOM 417 C C . PHE A ? 58 ? -4.764 -9.299 0.337 1.0 98.96 58 A 1 +ATOM 418 O O . PHE A ? 58 ? -4.436 -10.421 -0.052 1.0 98.89 58 A 1 +ATOM 419 C CB . PHE A ? 58 ? -3.522 -9.099 2.514 1.0 98.92 58 A 1 +ATOM 420 C CG . PHE A ? 58 ? -3.514 -8.645 3.957 1.0 98.88 58 A 1 +ATOM 421 C CD1 . PHE A ? 58 ? -3.276 -7.295 4.272 1.0 98.39 58 A 1 +ATOM 422 C CD2 . PHE A ? 58 ? -3.754 -9.568 4.993 1.0 98.41 58 A 1 +ATOM 423 C CE1 . PHE A ? 58 ? -3.274 -6.866 5.606 1.0 98.12 58 A 1 +ATOM 424 C CE2 . PHE A ? 58 ? -3.760 -9.145 6.332 1.0 98.04 58 A 1 +ATOM 425 C CZ . PHE A ? 58 ? -3.519 -7.794 6.640 1.0 98.26 58 A 1 +ATOM 426 N N . ILE A ? 59 ? -5.004 -8.305 -0.510 1.0 98.95 59 A 1 +ATOM 427 C CA . ILE A ? 59 ? -4.950 -8.476 -1.967 1.0 98.95 59 A 1 +ATOM 428 C C . ILE A ? 59 ? -4.080 -7.384 -2.585 1.0 98.93 59 A 1 +ATOM 429 O O . ILE A ? 59 ? -4.329 -6.194 -2.406 1.0 98.83 59 A 1 +ATOM 430 C CB . ILE A ? 59 ? -6.363 -8.537 -2.591 1.0 98.94 59 A 1 +ATOM 431 C CG1 . ILE A ? 59 ? -7.199 -9.669 -1.940 1.0 98.76 59 A 1 +ATOM 432 C CG2 . ILE A ? 59 ? -6.257 -8.742 -4.113 1.0 98.83 59 A 1 +ATOM 433 C CD1 . ILE A ? 59 ? -8.621 -9.820 -2.487 1.0 98.27 59 A 1 +ATOM 434 N N . GLY A ? 60 ? -3.059 -7.794 -3.328 1.0 98.94 60 A 1 +ATOM 435 C CA . GLY A ? 60 ? -2.204 -6.900 -4.088 1.0 98.94 60 A 1 +ATOM 436 C C . GLY A ? 60 ? -2.877 -6.417 -5.371 1.0 98.95 60 A 1 +ATOM 437 O O . GLY A ? 60 ? -3.406 -7.216 -6.132 1.0 98.88 60 A 1 +ATOM 438 N N . VAL A ? 61 ? -2.816 -5.110 -5.622 1.0 98.92 61 A 1 +ATOM 439 C CA . VAL A ? 61 ? -3.213 -4.498 -6.897 1.0 98.92 61 A 1 +ATOM 440 C C . VAL A ? 61 ? -2.414 -3.209 -7.081 1.0 98.89 61 A 1 +ATOM 441 O O . VAL A ? 61 ? -2.213 -2.469 -6.113 1.0 98.67 61 A 1 +ATOM 442 C CB . VAL A ? 61 ? -4.742 -4.281 -6.973 1.0 98.78 61 A 1 +ATOM 443 C CG1 . VAL A ? 61 ? -5.297 -3.359 -5.877 1.0 97.83 61 A 1 +ATOM 444 C CG2 . VAL A ? 61 ? -5.182 -3.751 -8.343 1.0 97.1 61 A 1 +ATOM 445 N N . VAL A ? 62 ? -1.908 -2.955 -8.279 1.0 98.83 62 A 1 +ATOM 446 C CA . VAL A ? 62 ? -0.976 -1.838 -8.528 1.0 98.77 62 A 1 +ATOM 447 C C . VAL A ? 62 ? -1.688 -0.610 -9.079 1.0 98.68 62 A 1 +ATOM 448 O O . VAL A ? 62 ? -1.473 0.496 -8.579 1.0 98.3 62 A 1 +ATOM 449 C CB . VAL A ? 62 ? 0.181 -2.267 -9.449 1.0 98.69 62 A 1 +ATOM 450 C CG1 . VAL A ? 62 ? 1.227 -1.157 -9.579 1.0 98.18 62 A 1 +ATOM 451 C CG2 . VAL A ? 62 ? 0.886 -3.520 -8.918 1.0 98.31 62 A 1 +ATOM 452 N N . VAL A ? 63 ? -2.544 -0.796 -10.079 1.0 98.71 63 A 1 +ATOM 453 C CA . VAL A ? 63 ? -3.266 0.289 -10.760 1.0 98.66 63 A 1 +ATOM 454 C C . VAL A ? 63 ? -4.778 0.032 -10.703 1.0 98.56 63 A 1 +ATOM 455 O O . VAL A ? 63 ? -5.395 -0.316 -11.708 1.0 98.19 63 A 1 +ATOM 456 C CB . VAL A ? 63 ? -2.753 0.512 -12.200 1.0 98.54 63 A 1 +ATOM 457 C CG1 . VAL A ? 63 ? -3.231 1.875 -12.710 1.0 97.53 63 A 1 +ATOM 458 C CG2 . VAL A ? 63 ? -1.218 0.502 -12.289 1.0 97.67 63 A 1 +ATOM 459 N N . PRO A ? 64 ? -5.412 0.186 -9.527 1.0 98.62 64 A 1 +ATOM 460 C CA . PRO A ? 64 ? -6.839 -0.090 -9.360 1.0 98.35 64 A 1 +ATOM 461 C C . PRO A ? 64 ? -7.755 1.024 -9.890 1.0 98.38 64 A 1 +ATOM 462 O O . PRO A ? 64 ? -8.949 1.017 -9.605 1.0 97.59 64 A 1 +ATOM 463 C CB . PRO A ? 64 ? -7.006 -0.313 -7.853 1.0 97.52 64 A 1 +ATOM 464 C CG . PRO A ? 64 ? -5.995 0.669 -7.261 1.0 96.88 64 A 1 +ATOM 465 C CD . PRO A ? 64 ? -4.827 0.582 -8.246 1.0 97.88 64 A 1 +ATOM 466 N N . SER A ? 65 ? -7.224 1.982 -10.633 1.0 98.4 65 A 1 +ATOM 467 C CA . SER A ? 65 ? -7.975 3.120 -11.173 1.0 98.46 65 A 1 +ATOM 468 C C . SER A ? 65 ? -9.217 2.662 -11.941 1.0 98.45 65 A 1 +ATOM 469 O O . SER A ? 65 ? -9.129 1.812 -12.825 1.0 98.27 65 A 1 +ATOM 470 C CB . SER A ? 65 ? -7.083 3.957 -12.095 1.0 98.31 65 A 1 +ATOM 471 O OG . SER A ? 65 ? -5.865 4.279 -11.456 1.0 95.43 65 A 1 +ATOM 472 N N . ASN A ? 66 ? -10.370 3.228 -11.600 1.0 97.94 66 A 1 +ATOM 473 C CA . ASN A ? 66 ? -11.691 2.870 -12.130 1.0 97.94 66 A 1 +ATOM 474 C C . ASN A ? 66 ? -12.191 1.461 -11.739 1.0 98.07 66 A 1 +ATOM 475 O O . ASN A ? 66 ? -13.207 1.000 -12.264 1.0 97.63 66 A 1 +ATOM 476 C CB . ASN A ? 66 ? -11.722 3.164 -13.643 1.0 97.55 66 A 1 +ATOM 477 C CG . ASN A ? 66 ? -13.115 3.202 -14.234 1.0 97.17 66 A 1 +ATOM 478 O OD1 . ASN A ? 66 ? -14.074 3.658 -13.630 1.0 92.99 66 A 1 +ATOM 479 N ND2 . ASN A ? 66 ? -13.261 2.766 -15.465 1.0 92.6 66 A 1 +ATOM 480 N N . ALA A ? 67 ? -11.544 0.781 -10.792 1.0 98.54 67 A 1 +ATOM 481 C CA . ALA A ? 67 ? -12.045 -0.484 -10.250 1.0 98.53 67 A 1 +ATOM 482 C C . ALA A ? 67 ? -13.212 -0.307 -9.258 1.0 98.53 67 A 1 +ATOM 483 O O . ALA A ? 67 ? -13.878 -1.285 -8.912 1.0 97.92 67 A 1 +ATOM 484 C CB . ALA A ? 67 ? -10.877 -1.249 -9.619 1.0 98.36 67 A 1 +ATOM 485 N N . GLY A ? 68 ? -13.489 0.920 -8.828 1.0 98.35 68 A 1 +ATOM 486 C CA . GLY A ? 68 ? -14.488 1.238 -7.812 1.0 98.42 68 A 1 +ATOM 487 C C . GLY A ? 68 ? -13.939 1.164 -6.384 1.0 98.51 68 A 1 +ATOM 488 O O . GLY A ? 68 ? -12.820 0.714 -6.142 1.0 97.99 68 A 1 +ATOM 489 N N . GLN A ? 69 ? -14.748 1.610 -5.415 1.0 98.36 69 A 1 +ATOM 490 C CA . GLN A ? 69 ? -14.342 1.695 -4.013 1.0 98.27 69 A 1 +ATOM 491 C C . GLN A ? 69 ? -13.902 0.339 -3.448 1.0 98.32 69 A 1 +ATOM 492 O O . GLN A ? 69 ? -14.643 -0.644 -3.477 1.0 97.88 69 A 1 +ATOM 493 C CB . GLN A ? 69 ? -15.488 2.286 -3.182 1.0 97.79 69 A 1 +ATOM 494 C CG . GLN A ? 69 ? -15.065 2.551 -1.734 1.0 96.11 69 A 1 +ATOM 495 C CD . GLN A ? 69 ? -16.234 2.987 -0.865 1.0 95.72 69 A 1 +ATOM 496 O OE1 . GLN A ? 69 ? -17.050 2.184 -0.456 1.0 88.64 69 A 1 +ATOM 497 N NE2 . GLN A ? 69 ? -16.350 4.257 -0.554 1.0 87.45 69 A 1 +ATOM 498 N N . GLY A ? 70 ? -12.709 0.310 -2.866 1.0 98.07 70 A 1 +ATOM 499 C CA . GLY A ? 70 ? -12.187 -0.867 -2.181 1.0 98.17 70 A 1 +ATOM 500 C C . GLY A ? 70 ? -12.210 -2.140 -3.036 1.0 98.49 70 A 1 +ATOM 501 O O . GLY A ? 70 ? -12.929 -3.078 -2.696 1.0 97.94 70 A 1 +ATOM 502 N N . PRO A ? 71 ? -11.437 -2.227 -4.123 1.0 98.57 71 A 1 +ATOM 503 C CA . PRO A ? 71 ? -11.506 -3.356 -5.060 1.0 98.53 71 A 1 +ATOM 504 C C . PRO A ? 71 ? -11.269 -4.715 -4.390 1.0 98.69 71 A 1 +ATOM 505 O O . PRO A ? 71 ? -11.947 -5.684 -4.713 1.0 98.47 71 A 1 +ATOM 506 C CB . PRO A ? 71 ? -10.461 -3.046 -6.139 1.0 97.93 71 A 1 +ATOM 507 C CG . PRO A ? 71 ? -9.508 -2.060 -5.463 1.0 96.14 71 A 1 +ATOM 508 C CD . PRO A ? 71 ? -10.426 -1.272 -4.543 1.0 98.06 71 A 1 +ATOM 509 N N . ALA A ? 72 ? -10.380 -4.787 -3.404 1.0 98.65 72 A 1 +ATOM 510 C CA . ALA A ? 72 ? -10.162 -6.009 -2.629 1.0 98.76 72 A 1 +ATOM 511 C C . ALA A ? 72 ? -11.415 -6.427 -1.836 1.0 98.83 72 A 1 +ATOM 512 O O . ALA A ? 72 ? -11.742 -7.610 -1.772 1.0 98.77 72 A 1 +ATOM 513 C CB . ALA A ? 72 ? -8.960 -5.786 -1.708 1.0 98.71 72 A 1 +ATOM 514 N N . ARG A ? 73 ? -12.158 -5.469 -1.276 1.0 98.45 73 A 1 +ATOM 515 C CA . ARG A ? 73 ? -13.424 -5.732 -0.562 1.0 98.5 73 A 1 +ATOM 516 C C . ARG A ? 73 ? -14.486 -6.293 -1.510 1.0 98.61 73 A 1 +ATOM 517 O O . ARG A ? 73 ? -15.165 -7.246 -1.146 1.0 98.5 73 A 1 +ATOM 518 C CB . ARG A ? 73 ? -13.877 -4.437 0.142 1.0 98.27 73 A 1 +ATOM 519 C CG . ARG A ? 73 ? -15.181 -4.573 0.951 1.0 97.09 73 A 1 +ATOM 520 C CD . ARG A ? 73 ? -15.048 -5.475 2.186 1.0 96.07 73 A 1 +ATOM 521 N NE . ARG A ? 73 ? -16.264 -5.376 3.013 1.0 97.0 73 A 1 +ATOM 522 C CZ . ARG A ? 73 ? -16.591 -6.103 4.066 1.0 97.56 73 A 1 +ATOM 523 N NH1 . ARG A ? 73 ? -15.830 -7.036 4.538 1.0 94.31 73 A 1 +ATOM 524 N NH2 . ARG A ? 73 ? -17.722 -5.894 4.667 1.0 95.13 73 A 1 +ATOM 525 N N . GLN A ? 74 ? -14.589 -5.758 -2.725 1.0 98.46 74 A 1 +ATOM 526 C CA . GLN A ? 74 ? -15.492 -6.272 -3.763 1.0 98.34 74 A 1 +ATOM 527 C C . GLN A ? 74 ? -15.185 -7.736 -4.106 1.0 98.59 74 A 1 +ATOM 528 O O . GLN A ? 74 ? -16.101 -8.548 -4.208 1.0 98.59 74 A 1 +ATOM 529 C CB . GLN A ? 74 ? -15.385 -5.430 -5.042 1.0 98.29 74 A 1 +ATOM 530 C CG . GLN A ? 74 ? -15.744 -3.949 -4.870 1.0 97.78 74 A 1 +ATOM 531 C CD . GLN A ? 74 ? -15.655 -3.209 -6.203 1.0 98.09 74 A 1 +ATOM 532 O OE1 . GLN A ? 74 ? -16.137 -3.677 -7.225 1.0 93.38 74 A 1 +ATOM 533 N NE2 . GLN A ? 74 ? -15.026 -2.056 -6.250 1.0 93.59 74 A 1 +ATOM 534 N N . VAL A ? 75 ? -13.906 -8.087 -4.244 1.0 98.77 75 A 1 +ATOM 535 C CA . VAL A ? 75 ? -13.453 -9.461 -4.510 1.0 98.81 75 A 1 +ATOM 536 C C . VAL A ? 75 ? -13.903 -10.410 -3.405 1.0 98.82 75 A 1 +ATOM 537 O O . VAL A ? 75 ? -14.498 -11.451 -3.684 1.0 98.76 75 A 1 +ATOM 538 C CB . VAL A ? 75 ? -11.918 -9.491 -4.660 1.0 98.76 75 A 1 +ATOM 539 C CG1 . VAL A ? 75 ? -11.325 -10.903 -4.603 1.0 98.36 75 A 1 +ATOM 540 C CG2 . VAL A ? 75 ? -11.506 -8.854 -5.993 1.0 98.17 75 A 1 +ATOM 541 N N . VAL A ? 76 ? -13.647 -10.048 -2.154 1.0 98.83 76 A 1 +ATOM 542 C CA . VAL A ? 76 ? -13.899 -10.894 -0.982 1.0 98.79 76 A 1 +ATOM 543 C C . VAL A ? 76 ? -15.398 -11.109 -0.754 1.0 98.75 76 A 1 +ATOM 544 O O . VAL A ? 76 ? -15.835 -12.246 -0.588 1.0 98.62 76 A 1 +ATOM 545 C CB . VAL A ? 76 ? -13.189 -10.286 0.244 1.0 98.69 76 A 1 +ATOM 546 C CG1 . VAL A ? 76 ? -13.576 -10.959 1.558 1.0 98.03 76 A 1 +ATOM 547 C CG2 . VAL A ? 76 ? -11.671 -10.436 0.074 1.0 98.1 76 A 1 +ATOM 548 N N . LEU A ? 77 ? -16.205 -10.046 -0.809 1.0 98.75 77 A 1 +ATOM 549 C CA . LEU A ? 77 ? -17.663 -10.174 -0.702 1.0 98.67 77 A 1 +ATOM 550 C C . LEU A ? 77 ? -18.259 -10.904 -1.915 1.0 98.59 77 A 1 +ATOM 551 O O . LEU A ? 77 ? -19.114 -11.773 -1.756 1.0 98.28 77 A 1 +ATOM 552 C CB . LEU A ? 77 ? -18.303 -8.789 -0.515 1.0 98.6 77 A 1 +ATOM 553 C CG . LEU A ? 77 ? -17.944 -8.075 0.803 1.0 98.08 77 A 1 +ATOM 554 C CD1 . LEU A ? 77 ? -18.738 -6.774 0.892 1.0 96.98 77 A 1 +ATOM 555 C CD2 . LEU A ? 77 ? -18.254 -8.909 2.045 1.0 96.6 77 A 1 +ATOM 556 N N . GLY A ? 78 ? -17.768 -10.616 -3.119 1.0 98.71 78 A 1 +ATOM 557 C CA . GLY A ? 78 ? -18.205 -11.285 -4.345 1.0 98.64 78 A 1 +ATOM 558 C C . GLY A ? 78 ? -17.899 -12.789 -4.365 1.0 98.72 78 A 1 +ATOM 559 O O . GLY A ? 78 ? -18.650 -13.561 -4.963 1.0 98.41 78 A 1 +ATOM 560 N N . ALA A ? 79 ? -16.848 -13.224 -3.670 1.0 98.77 79 A 1 +ATOM 561 C CA . ALA A ? 79 ? -16.526 -14.641 -3.490 1.0 98.79 79 A 1 +ATOM 562 C C . ALA A ? 79 ? -17.409 -15.353 -2.441 1.0 98.77 79 A 1 +ATOM 563 O O . ALA A ? 79 ? -17.302 -16.569 -2.281 1.0 98.54 79 A 1 +ATOM 564 C CB . ALA A ? 79 ? -15.035 -14.770 -3.170 1.0 98.76 79 A 1 +ATOM 565 N N . GLY A ? 80 ? -18.291 -14.619 -1.751 1.0 98.72 80 A 1 +ATOM 566 C CA . GLY A ? 80 ? -19.224 -15.154 -0.754 1.0 98.69 80 A 1 +ATOM 567 C C . GLY A ? 80 ? -18.686 -15.167 0.679 1.0 98.8 80 A 1 +ATOM 568 O O . GLY A ? 80 ? -19.271 -15.836 1.533 1.0 98.35 80 A 1 +ATOM 569 N N . CYS A ? 81 ? -17.588 -14.460 0.957 1.0 98.77 81 A 1 +ATOM 570 C CA . CYS A ? 81 ? -17.104 -14.273 2.324 1.0 98.77 81 A 1 +ATOM 571 C C . CYS A ? 81 ? -18.093 -13.428 3.143 1.0 98.71 81 A 1 +ATOM 572 O O . CYS A ? 81 ? -18.865 -12.638 2.596 1.0 98.38 81 A 1 +ATOM 573 C CB . CYS A ? 81 ? -15.709 -13.635 2.316 1.0 98.76 81 A 1 +ATOM 574 S SG . CYS A ? 81 ? -14.520 -14.687 1.424 1.0 98.64 81 A 1 +ATOM 575 N N . ASP A ? 82 ? -18.052 -13.588 4.470 1.0 98.65 82 A 1 +ATOM 576 C CA . ASP A ? 82 ? -18.949 -12.863 5.364 1.0 98.59 82 A 1 +ATOM 577 C C . ASP A ? 82 ? -18.664 -11.350 5.367 1.0 98.62 82 A 1 +ATOM 578 O O . ASP A ? 82 ? -17.525 -10.904 5.206 1.0 98.32 82 A 1 +ATOM 579 C CB . ASP A ? 82 ? -18.855 -13.450 6.781 1.0 98.36 82 A 1 +ATOM 580 C CG . ASP A ? 82 ? -19.972 -12.865 7.648 1.0 97.38 82 A 1 +ATOM 581 O OD1 . ASP A ? 82 ? -19.675 -11.932 8.425 1.0 94.62 82 A 1 +ATOM 582 O OD2 . ASP A ? 82 ? -21.133 -13.283 7.448 1.0 94.37 82 A 1 +ATOM 583 N N . VAL A ? 83 ? -19.699 -10.548 5.600 1.0 98.65 83 A 1 +ATOM 584 C CA . VAL A ? 83 ? -19.562 -9.082 5.670 1.0 98.59 83 A 1 +ATOM 585 C C . VAL A ? 83 ? -18.644 -8.618 6.809 1.0 98.64 83 A 1 +ATOM 586 O O . VAL A ? 83 ? -18.094 -7.523 6.735 1.0 98.12 83 A 1 +ATOM 587 C CB . VAL A ? 83 ? -20.930 -8.383 5.783 1.0 98.1 83 A 1 +ATOM 588 C CG1 . VAL A ? 83 ? -21.761 -8.600 4.515 1.0 95.95 83 A 1 +ATOM 589 C CG2 . VAL A ? 83 ? -21.739 -8.839 7.008 1.0 95.53 83 A 1 +ATOM 590 N N . SER A ? 84 ? -18.429 -9.460 7.824 1.0 98.53 84 A 1 +ATOM 591 C CA . SER A ? 84 ? -17.483 -9.208 8.920 1.0 98.53 84 A 1 +ATOM 592 C C . SER A ? 84 ? -16.005 -9.357 8.523 1.0 98.61 84 A 1 +ATOM 593 O O . SER A ? 84 ? -15.135 -8.931 9.281 1.0 98.27 84 A 1 +ATOM 594 C CB . SER A ? 84 ? -17.800 -10.125 10.106 1.0 98.33 84 A 1 +ATOM 595 O OG . SER A ? 84 ? -17.553 -11.479 9.792 1.0 96.78 84 A 1 +ATOM 596 N N . THR A ? 85 ? -15.714 -9.924 7.354 1.0 98.62 85 A 1 +ATOM 597 C CA . THR A ? 85 ? -14.340 -10.131 6.873 1.0 98.68 85 A 1 +ATOM 598 C C . THR A ? 85 ? -13.609 -8.801 6.717 1.0 98.67 85 A 1 +ATOM 599 O O . THR A ? 85 ? -14.074 -7.907 6.010 1.0 98.54 85 A 1 +ATOM 600 C CB . THR A ? 85 ? -14.318 -10.874 5.530 1.0 98.65 85 A 1 +ATOM 601 O OG1 . THR A ? 85 ? -15.153 -12.005 5.563 1.0 97.1 85 A 1 +ATOM 602 C CG2 . THR A ? 85 ? -12.918 -11.366 5.158 1.0 97.23 85 A 1 +ATOM 603 N N . VAL A ? 86 ? -12.436 -8.688 7.332 1.0 98.74 86 A 1 +ATOM 604 C CA . VAL A ? 86 ? -11.568 -7.509 7.212 1.0 98.76 86 A 1 +ATOM 605 C C . VAL A ? 86 ? -10.774 -7.603 5.909 1.0 98.81 86 A 1 +ATOM 606 O O . VAL A ? 86 ? -10.175 -8.634 5.627 1.0 98.62 86 A 1 +ATOM 607 C CB . VAL A ? 86 ? -10.635 -7.401 8.428 1.0 98.46 86 A 1 +ATOM 608 C CG1 . VAL A ? 86 ? -9.755 -6.150 8.337 1.0 97.32 86 A 1 +ATOM 609 C CG2 . VAL A ? 86 ? -11.441 -7.322 9.735 1.0 97.3 86 A 1 +ATOM 610 N N . VAL A ? 87 ? -10.750 -6.542 5.115 1.0 98.72 87 A 1 +ATOM 611 C CA . VAL A ? 87 ? -10.097 -6.583 3.796 1.0 98.76 87 A 1 +ATOM 612 C C . VAL A ? 87 ? -9.208 -5.371 3.573 1.0 98.73 87 A 1 +ATOM 613 O O . VAL A ? 87 ? -9.641 -4.238 3.755 1.0 98.51 87 A 1 +ATOM 614 C CB . VAL A ? 87 ? -11.109 -6.710 2.643 1.0 98.6 87 A 1 +ATOM 615 C CG1 . VAL A ? 87 ? -10.377 -7.008 1.327 1.0 97.58 87 A 1 +ATOM 616 C CG2 . VAL A ? 87 ? -12.130 -7.834 2.876 1.0 97.52 87 A 1 +ATOM 617 N N . THR A ? 88 ? -7.986 -5.621 3.124 1.0 98.8 88 A 1 +ATOM 618 C CA . THR A ? 88 ? -7.002 -4.580 2.820 1.0 98.8 88 A 1 +ATOM 619 C C . THR A ? 88 ? -6.368 -4.832 1.446 1.0 98.83 88 A 1 +ATOM 620 O O . THR A ? 88 ? -5.834 -5.910 1.195 1.0 98.79 88 A 1 +ATOM 621 C CB . THR A ? 88 ? -5.926 -4.527 3.912 1.0 98.74 88 A 1 +ATOM 622 O OG1 . THR A ? 88 ? -6.531 -4.410 5.184 1.0 97.66 88 A 1 +ATOM 623 C CG2 . THR A ? 88 ? -4.988 -3.332 3.764 1.0 97.83 88 A 1 +ATOM 624 N N . ALA A ? 89 ? -6.394 -3.836 0.572 1.0 98.85 89 A 1 +ATOM 625 C CA . ALA A ? 89 ? -5.538 -3.802 -0.610 1.0 98.81 89 A 1 +ATOM 626 C C . ALA A ? 89 ? -4.218 -3.117 -0.266 1.0 98.75 89 A 1 +ATOM 627 O O . ALA A ? 89 ? -4.201 -2.113 0.438 1.0 98.52 89 A 1 +ATOM 628 C CB . ALA A ? 89 ? -6.271 -3.113 -1.767 1.0 98.69 89 A 1 +ATOM 629 N N . VAL A ? 90 ? -3.085 -3.807 -0.867 1.0 98.68 90 A 1 +ATOM 630 C CA . VAL A ? 90 ? -1.756 -3.223 -0.743 1.0 98.55 90 A 1 +ATOM 631 C C . VAL A ? 90 ? -1.076 -3.152 -2.083 1.0 98.74 90 A 1 +ATOM 632 O O . VAL A ? 90 ? -1.291 -4.009 -2.939 1.0 98.44 90 A 1 +ATOM 633 C CB . VAL A ? 90 ? -0.881 -3.974 0.274 1.0 96.82 90 A 1 +ATOM 634 C CG1 . VAL A ? 90 ? -1.469 -3.869 1.698 1.0 94.85 90 A 1 +ATOM 635 C CG2 . VAL A ? 90 ? -0.690 -5.454 -0.062 1.0 94.5 90 A 1 +ATOM 636 N N . ASN A ? 91 ? -0.239 -1.988 -2.173 1.0 98.61 91 A 1 +ATOM 637 C CA . ASN A ? 91 ? 0.541 -1.814 -3.381 1.0 98.66 91 A 1 +ATOM 638 C C . ASN A ? 91 ? 2.033 -1.783 -3.036 1.0 98.7 91 A 1 +ATOM 639 O O . ASN A ? 91 ? 2.528 -0.845 -2.407 1.0 98.55 91 A 1 +ATOM 640 C CB . ASN A ? 91 ? 0.047 -0.558 -4.122 1.0 98.43 91 A 1 +ATOM 641 C CG . ASN A ? 91 ? 0.827 -0.279 -5.408 1.0 97.57 91 A 1 +ATOM 642 O OD1 . ASN A ? 91 ? 1.732 -1.002 -5.800 1.0 93.63 91 A 1 +ATOM 643 N ND2 . ASN A ? 91 ? 0.517 0.802 -6.085 1.0 92.71 91 A 1 +ATOM 644 N N . LYS A ? 92 ? 2.736 -2.810 -3.459 1.0 98.58 92 A 1 +ATOM 645 C CA . LYS A ? 92 ? 4.200 -2.886 -3.497 1.0 98.71 92 A 1 +ATOM 646 C C . LYS A ? 92 ? 4.654 -3.153 -4.944 1.0 98.71 92 A 1 +ATOM 647 O O . LYS A ? 92 ? 5.489 -4.022 -5.187 1.0 98.26 92 A 1 +ATOM 648 C CB . LYS A ? 92 ? 4.706 -3.908 -2.465 1.0 98.63 92 A 1 +ATOM 649 C CG . LYS A ? 92 ? 6.231 -3.799 -2.232 1.0 97.99 92 A 1 +ATOM 650 C CD . LYS A ? 92 ? 6.691 -4.764 -1.132 1.0 97.17 92 A 1 +ATOM 651 C CE . LYS A ? 92 ? 8.204 -4.694 -0.913 1.0 95.89 92 A 1 +ATOM 652 N NZ . LYS A ? 92 ? 8.961 -5.514 -1.893 1.0 94.9 92 A 1 +ATOM 653 N N . MET A ? 93 ? 4.059 -2.424 -5.875 1.0 98.78 93 A 1 +ATOM 654 C CA . MET A ? 93 ? 4.312 -2.575 -7.309 1.0 98.7 93 A 1 +ATOM 655 C C . MET A ? 93 ? 4.232 -4.052 -7.728 1.0 98.79 93 A 1 +ATOM 656 O O . MET A ? 93 ? 3.330 -4.777 -7.267 1.0 98.38 93 A 1 +ATOM 657 C CB . MET A ? 93 ? 5.621 -1.853 -7.705 1.0 98.11 93 A 1 +ATOM 658 C CG . MET A ? 93 ? 5.570 -0.335 -7.470 1.0 93.43 93 A 1 +ATOM 659 S SD . MET A ? 93 ? 5.612 0.198 -5.742 1.0 84.08 93 A 1 +ATOM 660 C CE . MET A ? 93 ? 7.391 0.195 -5.440 1.0 71.73 93 A 1 +ATOM 661 N N . CYS A ? 94 ? 5.153 -4.536 -8.563 1.0 98.62 94 A 1 +ATOM 662 C CA . CYS A ? 94 ? 5.099 -5.898 -9.099 1.0 98.46 94 A 1 +ATOM 663 C C . CYS A ? 94 ? 5.202 -7.006 -8.030 1.0 98.66 94 A 1 +ATOM 664 O O . CYS A ? 94 ? 4.914 -8.160 -8.324 1.0 98.03 94 A 1 +ATOM 665 C CB . CYS A ? 94 ? 6.203 -6.050 -10.148 1.0 97.07 94 A 1 +ATOM 666 S SG . CYS A ? 94 ? 6.302 -4.608 -11.254 1.0 90.58 94 A 1 +ATOM 667 N N . ALA A ? 95 ? 5.580 -6.684 -6.789 1.0 98.76 95 A 1 +ATOM 668 C CA . ALA A ? 95 ? 5.625 -7.630 -5.671 1.0 98.86 95 A 1 +ATOM 669 C C . ALA A ? 95 ? 4.354 -7.617 -4.791 1.0 98.91 95 A 1 +ATOM 670 O O . ALA A ? 95 ? 4.308 -8.321 -3.781 1.0 98.82 95 A 1 +ATOM 671 C CB . ALA A ? 95 ? 6.894 -7.372 -4.852 1.0 98.73 95 A 1 +ATOM 672 N N . SER A ? 96 ? 3.319 -6.857 -5.151 1.0 98.89 96 A 1 +ATOM 673 C CA . SER A ? 96 ? 2.103 -6.664 -4.346 1.0 98.91 96 A 1 +ATOM 674 C C . SER A ? 96 ? 1.433 -7.975 -3.919 1.0 98.93 96 A 1 +ATOM 675 O O . SER A ? 96 ? 1.125 -8.149 -2.742 1.0 98.86 96 A 1 +ATOM 676 C CB . SER A ? 96 ? 1.096 -5.807 -5.127 1.0 98.81 96 A 1 +ATOM 677 O OG . SER A ? 96 ? 1.652 -4.535 -5.395 1.0 98.24 96 A 1 +ATOM 678 N N . GLY A ? 97 ? 1.262 -8.916 -4.840 1.0 98.92 97 A 1 +ATOM 679 C CA . GLY A ? 97 ? 0.667 -10.222 -4.534 1.0 98.93 97 A 1 +ATOM 680 C C . GLY A ? 97 ? 1.475 -11.038 -3.515 1.0 98.96 97 A 1 +ATOM 681 O O . GLY A ? 97 ? 0.898 -11.708 -2.664 1.0 98.9 97 A 1 +ATOM 682 N N . MET A ? 98 ? 2.805 -10.940 -3.541 1.0 98.96 98 A 1 +ATOM 683 C CA . MET A ? 98 ? 3.662 -11.600 -2.549 1.0 98.95 98 A 1 +ATOM 684 C C . MET A ? 98 ? 3.635 -10.872 -1.196 1.0 98.96 98 A 1 +ATOM 685 O O . MET A ? 98 ? 3.564 -11.523 -0.157 1.0 98.9 98 A 1 +ATOM 686 C CB . MET A ? 98 ? 5.087 -11.731 -3.095 1.0 98.85 98 A 1 +ATOM 687 C CG . MET A ? 98 ? 5.951 -12.616 -2.188 1.0 97.58 98 A 1 +ATOM 688 S SD . MET A ? 98 ? 7.623 -12.921 -2.817 1.0 97.43 98 A 1 +ATOM 689 C CE . MET A ? 98 ? 7.258 -14.023 -4.204 1.0 93.28 98 A 1 +ATOM 690 N N . LYS A ? 99 ? 3.636 -9.529 -1.193 1.0 98.92 99 A 1 +ATOM 691 C CA . LYS A ? 99 ? 3.513 -8.752 0.051 1.0 98.92 99 A 1 +ATOM 692 C C . LYS A ? 99 ? 2.170 -8.994 0.749 1.0 98.92 99 A 1 +ATOM 693 O O . LYS A ? 99 ? 2.144 -9.067 1.970 1.0 98.86 99 A 1 +ATOM 694 C CB . LYS A ? 99 ? 3.768 -7.256 -0.215 1.0 98.87 99 A 1 +ATOM 695 C CG . LYS A ? 99 ? 3.903 -6.413 1.074 1.0 98.55 99 A 1 +ATOM 696 C CD . LYS A ? 99 ? 5.126 -6.786 1.936 1.0 97.94 99 A 1 +ATOM 697 C CE . LYS A ? 99 ? 5.328 -5.820 3.111 1.0 97.29 99 A 1 +ATOM 698 N NZ . LYS A ? 99 ? 6.600 -6.061 3.844 1.0 95.99 99 A 1 +ATOM 699 N N . ALA A ? 100 ? 1.094 -9.192 -0.007 1.0 98.96 100 A 1 +ATOM 700 C CA . ALA A ? 100 ? -0.199 -9.589 0.548 1.0 98.96 100 A 1 +ATOM 701 C C . ALA A ? 100 ? -0.105 -10.922 1.319 1.0 98.95 100 A 1 +ATOM 702 O O . ALA A ? 100 ? -0.575 -11.014 2.453 1.0 98.9 100 A 1 +ATOM 703 C CB . ALA A ? 100 ? -1.218 -9.662 -0.597 1.0 98.94 100 A 1 +ATOM 704 N N . ILE A ? 101 ? 0.577 -11.921 0.754 1.0 98.96 101 A 1 +ATOM 705 C CA . ILE A ? 101 ? 0.822 -13.213 1.418 1.0 98.96 101 A 1 +ATOM 706 C C . ILE A ? 101 ? 1.696 -13.030 2.673 1.0 98.92 101 A 1 +ATOM 707 O O . ILE A ? 101 ? 1.418 -13.636 3.704 1.0 98.84 101 A 1 +ATOM 708 C CB . ILE A ? 101 ? 1.431 -14.233 0.427 1.0 98.96 101 A 1 +ATOM 709 C CG1 . ILE A ? 101 ? 0.459 -14.521 -0.743 1.0 98.87 101 A 1 +ATOM 710 C CG2 . ILE A ? 101 ? 1.775 -15.556 1.140 1.0 98.88 101 A 1 +ATOM 711 C CD1 . ILE A ? 101 ? 1.075 -15.332 -1.897 1.0 98.7 101 A 1 +ATOM 712 N N . ALA A ? 102 ? 2.708 -12.164 2.623 1.0 98.91 102 A 1 +ATOM 713 C CA . ALA A ? 102 ? 3.543 -11.850 3.785 1.0 98.86 102 A 1 +ATOM 714 C C . ALA A ? 102 ? 2.738 -11.185 4.919 1.0 98.8 102 A 1 +ATOM 715 O O . ALA A ? 102 ? 2.861 -11.582 6.076 1.0 98.61 102 A 1 +ATOM 716 C CB . ALA A ? 102 ? 4.713 -10.966 3.332 1.0 98.79 102 A 1 +ATOM 717 N N . CYS A ? 103 ? 1.858 -10.229 4.594 1.0 98.85 103 A 1 +ATOM 718 C CA . CYS A ? 103 ? 0.951 -9.614 5.567 1.0 98.8 103 A 1 +ATOM 719 C C . CYS A ? 103 ? 0.017 -10.654 6.208 1.0 98.72 103 A 1 +ATOM 720 O O . CYS A ? 103 ? -0.133 -10.672 7.428 1.0 98.52 103 A 1 +ATOM 721 C CB . CYS A ? 103 ? 0.141 -8.499 4.886 1.0 98.8 103 A 1 +ATOM 722 S SG . CYS A ? 103 ? 1.203 -7.091 4.441 1.0 98.46 103 A 1 +ATOM 723 N N . ALA A ? 104 ? -0.556 -11.556 5.404 1.0 98.84 104 A 1 +ATOM 724 C CA . ALA A ? 104 ? -1.396 -12.644 5.901 1.0 98.82 104 A 1 +ATOM 725 C C . ALA A ? 104 ? -0.625 -13.595 6.836 1.0 98.72 104 A 1 +ATOM 726 O O . ALA A ? 104 ? -1.128 -13.955 7.897 1.0 98.52 104 A 1 +ATOM 727 C CB . ALA A ? 104 ? -1.979 -13.390 4.697 1.0 98.83 104 A 1 +ATOM 728 N N . ALA A ? 105 ? 0.616 -13.946 6.486 1.0 98.73 105 A 1 +ATOM 729 C CA . ALA A ? 105 ? 1.478 -14.765 7.333 1.0 98.63 105 A 1 +ATOM 730 C C . ALA A ? 105 ? 1.753 -14.094 8.688 1.0 98.43 105 A 1 +ATOM 731 O O . ALA A ? 105 ? 1.633 -14.744 9.725 1.0 98.15 105 A 1 +ATOM 732 C CB . ALA A ? 105 ? 2.779 -15.068 6.582 1.0 98.62 105 A 1 +ATOM 733 N N . SER A ? 106 ? 2.041 -12.789 8.700 1.0 98.44 106 A 1 +ATOM 734 C CA . SER A ? 106 ? 2.265 -12.020 9.932 1.0 98.22 106 A 1 +ATOM 735 C C . SER A ? 106 ? 1.039 -12.019 10.854 1.0 97.96 106 A 1 +ATOM 736 O O . SER A ? 106 ? 1.175 -12.216 12.060 1.0 97.48 106 A 1 +ATOM 737 C CB . SER A ? 106 ? 2.649 -10.574 9.598 1.0 98.08 106 A 1 +ATOM 738 O OG . SER A ? 106 ? 3.841 -10.515 8.838 1.0 96.59 106 A 1 +ATOM 739 N N . ILE A ? 107 ? -0.163 -11.855 10.297 1.0 98.07 107 A 1 +ATOM 740 C CA . ILE A ? 107 ? -1.430 -11.894 11.049 1.0 97.63 107 A 1 +ATOM 741 C C . ILE A ? 107 ? -1.660 -13.274 11.688 1.0 97.79 107 A 1 +ATOM 742 O O . ILE A ? 107 ? -2.044 -13.356 12.854 1.0 96.95 107 A 1 +ATOM 743 C CB . ILE A ? 107 ? -2.598 -11.479 10.119 1.0 95.84 107 A 1 +ATOM 744 C CG1 . ILE A ? 107 ? -2.511 -9.990 9.695 1.0 87.44 107 A 1 +ATOM 745 C CG2 . ILE A ? 107 ? -3.976 -11.765 10.735 1.0 83.67 107 A 1 +ATOM 746 C CD1 . ILE A ? 107 ? -2.627 -8.963 10.817 1.0 80.15 107 A 1 +ATOM 747 N N . LEU A ? 108 ? -1.383 -14.354 10.949 1.0 98.19 108 A 1 +ATOM 748 C CA . LEU A ? 108 ? -1.504 -15.727 11.452 1.0 98.2 108 A 1 +ATOM 749 C C . LEU A ? 108 ? -0.462 -16.042 12.535 1.0 97.78 108 A 1 +ATOM 750 O O . LEU A ? 108 ? -0.798 -16.660 13.544 1.0 97.29 108 A 1 +ATOM 751 C CB . LEU A ? 108 ? -1.376 -16.709 10.278 1.0 98.46 108 A 1 +ATOM 752 C CG . LEU A ? 108 ? -2.562 -16.689 9.296 1.0 98.41 108 A 1 +ATOM 753 C CD1 . LEU A ? 108 ? -2.207 -17.518 8.062 1.0 98.27 108 A 1 +ATOM 754 C CD2 . LEU A ? 108 ? -3.831 -17.275 9.911 1.0 98.22 108 A 1 +ATOM 755 N N . GLN A ? 109 ? 0.782 -15.593 12.367 1.0 97.91 109 A 1 +ATOM 756 C CA . GLN A ? 109 ? 1.840 -15.776 13.374 1.0 97.64 109 A 1 +ATOM 757 C C . GLN A ? 109 ? 1.520 -15.073 14.695 1.0 97.26 109 A 1 +ATOM 758 O O . GLN A ? 109 ? 1.862 -15.585 15.758 1.0 96.51 109 A 1 +ATOM 759 C CB . GLN A ? 109 ? 3.175 -15.240 12.852 1.0 97.52 109 A 1 +ATOM 760 C CG . GLN A ? 109 ? 3.856 -16.187 11.864 1.0 96.48 109 A 1 +ATOM 761 C CD . GLN A ? 109 ? 5.267 -15.680 11.569 1.0 96.67 109 A 1 +ATOM 762 O OE1 . GLN A ? 109 ? 5.497 -14.886 10.675 1.0 91.91 109 A 1 +ATOM 763 N NE2 . GLN A ? 109 ? 6.252 -16.093 12.339 1.0 90.88 109 A 1 +ATOM 764 N N . LEU A ? 110 ? 0.855 -13.919 14.638 1.0 97.55 110 A 1 +ATOM 765 C CA . LEU A ? 110 ? 0.427 -13.162 15.820 1.0 97.13 110 A 1 +ATOM 766 C C . LEU A ? 110 ? -0.884 -13.682 16.436 1.0 96.6 110 A 1 +ATOM 767 O O . LEU A ? 110 ? -1.360 -13.095 17.404 1.0 95.35 110 A 1 +ATOM 768 C CB . LEU A ? 110 ? 0.332 -11.674 15.458 1.0 97.09 110 A 1 +ATOM 769 C CG . LEU A ? 110 ? 1.696 -10.997 15.224 1.0 96.81 110 A 1 +ATOM 770 C CD1 . LEU A ? 110 ? 1.467 -9.599 14.655 1.0 96.11 110 A 1 +ATOM 771 C CD2 . LEU A ? 110 ? 2.500 -10.860 16.518 1.0 95.95 110 A 1 +ATOM 772 N N . ASP A ? 111 ? -1.463 -14.764 15.893 1.0 96.62 111 A 1 +ATOM 773 C CA . ASP A ? 111 ? -2.744 -15.338 16.345 1.0 96.1 111 A 1 +ATOM 774 C C . ASP A ? 111 ? -3.910 -14.322 16.348 1.0 96.41 111 A 1 +ATOM 775 O O . ASP A ? 111 ? -4.863 -14.452 17.113 1.0 94.77 111 A 1 +ATOM 776 C CB . ASP A ? 111 ? -2.555 -16.107 17.677 1.0 94.59 111 A 1 +ATOM 777 C CG . ASP A ? 111 ? -2.772 -17.620 17.610 1.0 91.02 111 A 1 +ATOM 778 O OD1 . ASP A ? 111 ? -3.287 -18.156 16.608 1.0 86.05 111 A 1 +ATOM 779 O OD2 . ASP A ? 111 ? -2.380 -18.316 18.582 1.0 84.71 111 A 1 +ATOM 780 N N . LEU A ? 112 ? -3.833 -13.289 15.499 1.0 96.84 112 A 1 +ATOM 781 C CA . LEU A ? 112 ? -4.892 -12.280 15.347 1.0 96.84 112 A 1 +ATOM 782 C C . LEU A ? 112 ? -6.087 -12.817 14.552 1.0 97.19 112 A 1 +ATOM 783 O O . LEU A ? 112 ? -7.215 -12.362 14.741 1.0 96.44 112 A 1 +ATOM 784 C CB . LEU A ? 112 ? -4.314 -11.030 14.660 1.0 96.57 112 A 1 +ATOM 785 C CG . LEU A ? 112 ? -3.235 -10.283 15.466 1.0 95.93 112 A 1 +ATOM 786 C CD1 . LEU A ? 112 ? -2.647 -9.158 14.617 1.0 94.6 112 A 1 +ATOM 787 C CD2 . LEU A ? 112 ? -3.800 -9.667 16.746 1.0 94.28 112 A 1 +ATOM 788 N N . GLN A ? 113 ? -5.823 -13.770 13.663 1.0 97.33 113 A 1 +ATOM 789 C CA . GLN A ? 113 ? -6.805 -14.488 12.844 1.0 97.81 113 A 1 +ATOM 790 C C . GLN A ? 113 ? -6.356 -15.947 12.690 1.0 97.92 113 A 1 +ATOM 791 O O . GLN A ? 113 ? -5.186 -16.274 12.875 1.0 97.45 113 A 1 +ATOM 792 C CB . GLN A ? 113 ? -6.924 -13.830 11.460 1.0 97.82 113 A 1 +ATOM 793 C CG . GLN A ? 113 ? -7.329 -12.354 11.446 1.0 97.4 113 A 1 +ATOM 794 C CD . GLN A ? 113 ? -8.757 -12.037 11.885 1.0 97.73 113 A 1 +ATOM 795 O OE1 . GLN A ? 113 ? -9.499 -12.837 12.422 1.0 93.83 113 A 1 +ATOM 796 N NE2 . GLN A ? 113 ? -9.176 -10.811 11.660 1.0 94.47 113 A 1 +ATOM 797 N N . GLU A ? 114 ? -7.295 -16.823 12.325 1.0 98.38 114 A 1 +ATOM 798 C CA . GLU A ? 114 ? -7.049 -18.255 12.097 1.0 98.41 114 A 1 +ATOM 799 C C . GLU A ? 114 ? -7.209 -18.657 10.619 1.0 98.65 114 A 1 +ATOM 800 O O . GLU A ? 114 ? -6.568 -19.596 10.162 1.0 98.37 114 A 1 +ATOM 801 C CB . GLU A ? 114 ? -8.007 -19.042 13.011 1.0 97.53 114 A 1 +ATOM 802 C CG . GLU A ? 114 ? -7.751 -20.557 13.041 1.0 94.32 114 A 1 +ATOM 803 C CD . GLU A ? 114 ? -8.795 -21.261 13.939 1.0 92.94 114 A 1 +ATOM 804 O OE1 . GLU A ? 114 ? -8.440 -21.931 14.926 1.0 85.7 114 A 1 +ATOM 805 O OE2 . GLU A ? 114 ? -10.017 -21.139 13.674 1.0 87.29 114 A 1 +ATOM 806 N N . MET A ? 115 ? -8.053 -17.947 9.868 1.0 98.72 115 A 1 +ATOM 807 C CA . MET A ? 115 ? -8.306 -18.206 8.448 1.0 98.81 115 A 1 +ATOM 808 C C . MET A ? 115 ? -8.190 -16.917 7.642 1.0 98.88 115 A 1 +ATOM 809 O O . MET A ? 115 ? -9.031 -16.024 7.761 1.0 98.76 115 A 1 +ATOM 810 C CB . MET A ? 115 ? -9.692 -18.843 8.286 1.0 98.56 115 A 1 +ATOM 811 C CG . MET A ? 115 ? -9.928 -19.407 6.882 1.0 94.45 115 A 1 +ATOM 812 S SD . MET A ? 115 ? -8.913 -20.849 6.423 1.0 95.02 115 A 1 +ATOM 813 C CE . MET A ? 115 ? -9.466 -22.049 7.657 1.0 88.83 115 A 1 +ATOM 814 N N . VAL A ? 116 ? -7.169 -16.829 6.807 1.0 98.92 116 A 1 +ATOM 815 C CA . VAL A ? 116 ? -6.850 -15.637 6.013 1.0 98.93 116 A 1 +ATOM 816 C C . VAL A ? 116 ? -6.704 -16.017 4.542 1.0 98.96 116 A 1 +ATOM 817 O O . VAL A ? 116 ? -6.155 -17.062 4.206 1.0 98.89 116 A 1 +ATOM 818 C CB . VAL A ? 116 ? -5.585 -14.935 6.554 1.0 98.62 116 A 1 +ATOM 819 C CG1 . VAL A ? 116 ? -5.329 -13.609 5.836 1.0 93.62 116 A 1 +ATOM 820 C CG2 . VAL A ? 116 ? -5.707 -14.616 8.052 1.0 91.81 116 A 1 +ATOM 821 N N . VAL A ? 117 ? -7.181 -15.169 3.653 1.0 98.94 117 A 1 +ATOM 822 C CA . VAL A ? 117 ? -6.903 -15.278 2.218 1.0 98.95 117 A 1 +ATOM 823 C C . VAL A ? 117 ? -5.965 -14.162 1.782 1.0 98.95 117 A 1 +ATOM 824 O O . VAL A ? 117 ? -5.994 -13.059 2.320 1.0 98.9 117 A 1 +ATOM 825 C CB . VAL A ? 117 ? -8.173 -15.343 1.352 1.0 98.83 117 A 1 +ATOM 826 C CG1 . VAL A ? 117 ? -9.012 -16.571 1.707 1.0 97.94 117 A 1 +ATOM 827 C CG2 . VAL A ? 117 ? -9.049 -14.093 1.470 1.0 97.63 117 A 1 +ATOM 828 N N . ALA A ? 118 ? -5.124 -14.449 0.804 1.0 98.96 118 A 1 +ATOM 829 C CA . ALA A ? 118 ? -4.200 -13.474 0.249 1.0 98.96 118 A 1 +ATOM 830 C C . ALA A ? 118 ? -3.980 -13.723 -1.241 1.0 98.97 118 A 1 +ATOM 831 O O . ALA A ? 118 ? -4.301 -14.787 -1.764 1.0 98.89 118 A 1 +ATOM 832 C CB . ALA A ? 118 ? -2.889 -13.518 1.036 1.0 98.87 118 A 1 +ATOM 833 N N . GLY A ? 119 ? -3.414 -12.751 -1.931 1.0 98.94 119 A 1 +ATOM 834 C CA . GLY A ? 119 ? -3.093 -12.904 -3.340 1.0 98.92 119 A 1 +ATOM 835 C C . GLY A ? 119 ? -2.888 -11.579 -4.040 1.0 98.95 119 A 1 +ATOM 836 O O . GLY A ? 119 ? -2.567 -10.565 -3.420 1.0 98.81 119 A 1 +ATOM 837 N N . GLY A ? 120 ? -3.058 -11.602 -5.348 1.0 98.97 120 A 1 +ATOM 838 C CA . GLY A ? 120 ? -2.901 -10.416 -6.165 1.0 98.97 120 A 1 +ATOM 839 C C . GLY A ? 120 ? -3.711 -10.483 -7.446 1.0 98.98 120 A 1 +ATOM 840 O O . GLY A ? 120 ? -4.060 -11.562 -7.928 1.0 98.92 120 A 1 +ATOM 841 N N . MET A ? 121 ? -4.008 -9.311 -7.982 1.0 98.97 121 A 1 +ATOM 842 C CA . MET A ? 121 ? -4.801 -9.161 -9.191 1.0 98.96 121 A 1 +ATOM 843 C C . MET A ? 121 ? -4.363 -7.921 -9.966 1.0 98.96 121 A 1 +ATOM 844 O O . MET A ? 121 ? -3.915 -6.938 -9.384 1.0 98.87 121 A 1 +ATOM 845 C CB . MET A ? 121 ? -6.291 -9.111 -8.831 1.0 98.83 121 A 1 +ATOM 846 C CG . MET A ? 121 ? -6.686 -7.905 -7.961 1.0 98.8 121 A 1 +ATOM 847 S SD . MET A ? 121 ? -8.403 -7.993 -7.384 1.0 98.79 121 A 1 +ATOM 848 C CE . MET A ? 121 ? -8.537 -6.402 -6.559 1.0 97.65 121 A 1 +ATOM 849 N N . GLU A ? 122 ? -4.525 -7.969 -11.275 1.0 98.97 122 A 1 +ATOM 850 C CA . GLU A ? 122 ? -4.356 -6.797 -12.137 1.0 98.96 122 A 1 +ATOM 851 C C . GLU A ? 122 ? -5.198 -6.960 -13.398 1.0 98.95 122 A 1 +ATOM 852 O O . GLU A ? 122 ? -5.279 -8.050 -13.961 1.0 98.88 122 A 1 +ATOM 853 C CB . GLU A ? 122 ? -2.883 -6.612 -12.515 1.0 98.9 122 A 1 +ATOM 854 C CG . GLU A ? 122 ? -2.487 -5.134 -12.722 1.0 98.5 122 A 1 +ATOM 855 C CD . GLU A ? 122 ? -2.396 -4.373 -11.395 1.0 98.87 122 A 1 +ATOM 856 O OE1 . GLU A ? 122 ? -3.105 -3.368 -11.220 1.0 97.82 122 A 1 +ATOM 857 O OE2 . GLU A ? 122 ? -1.611 -4.803 -10.514 1.0 98.02 122 A 1 +ATOM 858 N N . SER A ? 123 ? -5.802 -5.891 -13.847 1.0 98.88 123 A 1 +ATOM 859 C CA . SER A ? 123 ? -6.345 -5.774 -15.198 1.0 98.86 123 A 1 +ATOM 860 C C . SER A ? 123 ? -5.705 -4.572 -15.868 1.0 98.85 123 A 1 +ATOM 861 O O . SER A ? 123 ? -6.189 -3.449 -15.741 1.0 98.64 123 A 1 +ATOM 862 C CB . SER A ? 123 ? -7.865 -5.661 -15.191 1.0 98.72 123 A 1 +ATOM 863 O OG . SER A ? 123 ? -8.309 -5.475 -16.519 1.0 97.96 123 A 1 +ATOM 864 N N . MET A ? 124 ? -4.615 -4.799 -16.584 1.0 98.72 124 A 1 +ATOM 865 C CA . MET A ? 124 ? -3.943 -3.729 -17.326 1.0 98.68 124 A 1 +ATOM 866 C C . MET A ? 124 ? -4.833 -3.230 -18.477 1.0 98.57 124 A 1 +ATOM 867 O O . MET A ? 124 ? -4.838 -2.040 -18.765 1.0 98.37 124 A 1 +ATOM 868 C CB . MET A ? 124 ? -2.559 -4.188 -17.803 1.0 98.7 124 A 1 +ATOM 869 C CG . MET A ? 124 ? -1.693 -4.704 -16.644 1.0 98.24 124 A 1 +ATOM 870 S SD . MET A ? 124 ? 0.035 -5.092 -17.043 1.0 97.96 124 A 1 +ATOM 871 C CE . MET A ? 124 ? 0.744 -3.435 -17.025 1.0 94.42 124 A 1 +ATOM 872 N N . SER A ? 125 ? -5.655 -4.101 -19.050 1.0 98.62 125 A 1 +ATOM 873 C CA . SER A ? 125 ? -6.653 -3.740 -20.069 1.0 98.4 125 A 1 +ATOM 874 C C . SER A ? 125 ? -7.703 -2.740 -19.572 1.0 98.23 125 A 1 +ATOM 875 O O . SER A ? 125 ? -8.143 -1.883 -20.339 1.0 97.76 125 A 1 +ATOM 876 C CB . SER A ? 125 ? -7.385 -4.995 -20.552 1.0 98.13 125 A 1 +ATOM 877 O OG . SER A ? 125 ? -6.481 -5.886 -21.170 1.0 97.26 125 A 1 +ATOM 878 N N . CYS A ? 126 ? -8.094 -2.828 -18.305 1.0 98.47 126 A 1 +ATOM 879 C CA . CYS A ? 126 ? -9.099 -1.951 -17.701 1.0 98.34 126 A 1 +ATOM 880 C C . CYS A ? 126 ? -8.521 -0.665 -17.088 1.0 98.35 126 A 1 +ATOM 881 O O . CYS A ? 126 ? -9.296 0.174 -16.624 1.0 97.96 126 A 1 +ATOM 882 C CB . CYS A ? 126 ? -9.923 -2.742 -16.678 1.0 98.1 126 A 1 +ATOM 883 S SG . CYS A ? 126 ? -10.992 -3.966 -17.508 1.0 97.26 126 A 1 +ATOM 884 N N . VAL A ? 127 ? -7.202 -0.467 -17.077 1.0 98.07 127 A 1 +ATOM 885 C CA . VAL A ? 127 ? -6.602 0.790 -16.603 1.0 98.07 127 A 1 +ATOM 886 C C . VAL A ? 127 ? -6.995 1.925 -17.554 1.0 97.83 127 A 1 +ATOM 887 O O . VAL A ? 127 ? -6.733 1.827 -18.755 1.0 97.84 127 A 1 +ATOM 888 C CB . VAL A ? 127 ? -5.073 0.692 -16.468 1.0 98.18 127 A 1 +ATOM 889 C CG1 . VAL A ? 127 ? -4.449 2.037 -16.074 1.0 97.45 127 A 1 +ATOM 890 C CG2 . VAL A ? 127 ? -4.677 -0.327 -15.392 1.0 96.8 127 A 1 +ATOM 891 N N . PRO A ? 128 ? -7.600 3.013 -17.046 1.0 98.05 128 A 1 +ATOM 892 C CA . PRO A ? 128 ? -8.060 4.112 -17.884 1.0 97.96 128 A 1 +ATOM 893 C C . PRO A ? 128 ? -6.926 5.063 -18.288 1.0 98.03 128 A 1 +ATOM 894 O O . PRO A ? 128 ? -5.806 5.013 -17.777 1.0 98.12 128 A 1 +ATOM 895 C CB . PRO A ? 128 ? -9.131 4.803 -17.037 1.0 97.73 128 A 1 +ATOM 896 C CG . PRO A ? 128 ? -8.585 4.648 -15.619 1.0 97.39 128 A 1 +ATOM 897 C CD . PRO A ? 128 ? -7.959 3.255 -15.651 1.0 98.09 128 A 1 +ATOM 898 N N . PHE A ? 129 ? -7.251 5.981 -19.184 1.0 97.67 129 A 1 +ATOM 899 C CA . PHE A ? 129 ? -6.507 7.227 -19.342 1.0 97.53 129 A 1 +ATOM 900 C C . PHE A ? 129 ? -6.968 8.250 -18.301 1.0 97.75 129 A 1 +ATOM 901 O O . PHE A ? 129 ? -8.114 8.210 -17.851 1.0 97.56 129 A 1 +ATOM 902 C CB . PHE A ? 129 ? -6.682 7.772 -20.759 1.0 97.05 129 A 1 +ATOM 903 C CG . PHE A ? 129 ? -6.203 6.833 -21.840 1.0 96.76 129 A 1 +ATOM 904 C CD1 . PHE A ? 129 ? -4.829 6.723 -22.122 1.0 92.87 129 A 1 +ATOM 905 C CD2 . PHE A ? 129 ? -7.122 6.050 -22.560 1.0 92.39 129 A 1 +ATOM 906 C CE1 . PHE A ? 129 ? -4.378 5.841 -23.119 1.0 90.44 129 A 1 +ATOM 907 C CE2 . PHE A ? 129 ? -6.676 5.162 -23.556 1.0 90.36 129 A 1 +ATOM 908 C CZ . PHE A ? 129 ? -5.302 5.059 -23.836 1.0 93.06 129 A 1 +ATOM 909 N N . TYR A ? 130 ? -6.094 9.189 -17.961 1.0 97.86 130 A 1 +ATOM 910 C CA . TYR A ? 130 ? -6.361 10.222 -16.963 1.0 97.75 130 A 1 +ATOM 911 C C . TYR A ? 130 ? -6.419 11.614 -17.582 1.0 97.36 130 A 1 +ATOM 912 O O . TYR A ? 130 ? -5.558 11.995 -18.373 1.0 96.87 130 A 1 +ATOM 913 C CB . TYR A ? 130 ? -5.300 10.182 -15.858 1.0 97.74 130 A 1 +ATOM 914 C CG . TYR A ? 130 ? -5.053 8.847 -15.182 1.0 98.2 130 A 1 +ATOM 915 C CD1 . TYR A ? 130 ? -6.083 7.907 -14.993 1.0 96.85 130 A 1 +ATOM 916 C CD2 . TYR A ? 130 ? -3.764 8.549 -14.707 1.0 96.3 130 A 1 +ATOM 917 C CE1 . TYR A ? 130 ? -5.836 6.683 -14.343 1.0 96.52 130 A 1 +ATOM 918 C CE2 . TYR A ? 130 ? -3.504 7.333 -14.047 1.0 96.23 130 A 1 +ATOM 919 C CZ . TYR A ? 130 ? -4.543 6.402 -13.870 1.0 98.07 130 A 1 +ATOM 920 O OH . TYR A ? 130 ? -4.296 5.224 -13.229 1.0 97.81 130 A 1 +ATOM 921 N N . LEU A ? 131 ? -7.397 12.398 -17.140 1.0 97.29 131 A 1 +ATOM 922 C CA . LEU A ? 131 ? -7.455 13.840 -17.347 1.0 96.93 131 A 1 +ATOM 923 C C . LEU A ? 131 ? -7.321 14.533 -15.981 1.0 96.89 131 A 1 +ATOM 924 O O . LEU A ? 131 ? -8.256 14.461 -15.177 1.0 96.77 131 A 1 +ATOM 925 C CB . LEU A ? 131 ? -8.759 14.213 -18.069 1.0 96.41 131 A 1 +ATOM 926 C CG . LEU A ? 131 ? -8.877 15.724 -18.364 1.0 94.99 131 A 1 +ATOM 927 C CD1 . LEU A ? 131 ? -7.833 16.195 -19.378 1.0 92.06 131 A 1 +ATOM 928 C CD2 . LEU A ? 131 ? -10.257 16.036 -18.929 1.0 91.13 131 A 1 +ATOM 929 N N . PRO A ? 132 ? -6.201 15.216 -15.695 1.0 96.83 132 A 1 +ATOM 930 C CA . PRO A ? 132 ? -6.051 15.992 -14.467 1.0 95.93 132 A 1 +ATOM 931 C C . PRO A ? 132 ? -7.124 17.075 -14.327 1.0 95.8 132 A 1 +ATOM 932 O O . PRO A ? 132 ? -7.611 17.625 -15.314 1.0 94.97 132 A 1 +ATOM 933 C CB . PRO A ? 132 ? -4.647 16.600 -14.526 1.0 94.76 132 A 1 +ATOM 934 C CG . PRO A ? 132 ? -3.890 15.642 -15.442 1.0 94.35 132 A 1 +ATOM 935 C CD . PRO A ? 132 ? -4.959 15.215 -16.446 1.0 96.41 132 A 1 +ATOM 936 N N . ARG A ? 133 ? -7.457 17.437 -13.096 1.0 96.4 133 A 1 +ATOM 937 C CA . ARG A ? 133 ? -8.331 18.583 -12.813 1.0 95.55 133 A 1 +ATOM 938 C C . ARG A ? 133 ? -7.620 19.890 -13.149 1.0 94.93 133 A 1 +ATOM 939 O O . ARG A ? 133 ? -6.428 20.034 -12.918 1.0 92.28 133 A 1 +ATOM 940 C CB . ARG A ? 133 ? -8.785 18.581 -11.349 1.0 94.06 133 A 1 +ATOM 941 C CG . ARG A ? 133 ? -9.630 17.349 -11.013 1.0 91.05 133 A 1 +ATOM 942 C CD . ARG A ? 133 ? -10.123 17.403 -9.567 1.0 89.21 133 A 1 +ATOM 943 N NE . ARG A ? 133 ? -10.729 16.122 -9.219 1.0 94.1 133 A 1 +ATOM 944 C CZ . ARG A ? 133 ? -11.992 15.741 -9.377 1.0 95.92 133 A 1 +ATOM 945 N NH1 . ARG A ? 133 ? -12.965 16.540 -9.724 1.0 90.66 133 A 1 +ATOM 946 N NH2 . ARG A ? 133 ? -12.283 14.504 -9.196 1.0 92.93 133 A 1 +ATOM 947 N N . GLY A ? 134 ? -8.386 20.864 -13.606 1.0 94.1 134 A 1 +ATOM 948 C CA . GLY A ? 134 ? -7.880 22.193 -13.941 1.0 93.1 134 A 1 +ATOM 949 C C . GLY A ? 134 ? -8.478 22.721 -15.237 1.0 93.98 134 A 1 +ATOM 950 O O . GLY A ? 134 ? -9.298 22.057 -15.876 1.0 91.08 134 A 1 +ATOM 951 N N . GLU A ? 135 ? -8.068 23.925 -15.613 1.0 90.86 135 A 1 +ATOM 952 C CA . GLU A ? 135 ? -8.399 24.464 -16.928 1.0 89.93 135 A 1 +ATOM 953 C C . GLU A ? 135 ? -7.650 23.707 -18.024 1.0 90.48 135 A 1 +ATOM 954 O O . GLU A ? 135 ? -6.453 23.425 -17.918 1.0 87.86 135 A 1 +ATOM 955 C CB . GLU A ? 135 ? -8.089 25.964 -17.017 1.0 87.58 135 A 1 +ATOM 956 C CG . GLU A ? 135 ? -9.202 26.817 -16.394 1.0 77.81 135 A 1 +ATOM 957 C CD . GLU A ? 135 ? -9.009 28.317 -16.643 1.0 70.78 135 A 1 +ATOM 958 O OE1 . GLU A ? 135 ? -10.035 29.036 -16.648 1.0 64.52 135 A 1 +ATOM 959 O OE2 . GLU A ? 135 ? -7.846 28.742 -16.827 1.0 66.33 135 A 1 +ATOM 960 N N . ILE A ? 136 ? -8.367 23.408 -19.105 1.0 89.1 136 A 1 +ATOM 961 C CA . ILE A ? 136 ? -7.773 22.875 -20.328 1.0 89.4 136 A 1 +ATOM 962 C C . ILE A ? 136 ? -7.390 24.070 -21.205 1.0 89.71 136 A 1 +ATOM 963 O O . ILE A ? 136 ? -8.265 24.865 -21.560 1.0 87.73 136 A 1 +ATOM 964 C CB . ILE A ? 136 ? -8.734 21.894 -21.033 1.0 88.9 136 A 1 +ATOM 965 C CG1 . ILE A ? 136 ? -9.059 20.705 -20.096 1.0 87.29 136 A 1 +ATOM 966 C CG2 . ILE A ? 136 ? -8.109 21.401 -22.350 1.0 87.31 136 A 1 +ATOM 967 C CD1 . ILE A ? 136 ? -10.088 19.723 -20.661 1.0 82.8 136 A 1 +ATOM 968 N N . PRO A ? 137 ? -6.116 24.229 -21.562 1.0 89.23 137 A 1 +ATOM 969 C CA . PRO A ? 137 ? -5.673 25.346 -22.382 1.0 88.38 137 A 1 +ATOM 970 C C . PRO A ? 137 ? -6.231 25.257 -23.805 1.0 89.15 137 A 1 +ATOM 971 O O . PRO A ? 137 ? -6.640 24.192 -24.283 1.0 87.05 137 A 1 +ATOM 972 C CB . PRO A ? 137 ? -4.144 25.294 -22.343 1.0 86.64 137 A 1 +ATOM 973 C CG . PRO A ? 137 ? -3.849 23.810 -22.145 1.0 84.86 137 A 1 +ATOM 974 C CD . PRO A ? 137 ? -4.997 23.351 -21.247 1.0 88.69 137 A 1 +ATOM 975 N N . PHE A ? 138 ? -6.203 26.378 -24.510 1.0 90.38 138 A 1 +ATOM 976 C CA . PHE A ? 138 ? -6.497 26.400 -25.940 1.0 87.08 138 A 1 +ATOM 977 C C . PHE A ? 138 ? -5.606 25.400 -26.698 1.0 85.55 138 A 1 +ATOM 978 O O . PHE A ? 138 ? -4.409 25.291 -26.429 1.0 83.55 138 A 1 +ATOM 979 C CB . PHE A ? 138 ? -6.313 27.824 -26.478 1.0 87.39 138 A 1 +ATOM 980 C CG . PHE A ? 138 ? -6.592 27.935 -27.964 1.0 86.59 138 A 1 +ATOM 981 C CD1 . PHE A ? 138 ? -5.536 27.861 -28.892 1.0 83.14 138 A 1 +ATOM 982 C CD2 . PHE A ? 138 ? -7.917 28.065 -28.431 1.0 85.98 138 A 1 +ATOM 983 C CE1 . PHE A ? 138 ? -5.802 27.924 -30.275 1.0 82.6 138 A 1 +ATOM 984 C CE2 . PHE A ? 138 ? -8.187 28.126 -29.809 1.0 85.51 138 A 1 +ATOM 985 C CZ . PHE A ? 138 ? -7.129 28.057 -30.730 1.0 86.21 138 A 1 +ATOM 986 N N . GLY A ? 139 ? -6.195 24.682 -27.637 1.0 88.16 139 A 1 +ATOM 987 C CA . GLY A ? 139 ? -5.525 23.605 -28.373 1.0 85.21 139 A 1 +ATOM 988 C C . GLY A ? 139 ? -5.679 22.222 -27.734 1.0 86.54 139 A 1 +ATOM 989 O O . GLY A ? 139 ? -5.297 21.229 -28.351 1.0 83.03 139 A 1 +ATOM 990 N N . GLY A ? 140 ? -6.263 22.137 -26.547 1.0 89.61 140 A 1 +ATOM 991 C CA . GLY A ? 140 ? -6.517 20.880 -25.850 1.0 88.91 140 A 1 +ATOM 992 C C . GLY A ? 140 ? -5.371 20.442 -24.939 1.0 89.37 140 A 1 +ATOM 993 O O . GLY A ? 140 ? -4.430 21.188 -24.657 1.0 87.57 140 A 1 +ATOM 994 N N . THR A ? 141 ? -5.474 19.203 -24.447 1.0 90.14 141 A 1 +ATOM 995 C CA . THR A ? 141 ? -4.477 18.586 -23.564 1.0 90.84 141 A 1 +ATOM 996 C C . THR A ? 141 ? -4.265 17.122 -23.938 1.0 91.77 141 A 1 +ATOM 997 O O . THR A ? 141 ? -5.085 16.522 -24.639 1.0 90.62 141 A 1 +ATOM 998 C CB . THR A ? 141 ? -4.886 18.753 -22.090 1.0 89.08 141 A 1 +ATOM 999 O OG1 . THR A ? 141 ? -3.798 18.407 -21.262 1.0 84.7 141 A 1 +ATOM 1000 C CG2 . THR A ? 141 ? -6.078 17.889 -21.673 1.0 84.41 141 A 1 +ATOM 1001 N N . LYS A ? 142 ? -3.160 16.530 -23.472 1.0 94.08 142 A 1 +ATOM 1002 C CA . LYS A ? 142 ? -2.939 15.088 -23.592 1.0 94.58 142 A 1 +ATOM 1003 C C . LYS A ? 142 ? -3.559 14.359 -22.403 1.0 95.66 142 A 1 +ATOM 1004 O O . LYS A ? 142 ? -3.378 14.765 -21.257 1.0 94.46 142 A 1 +ATOM 1005 C CB . LYS A ? 142 ? -1.445 14.766 -23.726 1.0 91.33 142 A 1 +ATOM 1006 C CG . LYS A ? 142 ? -0.939 15.027 -25.155 1.0 76.39 142 A 1 +ATOM 1007 C CD . LYS A ? 142 ? 0.520 14.579 -25.292 1.0 74.56 142 A 1 +ATOM 1008 C CE . LYS A ? 142 ? 0.978 14.705 -26.746 1.0 62.19 142 A 1 +ATOM 1009 N NZ . LYS A ? 142 ? 2.376 14.240 -26.919 1.0 55.07 142 A 1 +ATOM 1010 N N . LEU A ? 143 ? -4.233 13.254 -22.700 1.0 96.03 143 A 1 +ATOM 1011 C CA . LEU A ? 143 ? -4.587 12.265 -21.693 1.0 96.48 143 A 1 +ATOM 1012 C C . LEU A ? 143 ? -3.332 11.486 -21.280 1.0 97.18 143 A 1 +ATOM 1013 O O . LEU A ? 143 ? -2.458 11.206 -22.100 1.0 96.62 143 A 1 +ATOM 1014 C CB . LEU A ? 143 ? -5.673 11.327 -22.237 1.0 95.27 143 A 1 +ATOM 1015 C CG . LEU A ? 143 ? -7.023 12.013 -22.505 1.0 92.16 143 A 1 +ATOM 1016 C CD1 . LEU A ? 143 ? -7.965 11.024 -23.182 1.0 89.26 143 A 1 +ATOM 1017 C CD2 . LEU A ? 143 ? -7.694 12.495 -21.219 1.0 88.38 143 A 1 +ATOM 1018 N N . ILE A ? 144 ? -3.264 11.128 -20.010 1.0 96.61 144 A 1 +ATOM 1019 C CA . ILE A ? 144 ? -2.165 10.364 -19.423 1.0 97.03 144 A 1 +ATOM 1020 C C . ILE A ? 144 ? -2.577 8.892 -19.395 1.0 97.47 144 A 1 +ATOM 1021 O O . ILE A ? 144 ? -3.625 8.557 -18.852 1.0 97.45 144 A 1 +ATOM 1022 C CB . ILE A ? 144 ? -1.830 10.911 -18.017 1.0 96.89 144 A 1 +ATOM 1023 C CG1 . ILE A ? 144 ? -1.395 12.401 -18.088 1.0 95.93 144 A 1 +ATOM 1024 C CG2 . ILE A ? 144 ? -0.733 10.062 -17.352 1.0 96.15 144 A 1 +ATOM 1025 C CD1 . ILE A ? 144 ? -1.386 13.100 -16.725 1.0 93.02 144 A 1 +ATOM 1026 N N . ASP A ? 145 ? -1.754 8.003 -19.952 1.0 95.94 145 A 1 +ATOM 1027 C CA . ASP A ? 145 ? -1.992 6.563 -19.855 1.0 96.71 145 A 1 +ATOM 1028 C C . ASP A ? 145 ? -1.645 6.072 -18.442 1.0 96.93 145 A 1 +ATOM 1029 O O . ASP A ? 145 ? -0.493 6.151 -18.011 1.0 97.14 145 A 1 +ATOM 1030 C CB . ASP A ? 145 ? -1.213 5.814 -20.952 1.0 96.67 145 A 1 +ATOM 1031 C CG . ASP A ? 145 ? -1.614 4.335 -21.050 1.0 97.02 145 A 1 +ATOM 1032 O OD1 . ASP A ? 145 ? -2.052 3.745 -20.040 1.0 95.12 145 A 1 +ATOM 1033 O OD2 . ASP A ? 145 ? -1.557 3.749 -22.144 1.0 94.59 145 A 1 +ATOM 1034 N N . GLY A ? 146 ? -2.638 5.556 -17.722 1.0 97.43 146 A 1 +ATOM 1035 C CA . GLY A ? 146 ? -2.472 5.061 -16.360 1.0 97.45 146 A 1 +ATOM 1036 C C . GLY A ? 146 ? -1.520 3.870 -16.232 1.0 97.81 146 A 1 +ATOM 1037 O O . GLY A ? 146 ? -0.891 3.708 -15.187 1.0 97.84 146 A 1 +ATOM 1038 N N . ILE A ? 147 ? -1.350 3.058 -17.278 1.0 97.96 147 A 1 +ATOM 1039 C CA . ILE A ? 147 ? -0.444 1.894 -17.252 1.0 97.89 147 A 1 +ATOM 1040 C C . ILE A ? 147 ? 1.015 2.328 -17.050 1.0 97.82 147 A 1 +ATOM 1041 O O . ILE A ? 147 ? 1.607 1.943 -16.043 1.0 97.87 147 A 1 +ATOM 1042 C CB . ILE A ? 147 ? -0.610 0.987 -18.490 1.0 97.95 147 A 1 +ATOM 1043 C CG1 . ILE A ? 147 ? -2.031 0.393 -18.564 1.0 97.29 147 A 1 +ATOM 1044 C CG2 . ILE A ? 147 ? 0.440 -0.146 -18.468 1.0 97.27 147 A 1 +ATOM 1045 C CD1 . ILE A ? 147 ? -2.310 -0.340 -19.886 1.0 96.29 147 A 1 +ATOM 1046 N N . PRO A ? 148 ? 1.630 3.115 -17.950 1.0 98.17 148 A 1 +ATOM 1047 C CA . PRO A ? 148 ? 2.989 3.590 -17.706 1.0 97.87 148 A 1 +ATOM 1048 C C . PRO A ? 148 ? 3.048 4.530 -16.498 1.0 97.78 148 A 1 +ATOM 1049 O O . PRO A ? 148 ? 3.954 4.389 -15.685 1.0 97.58 148 A 1 +ATOM 1050 C CB . PRO A ? 148 ? 3.431 4.276 -19.003 1.0 97.36 148 A 1 +ATOM 1051 C CG . PRO A ? 148 ? 2.113 4.685 -19.660 1.0 95.6 148 A 1 +ATOM 1052 C CD . PRO A ? 148 ? 1.172 3.563 -19.252 1.0 97.76 148 A 1 +ATOM 1053 N N . ARG A ? 149 ? 2.086 5.435 -16.334 1.0 98.09 149 A 1 +ATOM 1054 C CA . ARG A ? 149 ? 2.122 6.474 -15.290 1.0 97.92 149 A 1 +ATOM 1055 C C . ARG A ? 149 ? 2.214 5.890 -13.883 1.0 97.93 149 A 1 +ATOM 1056 O O . ARG A ? 149 ? 3.105 6.278 -13.125 1.0 97.52 149 A 1 +ATOM 1057 C CB . ARG A ? 149 ? 0.900 7.393 -15.455 1.0 97.76 149 A 1 +ATOM 1058 C CG . ARG A ? 149 ? 0.770 8.473 -14.357 1.0 97.03 149 A 1 +ATOM 1059 C CD . ARG A ? 149 ? 2.010 9.380 -14.269 1.0 95.63 149 A 1 +ATOM 1060 N NE . ARG A ? 149 ? 1.828 10.408 -13.241 1.0 95.2 149 A 1 +ATOM 1061 C CZ . ARG A ? 149 ? 2.775 11.081 -12.622 1.0 94.94 149 A 1 +ATOM 1062 N NH1 . ARG A ? 149 ? 4.040 10.911 -12.909 1.0 90.81 149 A 1 +ATOM 1063 N NH2 . ARG A ? 149 ? 2.462 11.931 -11.693 1.0 91.56 149 A 1 +ATOM 1064 N N . ASP A ? 150 ? 1.309 4.987 -13.534 1.0 98.52 150 A 1 +ATOM 1065 C CA . ASP A ? 150 ? 1.176 4.438 -12.177 1.0 98.48 150 A 1 +ATOM 1066 C C . ASP A ? 150 ? 1.736 3.007 -12.040 1.0 98.43 150 A 1 +ATOM 1067 O O . ASP A ? 150 ? 1.907 2.519 -10.917 1.0 97.89 150 A 1 +ATOM 1068 C CB . ASP A ? 150 ? -0.300 4.497 -11.749 1.0 98.45 150 A 1 +ATOM 1069 C CG . ASP A ? 150 ? -0.846 5.921 -11.553 1.0 98.58 150 A 1 +ATOM 1070 O OD1 . ASP A ? 150 ? -0.060 6.848 -11.252 1.0 97.26 150 A 1 +ATOM 1071 O OD2 . ASP A ? 150 ? -2.080 6.095 -11.656 1.0 97.22 150 A 1 +ATOM 1072 N N . GLY A ? 151 ? 2.062 2.355 -13.156 1.0 98.56 151 A 1 +ATOM 1073 C CA . GLY A ? 151 ? 2.549 0.978 -13.180 1.0 98.45 151 A 1 +ATOM 1074 C C . GLY A ? 151 ? 4.005 0.800 -13.610 1.0 98.52 151 A 1 +ATOM 1075 O O . GLY A ? 151 ? 4.784 0.155 -12.905 1.0 97.9 151 A 1 +ATOM 1076 N N . LEU A ? 152 ? 4.386 1.350 -14.769 1.0 98.54 152 A 1 +ATOM 1077 C CA . LEU A ? 152 ? 5.594 0.927 -15.491 1.0 98.56 152 A 1 +ATOM 1078 C C . LEU A ? 152 ? 6.691 1.991 -15.642 1.0 98.51 152 A 1 +ATOM 1079 O O . LEU A ? 152 ? 7.783 1.657 -16.107 1.0 97.92 152 A 1 +ATOM 1080 C CB . LEU A ? 152 ? 5.196 0.380 -16.874 1.0 98.42 152 A 1 +ATOM 1081 C CG . LEU A ? 152 ? 4.160 -0.763 -16.875 1.0 97.94 152 A 1 +ATOM 1082 C CD1 . LEU A ? 152 ? 3.964 -1.242 -18.312 1.0 97.1 152 A 1 +ATOM 1083 C CD2 . LEU A ? 152 ? 4.592 -1.961 -16.028 1.0 96.8 152 A 1 +ATOM 1084 N N . ASN A ? 153 ? 6.440 3.255 -15.295 1.0 98.37 153 A 1 +ATOM 1085 C CA . ASN A ? 153 ? 7.427 4.332 -15.385 1.0 98.25 153 A 1 +ATOM 1086 C C . ASN A ? 153 ? 8.156 4.513 -14.052 1.0 98.23 153 A 1 +ATOM 1087 O O . ASN A ? 153 ? 7.517 4.744 -13.026 1.0 97.59 153 A 1 +ATOM 1088 C CB . ASN A ? 153 ? 6.756 5.631 -15.853 1.0 97.79 153 A 1 +ATOM 1089 C CG . ASN A ? 153 ? 7.774 6.628 -16.385 1.0 95.21 153 A 1 +ATOM 1090 O OD1 . ASN A ? 153 ? 8.453 6.365 -17.358 1.0 85.5 153 A 1 +ATOM 1091 N ND2 . ASN A ? 153 ? 7.896 7.794 -15.792 1.0 85.07 153 A 1 +ATOM 1092 N N . ASP A ? 154 ? 9.481 4.431 -14.072 1.0 98.19 154 A 1 +ATOM 1093 C CA . ASP A ? 154 ? 10.323 4.842 -12.949 1.0 98.07 154 A 1 +ATOM 1094 C C . ASP A ? 154 ? 10.260 6.370 -12.825 1.0 98.07 154 A 1 +ATOM 1095 O O . ASP A ? 154 ? 10.764 7.097 -13.681 1.0 97.33 154 A 1 +ATOM 1096 C CB . ASP A ? 154 ? 11.759 4.350 -13.164 1.0 97.51 154 A 1 +ATOM 1097 C CG . ASP A ? 154 ? 12.680 4.757 -12.012 1.0 96.59 154 A 1 +ATOM 1098 O OD1 . ASP A ? 154 ? 13.028 5.954 -11.913 1.0 91.51 154 A 1 +ATOM 1099 O OD2 . ASP A ? 154 ? 13.057 3.878 -11.215 1.0 90.97 154 A 1 +ATOM 1100 N N . VAL A ? 155 ? 9.639 6.858 -11.760 1.0 97.86 155 A 1 +ATOM 1101 C CA . VAL A ? 155 ? 9.404 8.295 -11.556 1.0 97.65 155 A 1 +ATOM 1102 C C . VAL A ? 155 ? 10.657 9.068 -11.136 1.0 97.72 155 A 1 +ATOM 1103 O O . VAL A ? 155 ? 10.642 10.293 -11.129 1.0 96.21 155 A 1 +ATOM 1104 C CB . VAL A ? 155 ? 8.279 8.541 -10.530 1.0 96.56 155 A 1 +ATOM 1105 C CG1 . VAL A ? 155 ? 6.969 7.877 -10.962 1.0 91.62 155 A 1 +ATOM 1106 C CG2 . VAL A ? 155 ? 8.656 8.036 -9.127 1.0 91.82 155 A 1 +ATOM 1107 N N . TYR A ? 156 ? 11.731 8.371 -10.755 1.0 97.41 156 A 1 +ATOM 1108 C CA . TYR A ? 156 ? 12.972 8.993 -10.279 1.0 97.11 156 A 1 +ATOM 1109 C C . TYR A ? 156 ? 13.909 9.323 -11.441 1.0 97.21 156 A 1 +ATOM 1110 O O . TYR A ? 156 ? 14.599 10.338 -11.411 1.0 95.26 156 A 1 +ATOM 1111 C CB . TYR A ? 156 ? 13.663 8.065 -9.274 1.0 96.7 156 A 1 +ATOM 1112 C CG . TYR A ? 156 ? 12.743 7.504 -8.205 1.0 97.17 156 A 1 +ATOM 1113 C CD1 . TYR A ? 156 ? 12.387 8.279 -7.080 1.0 95.23 156 A 1 +ATOM 1114 C CD2 . TYR A ? 156 ? 12.185 6.220 -8.368 1.0 95.64 156 A 1 +ATOM 1115 C CE1 . TYR A ? 156 ? 11.482 7.775 -6.131 1.0 95.0 156 A 1 +ATOM 1116 C CE2 . TYR A ? 156 ? 11.275 5.708 -7.428 1.0 94.83 156 A 1 +ATOM 1117 C CZ . TYR A ? 156 ? 10.921 6.489 -6.312 1.0 96.68 156 A 1 +ATOM 1118 O OH . TYR A ? 156 ? 10.017 5.994 -5.409 1.0 95.71 156 A 1 +ATOM 1119 N N . ASN A ? 157 ? 13.918 8.470 -12.462 1.0 97.53 157 A 1 +ATOM 1120 C CA . ASN A ? 157 ? 14.730 8.634 -13.673 1.0 97.34 157 A 1 +ATOM 1121 C C . ASN A ? 157 ? 13.887 8.992 -14.911 1.0 97.76 157 A 1 +ATOM 1122 O O . ASN A ? 157 ? 14.446 9.241 -15.972 1.0 96.65 157 A 1 +ATOM 1123 C CB . ASN A ? 157 ? 15.526 7.342 -13.897 1.0 96.78 157 A 1 +ATOM 1124 C CG . ASN A ? 157 ? 16.383 6.966 -12.697 1.0 95.14 157 A 1 +ATOM 1125 O OD1 . ASN A ? 157 ? 17.474 7.476 -12.503 1.0 87.73 157 A 1 +ATOM 1126 N ND2 . ASN A ? 157 ? 15.908 6.066 -11.860 1.0 86.81 157 A 1 +ATOM 1127 N N . ASP A ? 158 ? 12.566 8.992 -14.768 1.0 97.56 158 A 1 +ATOM 1128 C CA . ASP A ? 158 ? 11.567 9.212 -15.822 1.0 97.84 158 A 1 +ATOM 1129 C C . ASP A ? 158 ? 11.762 8.316 -17.058 1.0 98.13 158 A 1 +ATOM 1130 O O . ASP A ? 158 ? 11.735 8.752 -18.209 1.0 97.56 158 A 1 +ATOM 1131 C CB . ASP A ? 158 ? 11.404 10.715 -16.125 1.0 97.43 158 A 1 +ATOM 1132 C CG . ASP A ? 158 ? 10.086 11.017 -16.848 1.0 96.38 158 A 1 +ATOM 1133 O OD1 . ASP A ? 158 ? 9.099 10.267 -16.622 1.0 93.75 158 A 1 +ATOM 1134 O OD2 . ASP A ? 158 ? 10.038 12.021 -17.594 1.0 92.84 158 A 1 +ATOM 1135 N N . ILE A ? 159 ? 11.975 7.028 -16.801 1.0 98.34 159 A 1 +ATOM 1136 C CA . ILE A ? 159 ? 12.136 5.991 -17.825 1.0 98.42 159 A 1 +ATOM 1137 C C . ILE A ? 159 ? 11.276 4.768 -17.491 1.0 98.57 159 A 1 +ATOM 1138 O O . ILE A ? 159 ? 11.002 4.468 -16.328 1.0 98.35 159 A 1 +ATOM 1139 C CB . ILE A ? 159 ? 13.621 5.606 -18.027 1.0 98.18 159 A 1 +ATOM 1140 C CG1 . ILE A ? 159 ? 14.267 5.057 -16.738 1.0 97.38 159 A 1 +ATOM 1141 C CG2 . ILE A ? 159 ? 14.411 6.793 -18.612 1.0 96.68 159 A 1 +ATOM 1142 C CD1 . ILE A ? 159 ? 15.711 4.570 -16.899 1.0 96.24 159 A 1 +ATOM 1143 N N . LEU A ? 160 ? 10.872 4.014 -18.510 1.0 98.35 160 A 1 +ATOM 1144 C CA . LEU A ? 160 ? 10.102 2.787 -18.319 1.0 98.49 160 A 1 +ATOM 1145 C C . LEU A ? 160 ? 10.946 1.680 -17.663 1.0 98.57 160 A 1 +ATOM 1146 O O . LEU A ? 160 ? 12.166 1.633 -17.812 1.0 98.46 160 A 1 +ATOM 1147 C CB . LEU A ? 160 ? 9.523 2.325 -19.667 1.0 98.44 160 A 1 +ATOM 1148 C CG . LEU A ? 160 ? 8.449 3.263 -20.260 1.0 98.07 160 A 1 +ATOM 1149 C CD1 . LEU A ? 160 ? 8.095 2.808 -21.673 1.0 97.19 160 A 1 +ATOM 1150 C CD2 . LEU A ? 160 ? 7.159 3.263 -19.432 1.0 97.0 160 A 1 +ATOM 1151 N N . MET A ? 161 ? 10.276 0.730 -17.013 1.0 98.63 161 A 1 +ATOM 1152 C CA . MET A ? 161 ? 10.921 -0.444 -16.408 1.0 98.64 161 A 1 +ATOM 1153 C C . MET A ? 161 ? 11.854 -1.185 -17.383 1.0 98.73 161 A 1 +ATOM 1154 O O . MET A ? 161 ? 12.929 -1.626 -16.993 1.0 98.7 161 A 1 +ATOM 1155 C CB . MET A ? 161 ? 9.844 -1.416 -15.900 1.0 98.6 161 A 1 +ATOM 1156 C CG . MET A ? 161 ? 8.964 -0.878 -14.764 1.0 97.91 161 A 1 +ATOM 1157 S SD . MET A ? 161 ? 9.791 -0.579 -13.170 1.0 97.72 161 A 1 +ATOM 1158 C CE . MET A ? 161 ? 10.313 1.145 -13.370 1.0 94.54 161 A 1 +ATOM 1159 N N . GLY A ? 162 ? 11.480 -1.274 -18.649 1.0 98.71 162 A 1 +ATOM 1160 C CA . GLY A ? 162 ? 12.318 -1.901 -19.677 1.0 98.77 162 A 1 +ATOM 1161 C C . GLY A ? 162 ? 13.638 -1.163 -19.931 1.0 98.83 162 A 1 +ATOM 1162 O O . GLY A ? 162 ? 14.659 -1.807 -20.149 1.0 98.73 162 A 1 +ATOM 1163 N N . ALA A ? 163 ? 13.654 0.171 -19.830 1.0 98.75 163 A 1 +ATOM 1164 C CA . ALA A ? 163 ? 14.887 0.958 -19.928 1.0 98.75 163 A 1 +ATOM 1165 C C . ALA A ? 163 ? 15.780 0.777 -18.685 1.0 98.78 163 A 1 +ATOM 1166 O O . ALA A ? 163 ? 17.004 0.732 -18.799 1.0 98.63 163 A 1 +ATOM 1167 C CB . ALA A ? 163 ? 14.512 2.426 -20.165 1.0 98.69 163 A 1 +ATOM 1168 N N . CYS A ? 164 ? 15.183 0.589 -17.507 1.0 98.76 164 A 1 +ATOM 1169 C CA . CYS A ? 164 ? 15.920 0.184 -16.308 1.0 98.74 164 A 1 +ATOM 1170 C C . CYS A ? 164 ? 16.562 -1.207 -16.490 1.0 98.79 164 A 1 +ATOM 1171 O O . CYS A ? 164 ? 17.719 -1.408 -16.121 1.0 98.71 164 A 1 +ATOM 1172 C CB . CYS A ? 164 ? 14.982 0.180 -15.090 1.0 98.69 164 A 1 +ATOM 1173 S SG . CYS A ? 164 ? 14.187 1.790 -14.817 1.0 98.4 164 A 1 +ATOM 1174 N N . ALA A ? 165 ? 15.835 -2.149 -17.104 1.0 98.77 165 A 1 +ATOM 1175 C CA . ALA A ? 165 ? 16.361 -3.480 -17.414 1.0 98.8 165 A 1 +ATOM 1176 C C . ALA A ? 165 ? 17.511 -3.430 -18.439 1.0 98.82 165 A 1 +ATOM 1177 O O . ALA A ? 165 ? 18.512 -4.121 -18.254 1.0 98.75 165 A 1 +ATOM 1178 C CB . ALA A ? 165 ? 15.207 -4.370 -17.885 1.0 98.76 165 A 1 +ATOM 1179 N N . ASP A ? 166 ? 17.422 -2.570 -19.461 1.0 98.79 166 A 1 +ATOM 1180 C CA . ASP A ? 166 ? 18.516 -2.318 -20.415 1.0 98.77 166 A 1 +ATOM 1181 C C . ASP A ? 166 ? 19.790 -1.832 -19.705 1.0 98.75 166 A 1 +ATOM 1182 O O . ASP A ? 166 ? 20.888 -2.319 -19.986 1.0 98.59 166 A 1 +ATOM 1183 C CB . ASP A ? 166 ? 18.090 -1.257 -21.450 1.0 98.66 166 A 1 +ATOM 1184 C CG . ASP A ? 166 ? 17.261 -1.790 -22.619 1.0 98.52 166 A 1 +ATOM 1185 O OD1 . ASP A ? 166 ? 17.405 -2.982 -22.970 1.0 96.69 166 A 1 +ATOM 1186 O OD2 . ASP A ? 166 ? 16.559 -0.971 -23.255 1.0 96.98 166 A 1 +ATOM 1187 N N . LYS A ? 167 ? 19.652 -0.902 -18.744 1.0 98.72 167 A 1 +ATOM 1188 C CA . LYS A ? 167 ? 20.776 -0.407 -17.940 1.0 98.6 167 A 1 +ATOM 1189 C C . LYS A ? 167 ? 21.430 -1.538 -17.141 1.0 98.67 167 A 1 +ATOM 1190 O O . LYS A ? 167 ? 22.653 -1.674 -17.169 1.0 98.4 167 A 1 +ATOM 1191 C CB . LYS A ? 167 ? 20.292 0.758 -17.055 1.0 98.23 167 A 1 +ATOM 1192 C CG . LYS A ? 167 ? 21.382 1.365 -16.142 1.0 96.46 167 A 1 +ATOM 1193 C CD . LYS A ? 167 ? 21.375 0.752 -14.727 1.0 92.74 167 A 1 +ATOM 1194 C CE . LYS A ? 167 ? 22.428 1.401 -13.827 1.0 90.06 167 A 1 +ATOM 1195 N NZ . LYS A ? 167 ? 22.345 0.913 -12.435 1.0 85.08 167 A 1 +ATOM 1196 N N . VAL A ? 168 ? 20.639 -2.362 -16.463 1.0 98.7 168 A 1 +ATOM 1197 C CA . VAL A ? 168 ? 21.140 -3.515 -15.693 1.0 98.71 168 A 1 +ATOM 1198 C C . VAL A ? 168 ? 21.850 -4.512 -16.612 1.0 98.75 168 A 1 +ATOM 1199 O O . VAL A ? 168 ? 22.973 -4.918 -16.319 1.0 98.65 168 A 1 +ATOM 1200 C CB . VAL A ? 168 ? 20.000 -4.184 -14.897 1.0 98.58 168 A 1 +ATOM 1201 C CG1 . VAL A ? 168 ? 20.422 -5.510 -14.249 1.0 97.78 168 A 1 +ATOM 1202 C CG2 . VAL A ? 168 ? 19.520 -3.261 -13.766 1.0 97.83 168 A 1 +ATOM 1203 N N . ALA A ? 169 ? 21.249 -4.849 -17.757 1.0 98.79 169 A 1 +ATOM 1204 C CA . ALA A ? 169 ? 21.848 -5.762 -18.728 1.0 98.8 169 A 1 +ATOM 1205 C C . ALA A ? 169 ? 23.216 -5.263 -19.222 1.0 98.76 169 A 1 +ATOM 1206 O O . ALA A ? 169 ? 24.183 -6.027 -19.247 1.0 98.58 169 A 1 +ATOM 1207 C CB . ALA A ? 169 ? 20.872 -5.940 -19.895 1.0 98.74 169 A 1 +ATOM 1208 N N . LYS A ? 170 ? 23.319 -3.973 -19.541 1.0 98.71 170 A 1 +ATOM 1209 C CA . LYS A ? 170 ? 24.567 -3.348 -20.002 1.0 98.6 170 A 1 +ATOM 1210 C C . LYS A ? 170 ? 25.624 -3.308 -18.896 1.0 98.55 170 A 1 +ATOM 1211 O O . LYS A ? 170 ? 26.779 -3.640 -19.142 1.0 98.1 170 A 1 +ATOM 1212 C CB . LYS A ? 170 ? 24.241 -1.953 -20.572 1.0 98.27 170 A 1 +ATOM 1213 C CG . LYS A ? 170 ? 25.358 -1.378 -21.473 1.0 93.94 170 A 1 +ATOM 1214 C CD . LYS A ? 170 ? 24.884 -0.085 -22.166 1.0 88.74 170 A 1 +ATOM 1215 C CE . LYS A ? 170 ? 25.890 0.410 -23.225 1.0 77.86 170 A 1 +ATOM 1216 N NZ . LYS A ? 170 ? 25.357 1.532 -24.060 1.0 67.82 170 A 1 +ATOM 1217 N N . GLN A ? 171 ? 25.227 -2.947 -17.679 1.0 98.55 171 A 1 +ATOM 1218 C CA . GLN A ? 171 ? 26.142 -2.843 -16.536 1.0 98.4 171 A 1 +ATOM 1219 C C . GLN A ? 171 ? 26.736 -4.197 -16.121 1.0 98.39 171 A 1 +ATOM 1220 O O . GLN A ? 171 ? 27.913 -4.272 -15.771 1.0 97.81 171 A 1 +ATOM 1221 C CB . GLN A ? 171 ? 25.397 -2.180 -15.368 1.0 98.1 171 A 1 +ATOM 1222 C CG . GLN A ? 171 ? 26.302 -2.005 -14.131 1.0 96.15 171 A 1 +ATOM 1223 C CD . GLN A ? 171 ? 25.624 -1.260 -12.982 1.0 95.34 171 A 1 +ATOM 1224 O OE1 . GLN A ? 171 ? 24.561 -0.673 -13.106 1.0 89.54 171 A 1 +ATOM 1225 N NE2 . GLN A ? 171 ? 26.220 -1.242 -11.817 1.0 88.18 171 A 1 +ATOM 1226 N N . PHE A ? 172 ? 25.944 -5.260 -16.162 1.0 98.53 172 A 1 +ATOM 1227 C CA . PHE A ? 172 ? 26.339 -6.594 -15.701 1.0 98.39 172 A 1 +ATOM 1228 C C . PHE A ? 172 ? 26.610 -7.584 -16.843 1.0 98.37 172 A 1 +ATOM 1229 O O . PHE A ? 172 ? 26.688 -8.790 -16.608 1.0 97.63 172 A 1 +ATOM 1230 C CB . PHE A ? 172 ? 25.306 -7.103 -14.693 1.0 98.22 172 A 1 +ATOM 1231 C CG . PHE A ? 172 ? 25.208 -6.250 -13.446 1.0 97.99 172 A 1 +ATOM 1232 C CD1 . PHE A ? 172 ? 26.223 -6.300 -12.472 1.0 96.29 172 A 1 +ATOM 1233 C CD2 . PHE A ? 172 ? 24.110 -5.391 -13.253 1.0 96.47 172 A 1 +ATOM 1234 C CE1 . PHE A ? 172 ? 26.140 -5.506 -11.318 1.0 95.35 172 A 1 +ATOM 1235 C CE2 . PHE A ? 172 ? 24.022 -4.590 -12.099 1.0 95.33 172 A 1 +ATOM 1236 C CZ . PHE A ? 172 ? 25.038 -4.648 -11.130 1.0 95.89 172 A 1 +ATOM 1237 N N . ALA A ? 173 ? 26.778 -7.084 -18.074 1.0 98.38 173 A 1 +ATOM 1238 C CA . ALA A ? 173 ? 27.103 -7.867 -19.270 1.0 98.32 173 A 1 +ATOM 1239 C C . ALA A ? 173 ? 26.150 -9.059 -19.522 1.0 98.47 173 A 1 +ATOM 1240 O O . ALA A ? 173 ? 26.581 -10.135 -19.937 1.0 97.65 173 A 1 +ATOM 1241 C CB . ALA A ? 173 ? 28.596 -8.228 -19.244 1.0 97.77 173 A 1 +ATOM 1242 N N . ILE A ? 174 ? 24.857 -8.872 -19.295 1.0 98.66 174 A 1 +ATOM 1243 C CA . ILE A ? 174 ? 23.815 -9.832 -19.681 1.0 98.75 174 A 1 +ATOM 1244 C C . ILE A ? 174 ? 23.456 -9.568 -21.148 1.0 98.78 174 A 1 +ATOM 1245 O O . ILE A ? 174 ? 22.709 -8.643 -21.468 1.0 98.55 174 A 1 +ATOM 1246 C CB . ILE A ? 174 ? 22.584 -9.750 -18.753 1.0 98.64 174 A 1 +ATOM 1247 C CG1 . ILE A ? 174 ? 22.922 -9.792 -17.245 1.0 97.36 174 A 1 +ATOM 1248 C CG2 . ILE A ? 174 ? 21.585 -10.866 -19.112 1.0 98.08 174 A 1 +ATOM 1249 C CD1 . ILE A ? 174 ? 23.599 -11.068 -16.753 1.0 91.97 174 A 1 +ATOM 1250 N N . THR A ? 175 ? 24.010 -10.356 -22.053 1.0 98.65 175 A 1 +ATOM 1251 C CA . THR A ? 175 ? 23.953 -10.098 -23.496 1.0 98.65 175 A 1 +ATOM 1252 C C . THR A ? 175 ? 22.553 -10.281 -24.082 1.0 98.76 175 A 1 +ATOM 1253 O O . THR A ? 175 ? 21.686 -10.952 -23.517 1.0 98.62 175 A 1 +ATOM 1254 C CB . THR A ? 175 ? 24.950 -10.973 -24.270 1.0 98.35 175 A 1 +ATOM 1255 O OG1 . THR A ? 175 ? 24.587 -12.326 -24.172 1.0 96.37 175 A 1 +ATOM 1256 C CG2 . THR A ? 175 ? 26.390 -10.816 -23.776 1.0 95.81 175 A 1 +ATOM 1257 N N . ARG A ? 176 ? 22.327 -9.707 -25.269 1.0 98.58 176 A 1 +ATOM 1258 C CA . ARG A ? 176 ? 21.106 -9.906 -26.052 1.0 98.64 176 A 1 +ATOM 1259 C C . ARG A ? 176 ? 20.885 -11.384 -26.386 1.0 98.76 176 A 1 +ATOM 1260 O O . ARG A ? 176 ? 19.767 -11.865 -26.221 1.0 98.63 176 A 1 +ATOM 1261 C CB . ARG A ? 176 ? 21.178 -9.030 -27.310 1.0 98.14 176 A 1 +ATOM 1262 C CG . ARG A ? 176 ? 20.049 -9.291 -28.313 1.0 96.58 176 A 1 +ATOM 1263 C CD . ARG A ? 176 ? 18.646 -9.019 -27.754 1.0 95.2 176 A 1 +ATOM 1264 N NE . ARG A ? 176 ? 17.635 -9.402 -28.736 1.0 94.98 176 A 1 +ATOM 1265 C CZ . ARG A ? 176 ? 17.210 -8.705 -29.785 1.0 96.37 176 A 1 +ATOM 1266 N NH1 . ARG A ? 176 ? 17.599 -7.485 -30.021 1.0 91.74 176 A 1 +ATOM 1267 N NH2 . ARG A ? 176 ? 16.391 -9.260 -30.617 1.0 93.42 176 A 1 +ATOM 1268 N N . GLU A ? 177 ? 21.941 -12.095 -26.810 1.0 98.66 177 A 1 +ATOM 1269 C CA . GLU A ? 177 ? 21.853 -13.534 -27.090 1.0 98.64 177 A 1 +ATOM 1270 C C . GLU A ? 177 ? 21.413 -14.340 -25.865 1.0 98.76 177 A 1 +ATOM 1271 O O . GLU A ? 177 ? 20.580 -15.231 -25.992 1.0 98.6 177 A 1 +ATOM 1272 C CB . GLU A ? 177 ? 23.198 -14.100 -27.569 1.0 98.26 177 A 1 +ATOM 1273 C CG . GLU A ? 177 ? 23.463 -13.921 -29.069 1.0 84.07 177 A 1 +ATOM 1274 C CD . GLU A ? 177 ? 24.264 -12.675 -29.445 1.0 76.26 177 A 1 +ATOM 1275 O OE1 . GLU A ? 177 ? 24.463 -12.496 -30.671 1.0 69.55 177 A 1 +ATOM 1276 O OE2 . GLU A ? 177 ? 24.649 -11.900 -28.534 1.0 69.86 177 A 1 +ATOM 1277 N N . GLU A ? 178 ? 21.944 -14.040 -24.679 1.0 98.74 178 A 1 +ATOM 1278 C CA . GLU A ? 178 ? 21.550 -14.735 -23.448 1.0 98.72 178 A 1 +ATOM 1279 C C . GLU A ? 178 ? 20.077 -14.485 -23.102 1.0 98.82 178 A 1 +ATOM 1280 O O . GLU A ? 178 ? 19.359 -15.429 -22.770 1.0 98.72 178 A 1 +ATOM 1281 C CB . GLU A ? 178 ? 22.439 -14.292 -22.279 1.0 98.46 178 A 1 +ATOM 1282 C CG . GLU A ? 178 ? 23.859 -14.872 -22.364 1.0 94.16 178 A 1 +ATOM 1283 C CD . GLU A ? 178 ? 24.724 -14.357 -21.207 1.0 94.34 178 A 1 +ATOM 1284 O OE1 . GLU A ? 178 ? 25.343 -15.192 -20.509 1.0 86.49 178 A 1 +ATOM 1285 O OE2 . GLU A ? 178 ? 24.761 -13.133 -20.952 1.0 88.71 178 A 1 +ATOM 1286 N N . GLN A ? 179 ? 19.617 -13.241 -23.228 1.0 98.85 179 A 1 +ATOM 1287 C CA . GLN A ? 179 ? 18.223 -12.873 -22.964 1.0 98.87 179 A 1 +ATOM 1288 C C . GLN A ? 179 ? 17.262 -13.559 -23.941 1.0 98.89 179 A 1 +ATOM 1289 O O . GLN A ? 179 ? 16.252 -14.118 -23.521 1.0 98.84 179 A 1 +ATOM 1290 C CB . GLN A ? 179 ? 18.061 -11.349 -23.034 1.0 98.84 179 A 1 +ATOM 1291 C CG . GLN A ? 179 ? 18.747 -10.618 -21.873 1.0 98.66 179 A 1 +ATOM 1292 C CD . GLN A ? 179 ? 18.700 -9.109 -22.060 1.0 98.66 179 A 1 +ATOM 1293 O OE1 . GLN A ? 179 ? 17.650 -8.499 -22.201 1.0 93.23 179 A 1 +ATOM 1294 N NE2 . GLN A ? 179 ? 19.833 -8.452 -22.086 1.0 93.39 179 A 1 +ATOM 1295 N N . ASP A ? 180 ? 17.588 -13.567 -25.239 1.0 98.82 180 A 1 +ATOM 1296 C CA . ASP A ? 180 ? 16.765 -14.223 -26.260 1.0 98.81 180 A 1 +ATOM 1297 C C . ASP A ? 180 ? 16.755 -15.750 -26.080 1.0 98.8 180 A 1 +ATOM 1298 O O . ASP A ? 180 ? 15.709 -16.388 -26.189 1.0 98.65 180 A 1 +ATOM 1299 C CB . ASP A ? 180 ? 17.271 -13.841 -27.664 1.0 98.73 180 A 1 +ATOM 1300 C CG . ASP A ? 180 ? 16.930 -12.409 -28.108 1.0 98.68 180 A 1 +ATOM 1301 O OD1 . ASP A ? 180 ? 16.195 -11.682 -27.406 1.0 97.6 180 A 1 +ATOM 1302 O OD2 . ASP A ? 180 ? 17.350 -12.019 -29.221 1.0 97.64 180 A 1 +ATOM 1303 N N . LYS A ? 181 ? 17.902 -16.348 -25.745 1.0 98.82 181 A 1 +ATOM 1304 C CA . LYS A ? 181 ? 18.006 -17.784 -25.461 1.0 98.77 181 A 1 +ATOM 1305 C C . LYS A ? 181 ? 17.169 -18.176 -24.239 1.0 98.82 181 A 1 +ATOM 1306 O O . LYS A ? 181 ? 16.477 -19.192 -24.272 1.0 98.67 181 A 1 +ATOM 1307 C CB . LYS A ? 181 ? 19.488 -18.140 -25.280 1.0 98.4 181 A 1 +ATOM 1308 C CG . LYS A ? 181 ? 19.752 -19.650 -25.357 1.0 89.41 181 A 1 +ATOM 1309 C CD . LYS A ? 181 ? 21.251 -19.906 -25.162 1.0 86.56 181 A 1 +ATOM 1310 C CE . LYS A ? 181 ? 21.571 -21.397 -25.286 1.0 72.61 181 A 1 +ATOM 1311 N NZ . LYS A ? 181 ? 22.993 -21.663 -24.956 1.0 64.79 181 A 1 +ATOM 1312 N N . TYR A ? 182 ? 17.196 -17.352 -23.189 1.0 98.83 182 A 1 +ATOM 1313 C CA . TYR A ? 182 ? 16.360 -17.554 -22.004 1.0 98.86 182 A 1 +ATOM 1314 C C . TYR A ? 182 ? 14.866 -17.395 -22.324 1.0 98.89 182 A 1 +ATOM 1315 O O . TYR A ? 182 ? 14.065 -18.223 -21.903 1.0 98.83 182 A 1 +ATOM 1316 C CB . TYR A ? 182 ? 16.799 -16.593 -20.894 1.0 98.81 182 A 1 +ATOM 1317 C CG . TYR A ? 182 ? 16.067 -16.859 -19.598 1.0 98.82 182 A 1 +ATOM 1318 C CD1 . TYR A ? 182 ? 14.800 -16.293 -19.366 1.0 98.58 182 A 1 +ATOM 1319 C CD2 . TYR A ? 182 ? 16.608 -17.753 -18.650 1.0 98.6 182 A 1 +ATOM 1320 C CE1 . TYR A ? 182 ? 14.071 -16.631 -18.215 1.0 98.41 182 A 1 +ATOM 1321 C CE2 . TYR A ? 182 ? 15.888 -18.099 -17.495 1.0 98.35 182 A 1 +ATOM 1322 C CZ . TYR A ? 182 ? 14.611 -17.543 -17.288 1.0 98.53 182 A 1 +ATOM 1323 O OH . TYR A ? 182 ? 13.884 -17.913 -16.188 1.0 98.0 182 A 1 +ATOM 1324 N N . ALA A ? 183 ? 14.496 -16.391 -23.120 1.0 98.87 183 A 1 +ATOM 1325 C CA . ALA A ? 183 ? 13.114 -16.204 -23.559 1.0 98.87 183 A 1 +ATOM 1326 C C . ALA A ? 183 ? 12.602 -17.426 -24.339 1.0 98.87 183 A 1 +ATOM 1327 O O . ALA A ? 183 ? 11.532 -17.952 -24.038 1.0 98.81 183 A 1 +ATOM 1328 C CB . ALA A ? 183 ? 13.031 -14.922 -24.393 1.0 98.82 183 A 1 +ATOM 1329 N N . ILE A ? 184 ? 13.394 -17.945 -25.279 1.0 98.84 184 A 1 +ATOM 1330 C CA . ILE A ? 184 ? 13.077 -19.180 -26.016 1.0 98.8 184 A 1 +ATOM 1331 C C . ILE A ? 184 ? 12.887 -20.360 -25.052 1.0 98.81 184 A 1 +ATOM 1332 O O . ILE A ? 184 ? 11.957 -21.150 -25.229 1.0 98.67 184 A 1 +ATOM 1333 C CB . ILE A ? 184 ? 14.178 -19.474 -27.065 1.0 98.67 184 A 1 +ATOM 1334 C CG1 . ILE A ? 184 ? 14.104 -18.441 -28.218 1.0 98.07 184 A 1 +ATOM 1335 C CG2 . ILE A ? 184 ? 14.068 -20.906 -27.634 1.0 98.21 184 A 1 +ATOM 1336 C CD1 . ILE A ? 184 ? 15.344 -18.425 -29.126 1.0 95.75 184 A 1 +ATOM 1337 N N . LEU A ? 185 ? 13.746 -20.486 -24.034 1.0 98.74 185 A 1 +ATOM 1338 C CA . LEU A ? 185 ? 13.623 -21.525 -23.013 1.0 98.73 185 A 1 +ATOM 1339 C C . LEU A ? 185 ? 12.317 -21.375 -22.219 1.0 98.81 185 A 1 +ATOM 1340 O O . LEU A ? 185 ? 11.609 -22.365 -22.047 1.0 98.74 185 A 1 +ATOM 1341 C CB . LEU A ? 185 ? 14.865 -21.488 -22.106 1.0 98.58 185 A 1 +ATOM 1342 C CG . LEU A ? 185 ? 14.878 -22.562 -21.002 1.0 97.36 185 A 1 +ATOM 1343 C CD1 . LEU A ? 185 ? 14.929 -23.978 -21.576 1.0 95.37 185 A 1 +ATOM 1344 C CD2 . LEU A ? 185 ? 16.102 -22.354 -20.113 1.0 95.42 185 A 1 +ATOM 1345 N N . SER A ? 186 ? 11.962 -20.159 -21.806 1.0 98.8 186 A 1 +ATOM 1346 C CA . SER A ? 186 ? 10.705 -19.864 -21.110 1.0 98.85 186 A 1 +ATOM 1347 C C . SER A ? 186 ? 9.490 -20.285 -21.948 1.0 98.87 186 A 1 +ATOM 1348 O O . SER A ? 186 ? 8.653 -21.051 -21.472 1.0 98.83 186 A 1 +ATOM 1349 C CB . SER A ? 186 ? 10.644 -18.372 -20.750 1.0 98.85 186 A 1 +ATOM 1350 O OG . SER A ? 186 ? 9.528 -18.113 -19.916 1.0 98.57 186 A 1 +ATOM 1351 N N . TYR A ? 187 ? 9.435 -19.899 -23.221 1.0 98.86 187 A 1 +ATOM 1352 C CA . TYR A ? 187 ? 8.348 -20.290 -24.135 1.0 98.84 187 A 1 +ATOM 1353 C C . TYR A ? 187 ? 8.269 -21.808 -24.360 1.0 98.82 187 A 1 +ATOM 1354 O O . TYR A ? 187 ? 7.175 -22.365 -24.429 1.0 98.64 187 A 1 +ATOM 1355 C CB . TYR A ? 187 ? 8.507 -19.571 -25.480 1.0 98.78 187 A 1 +ATOM 1356 C CG . TYR A ? 187 ? 7.938 -18.168 -25.499 1.0 98.7 187 A 1 +ATOM 1357 C CD1 . TYR A ? 187 ? 6.545 -17.974 -25.576 1.0 97.93 187 A 1 +ATOM 1358 C CD2 . TYR A ? 187 ? 8.787 -17.045 -25.440 1.0 98.15 187 A 1 +ATOM 1359 C CE1 . TYR A ? 187 ? 6.006 -16.678 -25.585 1.0 97.79 187 A 1 +ATOM 1360 C CE2 . TYR A ? 187 ? 8.259 -15.742 -25.446 1.0 97.63 187 A 1 +ATOM 1361 C CZ . TYR A ? 187 ? 6.866 -15.562 -25.516 1.0 97.98 187 A 1 +ATOM 1362 O OH . TYR A ? 187 ? 6.345 -14.292 -25.507 1.0 96.85 187 A 1 +ATOM 1363 N N . LYS A ? 188 ? 9.411 -22.498 -24.461 1.0 98.77 188 A 1 +ATOM 1364 C CA . LYS A ? 188 ? 9.427 -23.965 -24.593 1.0 98.72 188 A 1 +ATOM 1365 C C . LYS A ? 188 ? 8.937 -24.652 -23.318 1.0 98.77 188 A 1 +ATOM 1366 O O . LYS A ? 188 ? 8.170 -25.611 -23.404 1.0 98.58 188 A 1 +ATOM 1367 C CB . LYS A ? 188 ? 10.828 -24.452 -24.979 1.0 98.62 188 A 1 +ATOM 1368 C CG . LYS A ? 188 ? 11.137 -24.156 -26.457 1.0 97.04 188 A 1 +ATOM 1369 C CD . LYS A ? 188 ? 12.538 -24.656 -26.823 1.0 91.84 188 A 1 +ATOM 1370 C CE . LYS A ? 188 ? 12.792 -24.400 -28.311 1.0 87.49 188 A 1 +ATOM 1371 N NZ . LYS A ? 188 ? 14.123 -24.891 -28.744 1.0 77.85 188 A 1 +ATOM 1372 N N . ARG A ? 189 ? 9.343 -24.158 -22.154 1.0 98.85 189 A 1 +ATOM 1373 C CA . ARG A ? 189 ? 8.938 -24.702 -20.850 1.0 98.86 189 A 1 +ATOM 1374 C C . ARG A ? 189 ? 7.449 -24.483 -20.572 1.0 98.88 189 A 1 +ATOM 1375 O O . ARG A ? 189 ? 6.782 -25.435 -20.176 1.0 98.75 189 A 1 +ATOM 1376 C CB . ARG A ? 189 ? 9.794 -24.075 -19.747 1.0 98.69 189 A 1 +ATOM 1377 C CG . ARG A ? 189 ? 11.209 -24.672 -19.690 1.0 98.13 189 A 1 +ATOM 1378 C CD . ARG A ? 189 ? 12.027 -23.903 -18.655 1.0 97.17 189 A 1 +ATOM 1379 N NE . ARG A ? 189 ? 13.301 -24.574 -18.320 1.0 95.67 189 A 1 +ATOM 1380 C CZ . ARG A ? 189 ? 14.187 -24.128 -17.447 1.0 95.37 189 A 1 +ATOM 1381 N NH1 . ARG A ? 189 ? 14.046 -22.983 -16.844 1.0 90.41 189 A 1 +ATOM 1382 N NH2 . ARG A ? 189 ? 15.232 -24.835 -17.149 1.0 91.04 189 A 1 +ATOM 1383 N N . SER A ? 190 ? 6.917 -23.294 -20.827 1.0 98.88 190 A 1 +ATOM 1384 C CA . SER A ? 190 ? 5.486 -23.019 -20.644 1.0 98.85 190 A 1 +ATOM 1385 C C . SER A ? 190 ? 4.612 -23.846 -21.591 1.0 98.87 190 A 1 +ATOM 1386 O O . SER A ? 190 ? 3.625 -24.435 -21.153 1.0 98.71 190 A 1 +ATOM 1387 C CB . SER A ? 190 ? 5.194 -21.523 -20.794 1.0 98.54 190 A 1 +ATOM 1388 O OG . SER A ? 190 ? 5.606 -21.040 -22.055 1.0 91.0 190 A 1 +ATOM 1389 N N . ALA A ? 191 ? 5.013 -23.985 -22.859 1.0 98.77 191 A 1 +ATOM 1390 C CA . ALA A ? 191 ? 4.306 -24.835 -23.818 1.0 98.71 191 A 1 +ATOM 1391 C C . ALA A ? 191 ? 4.324 -26.320 -23.404 1.0 98.73 191 A 1 +ATOM 1392 O O . ALA A ? 191 ? 3.303 -26.998 -23.511 1.0 98.53 191 A 1 +ATOM 1393 C CB . ALA A ? 191 ? 4.921 -24.632 -25.208 1.0 98.51 191 A 1 +ATOM 1394 N N . ALA A ? 192 ? 5.459 -26.819 -22.909 1.0 98.72 192 A 1 +ATOM 1395 C CA . ALA A ? 192 ? 5.552 -28.181 -22.384 1.0 98.71 192 A 1 +ATOM 1396 C C . ALA A ? 192 ? 4.668 -28.368 -21.140 1.0 98.72 192 A 1 +ATOM 1397 O O . ALA A ? 192 ? 3.911 -29.335 -21.078 1.0 98.5 192 A 1 +ATOM 1398 C CB . ALA A ? 192 ? 7.023 -28.509 -22.103 1.0 98.63 192 A 1 +ATOM 1399 N N . ALA A ? 193 ? 4.697 -27.415 -20.201 1.0 98.8 193 A 1 +ATOM 1400 C CA . ALA A ? 193 ? 3.880 -27.449 -18.989 1.0 98.79 193 A 1 +ATOM 1401 C C . ALA A ? 193 ? 2.374 -27.471 -19.302 1.0 98.77 193 A 1 +ATOM 1402 O O . ALA A ? 193 ? 1.641 -28.285 -18.739 1.0 98.55 193 A 1 +ATOM 1403 C CB . ALA A ? 193 ? 4.254 -26.240 -18.125 1.0 98.71 193 A 1 +ATOM 1404 N N . TRP A ? 194 ? 1.917 -26.641 -20.237 1.0 98.73 194 A 1 +ATOM 1405 C CA . TRP A ? 194 ? 0.528 -26.662 -20.707 1.0 98.67 194 A 1 +ATOM 1406 C C . TRP A ? 194 ? 0.158 -27.990 -21.370 1.0 98.54 194 A 1 +ATOM 1407 O O . TRP A ? 194 ? -0.889 -28.559 -21.076 1.0 98.01 194 A 1 +ATOM 1408 C CB . TRP A ? 194 ? 0.285 -25.478 -21.648 1.0 98.56 194 A 1 +ATOM 1409 C CG . TRP A ? 194 ? -0.255 -24.280 -20.933 1.0 98.46 194 A 1 +ATOM 1410 C CD1 . TRP A ? 194 ? 0.418 -23.155 -20.608 1.0 97.77 194 A 1 +ATOM 1411 C CD2 . TRP A ? 194 ? -1.597 -24.130 -20.378 1.0 98.35 194 A 1 +ATOM 1412 N NE1 . TRP A ? 194 ? -0.406 -22.307 -19.883 1.0 97.66 194 A 1 +ATOM 1413 C CE2 . TRP A ? 194 ? -1.648 -22.879 -19.699 1.0 97.87 194 A 1 +ATOM 1414 C CE3 . TRP A ? 194 ? -2.751 -24.940 -20.358 1.0 97.71 194 A 1 +ATOM 1415 C CZ2 . TRP A ? 194 ? -2.795 -22.463 -18.989 1.0 97.07 194 A 1 +ATOM 1416 C CZ3 . TRP A ? 194 ? -3.902 -24.521 -19.658 1.0 96.83 194 A 1 +ATOM 1417 C CH2 . TRP A ? 194 ? -3.914 -23.304 -18.970 1.0 96.71 194 A 1 +ATOM 1418 N N . LYS A ? 195 ? 1.048 -28.530 -22.223 1.0 98.37 195 A 1 +ATOM 1419 C CA . LYS A ? 195 ? 0.831 -29.810 -22.905 1.0 98.22 195 A 1 +ATOM 1420 C C . LYS A ? 195 ? 0.735 -30.989 -21.931 1.0 98.16 195 A 1 +ATOM 1421 O O . LYS A ? 195 ? -0.034 -31.915 -22.178 1.0 97.55 195 A 1 +ATOM 1422 C CB . LYS A ? 195 ? 1.958 -30.008 -23.923 1.0 97.98 195 A 1 +ATOM 1423 C CG . LYS A ? 195 ? 1.698 -31.214 -24.839 1.0 93.7 195 A 1 +ATOM 1424 C CD . LYS A ? 195 ? 2.851 -31.377 -25.830 1.0 89.13 195 A 1 +ATOM 1425 C CE . LYS A ? 195 ? 2.578 -32.593 -26.719 1.0 78.99 195 A 1 +ATOM 1426 N NZ . LYS A ? 195 ? 3.714 -32.864 -27.624 1.0 70.35 195 A 1 +ATOM 1427 N N . GLU A ? 196 ? 1.488 -30.947 -20.835 1.0 98.52 196 A 1 +ATOM 1428 C CA . GLU A ? 196 ? 1.470 -31.971 -19.780 1.0 98.33 196 A 1 +ATOM 1429 C C . GLU A ? 196 ? 0.358 -31.757 -18.734 1.0 98.29 196 A 1 +ATOM 1430 O O . GLU A ? 196 ? 0.194 -32.573 -17.830 1.0 97.35 196 A 1 +ATOM 1431 C CB . GLU A ? 196 ? 2.850 -32.067 -19.111 1.0 97.93 196 A 1 +ATOM 1432 C CG . GLU A ? 196 ? 3.949 -32.521 -20.085 1.0 91.82 196 A 1 +ATOM 1433 C CD . GLU A ? 196 ? 4.916 -33.563 -19.519 1.0 83.73 196 A 1 +ATOM 1434 O OE1 . GLU A ? 196 ? 5.605 -34.201 -20.353 1.0 73.65 196 A 1 +ATOM 1435 O OE2 . GLU A ? 196 ? 4.943 -33.770 -18.280 1.0 75.26 196 A 1 +ATOM 1436 N N . GLY A ? 197 ? -0.416 -30.678 -18.836 1.0 98.32 197 A 1 +ATOM 1437 C CA . GLY A ? 197 ? -1.498 -30.377 -17.894 1.0 98.08 197 A 1 +ATOM 1438 C C . GLY A ? 197 ? -1.022 -29.950 -16.502 1.0 98.24 197 A 1 +ATOM 1439 O O . GLY A ? 197 ? -1.776 -30.071 -15.534 1.0 97.23 197 A 1 +ATOM 1440 N N . ILE A ? 198 ? 0.203 -29.436 -16.384 1.0 98.43 198 A 1 +ATOM 1441 C CA . ILE A ? 198 ? 0.818 -29.029 -15.105 1.0 98.36 198 A 1 +ATOM 1442 C C . ILE A ? 198 ? -0.044 -28.021 -14.339 1.0 98.3 198 A 1 +ATOM 1443 O O . ILE A ? 198 ? -0.168 -28.110 -13.118 1.0 97.4 198 A 1 +ATOM 1444 C CB . ILE A ? 198 ? 2.234 -28.467 -15.372 1.0 98.01 198 A 1 +ATOM 1445 C CG1 . ILE A ? 198 ? 3.202 -29.544 -15.918 1.0 96.46 198 A 1 +ATOM 1446 C CG2 . ILE A ? 198 ? 2.844 -27.789 -14.130 1.0 96.88 198 A 1 +ATOM 1447 C CD1 . ILE A ? 198 ? 3.540 -30.694 -14.963 1.0 92.67 198 A 1 +ATOM 1448 N N . PHE A ? 199 ? -0.683 -27.089 -15.045 1.0 98.47 199 A 1 +ATOM 1449 C CA . PHE A ? 199 ? -1.476 -26.017 -14.443 1.0 98.36 199 A 1 +ATOM 1450 C C . PHE A ? 199 ? -2.902 -26.433 -14.051 1.0 98.06 199 A 1 +ATOM 1451 O O . PHE A ? 199 ? -3.614 -25.649 -13.428 1.0 96.86 199 A 1 +ATOM 1452 C CB . PHE A ? 199 ? -1.470 -24.804 -15.378 1.0 98.25 199 A 1 +ATOM 1453 C CG . PHE A ? 199 ? -0.089 -24.283 -15.718 1.0 98.54 199 A 1 +ATOM 1454 C CD1 . PHE A ? 199 ? 0.773 -23.829 -14.702 1.0 97.96 199 A 1 +ATOM 1455 C CD2 . PHE A ? 199 ? 0.345 -24.258 -17.055 1.0 97.95 199 A 1 +ATOM 1456 C CE1 . PHE A ? 199 ? 2.054 -23.347 -15.017 1.0 97.52 199 A 1 +ATOM 1457 C CE2 . PHE A ? 199 ? 1.627 -23.772 -17.378 1.0 97.47 199 A 1 +ATOM 1458 C CZ . PHE A ? 199 ? 2.481 -23.317 -16.359 1.0 98.02 199 A 1 +ATOM 1459 N N . ALA A ? 200 ? -3.328 -27.664 -14.351 1.0 97.06 200 A 1 +ATOM 1460 C CA . ALA A ? 200 ? -4.709 -28.113 -14.138 1.0 96.12 200 A 1 +ATOM 1461 C C . ALA A ? 200 ? -5.203 -27.991 -12.681 1.0 96.16 200 A 1 +ATOM 1462 O O . ALA A ? 200 ? -6.400 -27.857 -12.440 1.0 94.58 200 A 1 +ATOM 1463 C CB . ALA A ? 200 ? -4.818 -29.563 -14.619 1.0 94.53 200 A 1 +ATOM 1464 N N . LYS A ? 201 ? -4.297 -28.034 -11.704 1.0 96.52 201 A 1 +ATOM 1465 C CA . LYS A ? 201 ? -4.637 -27.886 -10.279 1.0 95.84 201 A 1 +ATOM 1466 C C . LYS A ? 201 ? -4.849 -26.437 -9.842 1.0 96.89 201 A 1 +ATOM 1467 O O . LYS A ? 201 ? -5.457 -26.220 -8.798 1.0 95.41 201 A 1 +ATOM 1468 C CB . LYS A ? 201 ? -3.543 -28.521 -9.413 1.0 92.67 201 A 1 +ATOM 1469 C CG . LYS A ? 201 ? -3.508 -30.048 -9.545 1.0 83.97 201 A 1 +ATOM 1470 C CD . LYS A ? 201 ? -2.439 -30.603 -8.601 1.0 79.69 201 A 1 +ATOM 1471 C CE . LYS A ? 201 ? -2.385 -32.128 -8.699 1.0 69.18 201 A 1 +ATOM 1472 N NZ . LYS A ? 201 ? -1.296 -32.669 -7.856 1.0 61.34 201 A 1 +ATOM 1473 N N . GLU A ? 202 ? -4.303 -25.479 -10.583 1.0 97.94 202 A 1 +ATOM 1474 C CA . GLU A ? 202 ? -4.279 -24.066 -10.176 1.0 98.03 202 A 1 +ATOM 1475 C C . GLU A ? 202 ? -5.108 -23.144 -11.076 1.0 98.52 202 A 1 +ATOM 1476 O O . GLU A ? 202 ? -5.540 -22.094 -10.613 1.0 98.16 202 A 1 +ATOM 1477 C CB . GLU A ? 202 ? -2.825 -23.582 -10.047 1.0 95.65 202 A 1 +ATOM 1478 C CG . GLU A ? 202 ? -2.056 -23.457 -11.369 1.0 91.23 202 A 1 +ATOM 1479 C CD . GLU A ? 202 ? -0.571 -23.152 -11.140 1.0 95.99 202 A 1 +ATOM 1480 O OE1 . GLU A ? 202 ? -0.105 -22.075 -11.552 1.0 91.96 202 A 1 +ATOM 1481 O OE2 . GLU A ? 202 ? 0.118 -24.016 -10.546 1.0 93.97 202 A 1 +ATOM 1482 N N . ILE A ? 203 ? -5.361 -23.538 -12.322 1.0 98.5 203 A 1 +ATOM 1483 C CA . ILE A ? 203 ? -6.201 -22.769 -13.248 1.0 98.4 203 A 1 +ATOM 1484 C C . ILE A ? 203 ? -7.677 -22.981 -12.923 1.0 98.43 203 A 1 +ATOM 1485 O O . ILE A ? 203 ? -8.146 -24.103 -12.752 1.0 97.55 203 A 1 +ATOM 1486 C CB . ILE A ? 203 ? -5.889 -23.132 -14.718 1.0 97.08 203 A 1 +ATOM 1487 C CG1 . ILE A ? 203 ? -4.477 -22.658 -15.132 1.0 91.8 203 A 1 +ATOM 1488 C CG2 . ILE A ? 203 ? -6.937 -22.570 -15.693 1.0 93.73 203 A 1 +ATOM 1489 C CD1 . ILE A ? 203 ? -4.350 -21.170 -15.476 1.0 84.41 203 A 1 +ATOM 1490 N N . ILE A ? 204 ? -8.420 -21.883 -12.922 1.0 98.54 204 A 1 +ATOM 1491 C CA . ILE A ? 204 ? -9.877 -21.879 -12.947 1.0 98.19 204 A 1 +ATOM 1492 C C . ILE A ? 204 ? -10.364 -21.343 -14.299 1.0 98.44 204 A 1 +ATOM 1493 O O . ILE A ? 204 ? -9.889 -20.299 -14.746 1.0 97.78 204 A 1 +ATOM 1494 C CB . ILE A ? 204 ? -10.462 -21.082 -11.766 1.0 96.15 204 A 1 +ATOM 1495 C CG1 . ILE A ? 204 ? -9.775 -19.721 -11.530 1.0 86.02 204 A 1 +ATOM 1496 C CG2 . ILE A ? 204 ? -10.395 -21.919 -10.482 1.0 78.27 204 A 1 +ATOM 1497 C CD1 . ILE A ? 204 ? -10.795 -18.628 -11.266 1.0 74.93 204 A 1 +ATOM 1498 N N . PRO A ? 205 ? -11.318 -22.014 -14.953 1.0 98.14 205 A 1 +ATOM 1499 C CA . PRO A ? 205 ? -11.961 -21.472 -16.142 1.0 97.83 205 A 1 +ATOM 1500 C C . PRO A ? 205 ? -12.721 -20.184 -15.810 1.0 97.95 205 A 1 +ATOM 1501 O O . PRO A ? 205 ? -13.356 -20.088 -14.758 1.0 97.07 205 A 1 +ATOM 1502 C CB . PRO A ? 205 ? -12.902 -22.568 -16.650 1.0 96.39 205 A 1 +ATOM 1503 C CG . PRO A ? 205 ? -12.412 -23.840 -15.956 1.0 92.89 205 A 1 +ATOM 1504 C CD . PRO A ? 205 ? -11.843 -23.323 -14.642 1.0 96.71 205 A 1 +ATOM 1505 N N . LEU A ? 206 ? -12.702 -19.213 -16.722 1.0 97.87 206 A 1 +ATOM 1506 C CA . LEU A ? 206 ? -13.550 -18.024 -16.647 1.0 97.82 206 A 1 +ATOM 1507 C C . LEU A ? 206 ? -14.509 -17.977 -17.827 1.0 98.01 206 A 1 +ATOM 1508 O O . LEU A ? 206 ? -14.092 -18.022 -18.979 1.0 97.03 206 A 1 +ATOM 1509 C CB . LEU A ? 206 ? -12.717 -16.731 -16.582 1.0 96.53 206 A 1 +ATOM 1510 C CG . LEU A ? 206 ? -12.576 -16.198 -15.148 1.0 90.84 206 A 1 +ATOM 1511 C CD1 . LEU A ? 206 ? -11.412 -16.854 -14.434 1.0 84.59 206 A 1 +ATOM 1512 C CD2 . LEU A ? 206 ? -12.357 -14.685 -15.154 1.0 85.73 206 A 1 +ATOM 1513 N N . GLU A ? 207 ? -15.795 -17.797 -17.534 1.0 97.06 207 A 1 +ATOM 1514 C CA . GLU A ? 207 ? -16.756 -17.379 -18.545 1.0 96.65 207 A 1 +ATOM 1515 C C . GLU A ? 207 ? -16.654 -15.872 -18.783 1.0 96.85 207 A 1 +ATOM 1516 O O . GLU A ? 207 ? -16.741 -15.061 -17.858 1.0 95.26 207 A 1 +ATOM 1517 C CB . GLU A ? 207 ? -18.183 -17.768 -18.159 1.0 95.02 207 A 1 +ATOM 1518 C CG . GLU A ? 207 ? -18.436 -19.272 -18.330 1.0 84.63 207 A 1 +ATOM 1519 C CD . GLU A ? 207 ? -19.920 -19.636 -18.212 1.0 80.25 207 A 1 +ATOM 1520 O OE1 . GLU A ? 207 ? -20.267 -20.758 -18.645 1.0 72.61 207 A 1 +ATOM 1521 O OE2 . GLU A ? 207 ? -20.711 -18.789 -17.729 1.0 73.28 207 A 1 +ATOM 1522 N N . VAL A ? 208 ? -16.496 -15.506 -20.048 1.0 95.75 208 A 1 +ATOM 1523 C CA . VAL A ? 208 ? -16.421 -14.121 -20.498 1.0 95.39 208 A 1 +ATOM 1524 C C . VAL A ? 208 ? -17.437 -13.887 -21.605 1.0 95.11 208 A 1 +ATOM 1525 O O . VAL A ? 208 ? -17.548 -14.668 -22.545 1.0 93.1 208 A 1 +ATOM 1526 C CB . VAL A ? 208 ? -15.014 -13.715 -20.983 1.0 93.63 208 A 1 +ATOM 1527 C CG1 . VAL A ? 208 ? -14.443 -12.663 -20.042 1.0 86.83 208 A 1 +ATOM 1528 C CG2 . VAL A ? 208 ? -13.989 -14.860 -21.067 1.0 87.51 208 A 1 +ATOM 1529 N N . THR A ? 209 ? -18.174 -12.797 -21.506 1.0 92.5 209 A 1 +ATOM 1530 C CA . THR A ? 209 ? -19.133 -12.413 -22.542 1.0 90.3 209 A 1 +ATOM 1531 C C . THR A ? 209 ? -18.464 -11.455 -23.524 1.0 89.32 209 A 1 +ATOM 1532 O O . THR A ? 209 ? -18.130 -10.325 -23.174 1.0 84.87 209 A 1 +ATOM 1533 C CB . THR A ? 209 ? -20.403 -11.810 -21.932 1.0 86.91 209 A 1 +ATOM 1534 O OG1 . THR A ? 209 ? -20.920 -12.678 -20.950 1.0 76.99 209 A 1 +ATOM 1535 C CG2 . THR A ? 209 ? -21.501 -11.624 -22.974 1.0 74.57 209 A 1 +ATOM 1536 N N . GLN A ? 210 ? -18.297 -11.893 -24.768 1.0 86.41 210 A 1 +ATOM 1537 C CA . GLN A ? 210 ? -17.846 -11.059 -25.883 1.0 84.27 210 A 1 +ATOM 1538 C C . GLN A ? 210 ? -19.036 -10.763 -26.804 1.0 84.53 210 A 1 +ATOM 1539 O O . GLN A ? 210 ? -19.458 -11.599 -27.609 1.0 78.7 210 A 1 +ATOM 1540 C CB . GLN A ? 210 ? -16.686 -11.728 -26.631 1.0 80.31 210 A 1 +ATOM 1541 C CG . GLN A ? 210 ? -15.379 -11.719 -25.818 1.0 73.92 210 A 1 +ATOM 1542 C CD . GLN A ? 210 ? -14.188 -12.248 -26.623 1.0 69.41 210 A 1 +ATOM 1543 O OE1 . GLN A ? 210 ? -14.311 -12.695 -27.754 1.0 63.61 210 A 1 +ATOM 1544 N NE2 . GLN A ? 210 ? -12.998 -12.221 -26.061 1.0 62.45 210 A 1 +ATOM 1545 N N . GLY A ? 211 ? -19.598 -9.566 -26.653 1.0 82.45 211 A 1 +ATOM 1546 C CA . GLY A ? 211 ? -20.821 -9.178 -27.353 1.0 82.59 211 A 1 +ATOM 1547 C C . GLY A ? 211 ? -21.996 -10.092 -26.977 1.0 85.16 211 A 1 +ATOM 1548 O O . GLY A ? 211 ? -22.488 -10.054 -25.852 1.0 81.14 211 A 1 +ATOM 1549 N N . LYS A ? 212 ? -22.454 -10.919 -27.918 1.0 86.32 212 A 1 +ATOM 1550 C CA . LYS A ? 212 ? -23.572 -11.864 -27.711 1.0 88.3 212 A 1 +ATOM 1551 C C . LYS A ? 212 ? -23.120 -13.301 -27.419 1.0 90.05 212 A 1 +ATOM 1552 O O . LYS A ? 212 ? -23.974 -14.171 -27.256 1.0 85.97 212 A 1 +ATOM 1553 C CB . LYS A ? 212 ? -24.522 -11.841 -28.918 1.0 85.97 212 A 1 +ATOM 1554 C CG . LYS A ? 212 ? -25.253 -10.499 -29.079 1.0 78.24 212 A 1 +ATOM 1555 C CD . LYS A ? 212 ? -26.305 -10.617 -30.191 1.0 70.38 212 A 1 +ATOM 1556 C CE . LYS A ? 212 ? -27.068 -9.291 -30.335 1.0 62.21 212 A 1 +ATOM 1557 N NZ . LYS A ? 212 ? -28.136 -9.369 -31.367 1.0 52.18 212 A 1 +ATOM 1558 N N . LYS A ? 213 ? -21.821 -13.577 -27.424 1.0 89.28 213 A 1 +ATOM 1559 C CA . LYS A ? 213 ? -21.281 -14.915 -27.173 1.0 90.49 213 A 1 +ATOM 1560 C C . LYS A ? 213 ? -20.627 -14.968 -25.800 1.0 92.04 213 A 1 +ATOM 1561 O O . LYS A ? 213 ? -19.813 -14.111 -25.468 1.0 89.19 213 A 1 +ATOM 1562 C CB . LYS A ? 213 ? -20.294 -15.333 -28.272 1.0 86.79 213 A 1 +ATOM 1563 C CG . LYS A ? 213 ? -21.008 -15.701 -29.585 1.0 75.45 213 A 1 +ATOM 1564 C CD . LYS A ? 213 ? -19.994 -16.253 -30.594 1.0 71.78 213 A 1 +ATOM 1565 C CE . LYS A ? 213 ? -20.703 -16.743 -31.864 1.0 61.73 213 A 1 +ATOM 1566 N NZ . LYS A ? 213 ? -19.748 -17.355 -32.818 1.0 55.04 213 A 1 +ATOM 1567 N N . THR A ? 214 ? -20.950 -16.018 -25.060 1.0 92.55 214 A 1 +ATOM 1568 C CA . THR A ? 214 ? -20.190 -16.412 -23.878 1.0 93.14 214 A 1 +ATOM 1569 C C . THR A ? 214 ? -19.117 -17.405 -24.306 1.0 93.97 214 A 1 +ATOM 1570 O O . THR A ? 214 ? -19.405 -18.355 -25.035 1.0 91.97 214 A 1 +ATOM 1571 C CB . THR A ? 214 ? -21.105 -17.001 -22.798 1.0 90.67 214 A 1 +ATOM 1572 O OG1 . THR A ? 214 ? -22.160 -16.091 -22.547 1.0 81.81 214 A 1 +ATOM 1573 C CG2 . THR A ? 214 ? -20.372 -17.219 -21.483 1.0 80.59 214 A 1 +ATOM 1574 N N . ILE A ? 215 ? -17.876 -17.147 -23.909 1.0 94.93 215 A 1 +ATOM 1575 C CA . ILE A ? 215 ? -16.716 -17.992 -24.183 1.0 94.91 215 A 1 +ATOM 1576 C C . ILE A ? 215 ? -16.098 -18.360 -22.837 1.0 96.31 215 A 1 +ATOM 1577 O O . ILE A ? 215 ? -15.955 -17.498 -21.972 1.0 95.42 215 A 1 +ATOM 1578 C CB . ILE A ? 215 ? -15.693 -17.275 -25.098 1.0 91.93 215 A 1 +ATOM 1579 C CG1 . ILE A ? 215 ? -16.374 -16.660 -26.351 1.0 78.9 215 A 1 +ATOM 1580 C CG2 . ILE A ? 215 ? -14.584 -18.262 -25.511 1.0 76.74 215 A 1 +ATOM 1581 C CD1 . ILE A ? 215 ? -15.420 -15.884 -27.270 1.0 72.22 215 A 1 +ATOM 1582 N N . THR A ? 216 ? -15.711 -19.614 -22.673 1.0 96.78 216 A 1 +ATOM 1583 C CA . THR A ? 216 ? -14.926 -20.051 -21.520 1.0 97.21 216 A 1 +ATOM 1584 C C . THR A ? 216 ? -13.447 -19.930 -21.852 1.0 97.39 216 A 1 +ATOM 1585 O O . THR A ? 216 ? -12.988 -20.487 -22.847 1.0 96.56 216 A 1 +ATOM 1586 C CB . THR A ? 216 ? -15.284 -21.481 -21.098 1.0 96.59 216 A 1 +ATOM 1587 O OG1 . THR A ? 216 ? -16.686 -21.611 -20.978 1.0 91.79 216 A 1 +ATOM 1588 C CG2 . THR A ? 216 ? -14.689 -21.834 -19.741 1.0 91.94 216 A 1 +ATOM 1589 N N . VAL A ? 217 ? -12.706 -19.179 -21.040 1.0 97.75 217 A 1 +ATOM 1590 C CA . VAL A ? 217 ? -11.249 -19.044 -21.138 1.0 97.94 217 A 1 +ATOM 1591 C C . VAL A ? 217 ? -10.622 -19.973 -20.105 1.0 98.15 217 A 1 +ATOM 1592 O O . VAL A ? 217 ? -10.844 -19.805 -18.907 1.0 97.9 217 A 1 +ATOM 1593 C CB . VAL A ? 217 ? -10.797 -17.590 -20.934 1.0 97.61 217 A 1 +ATOM 1594 C CG1 . VAL A ? 217 ? -9.292 -17.444 -21.158 1.0 96.45 217 A 1 +ATOM 1595 C CG2 . VAL A ? 217 ? -11.516 -16.643 -21.907 1.0 96.57 217 A 1 +ATOM 1596 N N . GLU A ? 218 ? -9.840 -20.941 -20.573 1.0 97.98 218 A 1 +ATOM 1597 C CA . GLU A ? 218 ? -9.257 -22.014 -19.752 1.0 97.58 218 A 1 +ATOM 1598 C C . GLU A ? 218 ? -7.730 -22.075 -19.842 1.0 97.93 218 A 1 +ATOM 1599 O O . GLU A ? 218 ? -7.093 -22.775 -19.056 1.0 96.88 218 A 1 +ATOM 1600 C CB . GLU A ? 218 ? -9.854 -23.367 -20.176 1.0 95.15 218 A 1 +ATOM 1601 C CG . GLU A ? 218 ? -11.391 -23.391 -20.094 1.0 85.96 218 A 1 +ATOM 1602 C CD . GLU A ? 218 ? -11.990 -24.774 -20.360 1.0 85.44 218 A 1 +ATOM 1603 O OE1 . GLU A ? 218 ? -12.902 -25.160 -19.590 1.0 77.6 218 A 1 +ATOM 1604 O OE2 . GLU A ? 218 ? -11.560 -25.434 -21.330 1.0 79.77 218 A 1 +ATOM 1605 N N . GLU A ? 219 ? -7.136 -21.338 -20.777 1.0 98.06 219 A 1 +ATOM 1606 C CA . GLU A ? 219 ? -5.702 -21.333 -21.058 1.0 98.06 219 A 1 +ATOM 1607 C C . GLU A ? 219 ? -5.103 -19.931 -20.977 1.0 98.46 219 A 1 +ATOM 1608 O O . GLU A ? 219 ? -5.731 -18.939 -21.346 1.0 98.08 219 A 1 +ATOM 1609 C CB . GLU A ? 219 ? -5.427 -21.934 -22.449 1.0 95.97 219 A 1 +ATOM 1610 C CG . GLU A ? 219 ? -5.426 -23.478 -22.480 1.0 87.84 219 A 1 +ATOM 1611 C CD . GLU A ? 219 ? -4.966 -23.957 -23.871 1.0 90.26 219 A 1 +ATOM 1612 O OE1 . GLU A ? 219 ? -3.941 -24.663 -23.992 1.0 84.72 219 A 1 +ATOM 1613 O OE2 . GLU A ? 219 ? -5.545 -23.518 -24.889 1.0 86.4 219 A 1 +ATOM 1614 N N . ASP A ? 220 ? -3.835 -19.864 -20.560 1.0 98.58 220 A 1 +ATOM 1615 C CA . ASP A ? 220 ? -3.009 -18.670 -20.713 1.0 98.61 220 A 1 +ATOM 1616 C C . ASP A ? 220 ? -2.839 -18.344 -22.207 1.0 98.49 220 A 1 +ATOM 1617 O O . ASP A ? 220 ? -2.572 -19.225 -23.032 1.0 97.99 220 A 1 +ATOM 1618 C CB . ASP A ? 220 ? -1.641 -18.893 -20.046 1.0 98.6 220 A 1 +ATOM 1619 C CG . ASP A ? 220 ? -1.706 -19.110 -18.530 1.0 98.66 220 A 1 +ATOM 1620 O OD1 . ASP A ? 220 ? -2.443 -18.385 -17.835 1.0 97.94 220 A 1 +ATOM 1621 O OD2 . ASP A ? 220 ? -0.981 -19.980 -17.998 1.0 97.96 220 A 1 +ATOM 1622 N N . GLU A ? 221 ? -2.957 -17.067 -22.570 1.0 98.56 221 A 1 +ATOM 1623 C CA . GLU A ? 221 ? -2.931 -16.656 -23.985 1.0 98.34 221 A 1 +ATOM 1624 C C . GLU A ? 221 ? -1.515 -16.450 -24.545 1.0 98.16 221 A 1 +ATOM 1625 O O . GLU A ? 221 ? -1.297 -16.651 -25.743 1.0 96.94 221 A 1 +ATOM 1626 C CB . GLU A ? 221 ? -3.746 -15.370 -24.177 1.0 97.89 221 A 1 +ATOM 1627 C CG . GLU A ? 221 ? -5.269 -15.577 -24.065 1.0 96.78 221 A 1 +ATOM 1628 C CD . GLU A ? 221 ? -5.968 -14.292 -24.522 1.0 97.1 221 A 1 +ATOM 1629 O OE1 . GLU A ? 221 ? -6.300 -14.165 -25.724 1.0 94.18 221 A 1 +ATOM 1630 O OE2 . GLU A ? 221 ? -6.111 -13.359 -23.708 1.0 94.51 221 A 1 +ATOM 1631 N N . GLU A ? 222 ? -0.554 -16.033 -23.706 1.0 98.43 222 A 1 +ATOM 1632 C CA . GLU A ? 222 ? 0.753 -15.546 -24.183 1.0 98.3 222 A 1 +ATOM 1633 C C . GLU A ? 222 ? 1.695 -16.653 -24.668 1.0 98.22 222 A 1 +ATOM 1634 O O . GLU A ? 222 ? 2.424 -16.451 -25.638 1.0 97.09 222 A 1 +ATOM 1635 C CB . GLU A ? 222 ? 1.456 -14.720 -23.097 1.0 97.62 222 A 1 +ATOM 1636 C CG . GLU A ? 222 ? 0.797 -13.369 -22.788 1.0 94.47 222 A 1 +ATOM 1637 C CD . GLU A ? 222 ? 0.781 -12.374 -23.959 1.0 96.18 222 A 1 +ATOM 1638 O OE1 . GLU A ? 222 ? 0.054 -11.359 -23.837 1.0 92.02 222 A 1 +ATOM 1639 O OE2 . GLU A ? 222 ? 1.445 -12.604 -24.993 1.0 92.72 222 A 1 +ATOM 1640 N N . TYR A ? 223 ? 1.686 -17.826 -24.040 1.0 98.36 223 A 1 +ATOM 1641 C CA . TYR A ? 223 ? 2.661 -18.892 -24.331 1.0 98.14 223 A 1 +ATOM 1642 C C . TYR A ? 223 ? 2.620 -19.395 -25.780 1.0 98.12 223 A 1 +ATOM 1643 O O . TYR A ? 223 ? 3.607 -19.939 -26.279 1.0 97.03 223 A 1 +ATOM 1644 C CB . TYR A ? 223 ? 2.487 -20.048 -23.340 1.0 97.62 223 A 1 +ATOM 1645 C CG . TYR A ? 223 ? 1.451 -21.078 -23.728 1.0 97.77 223 A 1 +ATOM 1646 C CD1 . TYR A ? 223 ? 0.101 -20.940 -23.344 1.0 96.91 223 A 1 +ATOM 1647 C CD2 . TYR A ? 223 ? 1.845 -22.207 -24.478 1.0 97.08 223 A 1 +ATOM 1648 C CE1 . TYR A ? 223 ? -0.841 -21.924 -23.695 1.0 96.06 223 A 1 +ATOM 1649 C CE2 . TYR A ? 223 ? 0.910 -23.194 -24.838 1.0 96.21 223 A 1 +ATOM 1650 C CZ . TYR A ? 223 ? -0.431 -23.053 -24.440 1.0 96.21 223 A 1 +ATOM 1651 O OH . TYR A ? 223 ? -1.332 -24.031 -24.780 1.0 94.63 223 A 1 +ATOM 1652 N N . LYS A ? 224 ? 1.499 -19.180 -26.473 1.0 97.76 224 A 1 +ATOM 1653 C CA . LYS A ? 224 ? 1.306 -19.510 -27.895 1.0 97.21 224 A 1 +ATOM 1654 C C . LYS A ? 224 ? 1.759 -18.385 -28.836 1.0 97.59 224 A 1 +ATOM 1655 O O . LYS A ? 224 ? 1.902 -18.620 -30.034 1.0 95.95 224 A 1 +ATOM 1656 C CB . LYS A ? 224 ? -0.174 -19.870 -28.141 1.0 95.31 224 A 1 +ATOM 1657 C CG . LYS A ? 224 ? -0.634 -21.096 -27.332 1.0 92.17 224 A 1 +ATOM 1658 C CD . LYS A ? 224 ? -2.108 -21.447 -27.587 1.0 88.35 224 A 1 +ATOM 1659 C CE . LYS A ? 224 ? -2.496 -22.623 -26.675 1.0 80.41 224 A 1 +ATOM 1660 N NZ . LYS A ? 224 ? -3.935 -22.974 -26.721 1.0 73.62 224 A 1 +ATOM 1661 N N . LYS A ? 225 ? 1.970 -17.176 -28.328 1.0 97.63 225 A 1 +ATOM 1662 C CA . LYS A ? 225 ? 2.273 -15.967 -29.113 1.0 97.46 225 A 1 +ATOM 1663 C C . LYS A ? 225 ? 3.782 -15.764 -29.293 1.0 97.69 225 A 1 +ATOM 1664 O O . LYS A ? 225 ? 4.344 -14.740 -28.911 1.0 95.95 225 A 1 +ATOM 1665 C CB . LYS A ? 225 ? 1.579 -14.744 -28.494 1.0 96.6 225 A 1 +ATOM 1666 C CG . LYS A ? 225 ? 0.049 -14.860 -28.535 1.0 95.07 225 A 1 +ATOM 1667 C CD . LYS A ? 225 ? -0.586 -13.577 -27.991 1.0 92.16 225 A 1 +ATOM 1668 C CE . LYS A ? 225 ? -2.111 -13.677 -28.048 1.0 87.27 225 A 1 +ATOM 1669 N NZ . LYS A ? 225 ? -2.752 -12.475 -27.472 1.0 80.26 225 A 1 +ATOM 1670 N N . VAL A ? 226 ? 4.457 -16.740 -29.896 1.0 97.72 226 A 1 +ATOM 1671 C CA . VAL A ? 226 ? 5.906 -16.706 -30.124 1.0 98.02 226 A 1 +ATOM 1672 C C . VAL A ? 226 ? 6.259 -17.115 -31.551 1.0 98.22 226 A 1 +ATOM 1673 O O . VAL A ? 226 ? 5.693 -18.050 -32.112 1.0 97.58 226 A 1 +ATOM 1674 C CB . VAL A ? 226 ? 6.644 -17.549 -29.062 1.0 97.34 226 A 1 +ATOM 1675 C CG1 . VAL A ? 226 ? 6.353 -19.053 -29.152 1.0 96.02 226 A 1 +ATOM 1676 C CG2 . VAL A ? 226 ? 8.158 -17.328 -29.122 1.0 95.4 226 A 1 +ATOM 1677 N N . ASN A ? 227 ? 7.233 -16.415 -32.138 1.0 98.04 227 A 1 +ATOM 1678 C CA . ASN A ? 227 ? 7.909 -16.812 -33.371 1.0 98.09 227 A 1 +ATOM 1679 C C . ASN A ? 227 ? 9.419 -16.854 -33.098 1.0 98.33 227 A 1 +ATOM 1680 O O . ASN A ? 227 ? 10.080 -15.813 -33.077 1.0 97.85 227 A 1 +ATOM 1681 C CB . ASN A ? 227 ? 7.514 -15.857 -34.510 1.0 97.38 227 A 1 +ATOM 1682 C CG . ASN A ? 227 ? 8.156 -16.234 -35.837 1.0 95.9 227 A 1 +ATOM 1683 O OD1 . ASN A ? 227 ? 9.201 -16.845 -35.910 1.0 91.01 227 A 1 +ATOM 1684 N ND2 . ASN A ? 227 ? 7.548 -15.859 -36.938 1.0 89.0 227 A 1 +ATOM 1685 N N . PHE A ? 228 ? 9.954 -18.055 -32.901 1.0 98.24 228 A 1 +ATOM 1686 C CA . PHE A ? 228 ? 11.354 -18.265 -32.521 1.0 98.29 228 A 1 +ATOM 1687 C C . PHE A ? 228 ? 12.355 -17.701 -33.541 1.0 98.32 228 A 1 +ATOM 1688 O O . PHE A ? 228 ? 13.374 -17.143 -33.150 1.0 97.4 228 A 1 +ATOM 1689 C CB . PHE A ? 228 ? 11.603 -19.760 -32.300 1.0 97.88 228 A 1 +ATOM 1690 C CG . PHE A ? 228 ? 10.822 -20.356 -31.149 1.0 98.06 228 A 1 +ATOM 1691 C CD1 . PHE A ? 228 ? 11.050 -19.902 -29.837 1.0 96.76 228 A 1 +ATOM 1692 C CD2 . PHE A ? 228 ? 9.870 -21.368 -31.374 1.0 96.69 228 A 1 +ATOM 1693 C CE1 . PHE A ? 228 ? 10.336 -20.453 -28.759 1.0 95.81 228 A 1 +ATOM 1694 C CE2 . PHE A ? 228 ? 9.153 -21.924 -30.299 1.0 95.79 228 A 1 +ATOM 1695 C CZ . PHE A ? 228 ? 9.387 -21.466 -28.987 1.0 96.82 228 A 1 +ATOM 1696 N N . GLU A ? 229 ? 12.060 -17.784 -34.842 1.0 98.29 229 A 1 +ATOM 1697 C CA . GLU A ? 229 ? 12.938 -17.249 -35.894 1.0 98.14 229 A 1 +ATOM 1698 C C . GLU A ? 229 ? 12.998 -15.716 -35.897 1.0 98.27 229 A 1 +ATOM 1699 O O . GLU A ? 229 ? 13.976 -15.122 -36.357 1.0 97.14 229 A 1 +ATOM 1700 C CB . GLU A ? 229 ? 12.434 -17.695 -37.268 1.0 97.43 229 A 1 +ATOM 1701 C CG . GLU A ? 229 ? 12.459 -19.214 -37.476 1.0 87.98 229 A 1 +ATOM 1702 C CD . GLU A ? 229 ? 12.064 -19.603 -38.905 1.0 79.08 229 A 1 +ATOM 1703 O OE1 . GLU A ? 229 ? 12.180 -20.810 -39.217 1.0 70.16 229 A 1 +ATOM 1704 O OE2 . GLU A ? 229 ? 11.662 -18.696 -39.678 1.0 70.84 229 A 1 +ATOM 1705 N N . LYS A ? 230 ? 11.955 -15.070 -35.393 1.0 98.06 230 A 1 +ATOM 1706 C CA . LYS A ? 230 ? 11.852 -13.611 -35.345 1.0 98.09 230 A 1 +ATOM 1707 C C . LYS A ? 230 ? 12.563 -13.018 -34.127 1.0 98.42 230 A 1 +ATOM 1708 O O . LYS A ? 230 ? 13.047 -11.896 -34.219 1.0 97.78 230 A 1 +ATOM 1709 C CB . LYS A ? 230 ? 10.368 -13.221 -35.414 1.0 97.02 230 A 1 +ATOM 1710 C CG . LYS A ? 230 ? 10.163 -11.782 -35.901 1.0 89.66 230 A 1 +ATOM 1711 C CD . LYS A ? 230 ? 8.671 -11.447 -35.973 1.0 88.76 230 A 1 +ATOM 1712 C CE . LYS A ? 230 ? 8.466 -10.028 -36.509 1.0 80.83 230 A 1 +ATOM 1713 N NZ . LYS A ? 230 ? 7.044 -9.620 -36.460 1.0 73.89 230 A 1 +ATOM 1714 N N . ILE A ? 231 ? 12.654 -13.757 -33.021 1.0 98.36 231 A 1 +ATOM 1715 C CA . ILE A ? 231 ? 13.221 -13.289 -31.740 1.0 98.5 231 A 1 +ATOM 1716 C C . ILE A ? 231 ? 14.587 -12.593 -31.904 1.0 98.49 231 A 1 +ATOM 1717 O O . ILE A ? 231 ? 14.695 -11.430 -31.517 1.0 98.2 231 A 1 +ATOM 1718 C CB . ILE A ? 231 ? 13.241 -14.420 -30.684 1.0 98.41 231 A 1 +ATOM 1719 C CG1 . ILE A ? 231 ? 11.795 -14.773 -30.279 1.0 97.95 231 A 1 +ATOM 1720 C CG2 . ILE A ? 231 ? 14.065 -14.023 -29.439 1.0 98.05 231 A 1 +ATOM 1721 C CD1 . ILE A ? 231 ? 11.670 -15.929 -29.275 1.0 96.93 231 A 1 +ATOM 1722 N N . PRO A ? 232 ? 15.619 -13.218 -32.519 1.0 98.34 232 A 1 +ATOM 1723 C CA . PRO A ? 232 ? 16.947 -12.597 -32.632 1.0 98.0 232 A 1 +ATOM 1724 C C . PRO A ? 232 ? 16.992 -11.387 -33.582 1.0 98.12 232 A 1 +ATOM 1725 O O . PRO A ? 232 ? 17.969 -10.646 -33.597 1.0 97.28 232 A 1 +ATOM 1726 C CB . PRO A ? 232 ? 17.877 -13.729 -33.091 1.0 97.03 232 A 1 +ATOM 1727 C CG . PRO A ? 232 ? 16.955 -14.687 -33.843 1.0 94.77 232 A 1 +ATOM 1728 C CD . PRO A ? 232 ? 15.650 -14.574 -33.064 1.0 97.52 232 A 1 +ATOM 1729 N N . LYS A ? 233 ? 15.945 -11.166 -34.370 1.0 98.21 233 A 1 +ATOM 1730 C CA . LYS A ? 233 ? 15.840 -10.076 -35.359 1.0 98.08 233 A 1 +ATOM 1731 C C . LYS A ? 233 ? 15.022 -8.881 -34.856 1.0 98.2 233 A 1 +ATOM 1732 O O . LYS A ? 233 ? 14.906 -7.883 -35.568 1.0 96.85 233 A 1 +ATOM 1733 C CB . LYS A ? 233 ? 15.246 -10.630 -36.666 1.0 97.42 233 A 1 +ATOM 1734 C CG . LYS A ? 233 ? 16.076 -11.778 -37.272 1.0 95.19 233 A 1 +ATOM 1735 C CD . LYS A ? 233 ? 15.386 -12.353 -38.514 1.0 91.29 233 A 1 +ATOM 1736 C CE . LYS A ? 233 ? 16.169 -13.576 -39.010 1.0 83.47 233 A 1 +ATOM 1737 N NZ . LYS A ? 233 ? 15.411 -14.369 -40.013 1.0 74.63 233 A 1 +ATOM 1738 N N . LEU A ? 234 ? 14.431 -8.978 -33.677 1.0 98.31 234 A 1 +ATOM 1739 C CA . LEU A ? 234 ? 13.612 -7.903 -33.119 1.0 98.44 234 A 1 +ATOM 1740 C C . LEU A ? 234 ? 14.465 -6.679 -32.779 1.0 98.5 234 A 1 +ATOM 1741 O O . LEU A ? 234 ? 15.603 -6.793 -32.326 1.0 98.07 234 A 1 +ATOM 1742 C CB . LEU A ? 234 ? 12.826 -8.392 -31.893 1.0 98.25 234 A 1 +ATOM 1743 C CG . LEU A ? 234 ? 11.759 -9.455 -32.206 1.0 97.61 234 A 1 +ATOM 1744 C CD1 . LEU A ? 234 ? 11.077 -9.879 -30.911 1.0 97.02 234 A 1 +ATOM 1745 C CD2 . LEU A ? 234 ? 10.683 -8.956 -33.171 1.0 96.85 234 A 1 +ATOM 1746 N N . LYS A ? 235 ? 13.888 -5.492 -32.971 1.0 98.38 235 A 1 +ATOM 1747 C CA . LYS A ? 235 ? 14.498 -4.242 -32.515 1.0 98.36 235 A 1 +ATOM 1748 C C . LYS A ? 235 ? 14.376 -4.120 -30.993 1.0 98.65 235 A 1 +ATOM 1749 O O . LYS A ? 235 ? 13.400 -4.630 -30.432 1.0 98.25 235 A 1 +ATOM 1750 C CB . LYS A ? 235 ? 13.861 -3.039 -33.218 1.0 97.26 235 A 1 +ATOM 1751 C CG . LYS A ? 235 ? 14.199 -3.008 -34.717 1.0 84.92 235 A 1 +ATOM 1752 C CD . LYS A ? 235 ? 13.680 -1.713 -35.351 1.0 79.39 235 A 1 +ATOM 1753 C CE . LYS A ? 235 ? 14.062 -1.667 -36.831 1.0 66.07 235 A 1 +ATOM 1754 N NZ . LYS A ? 235 ? 13.659 -0.381 -37.461 1.0 56.31 235 A 1 +ATOM 1755 N N . PRO A ? 236 ? 15.307 -3.397 -30.350 1.0 98.6 236 A 1 +ATOM 1756 C CA . PRO A ? 236 ? 15.146 -2.987 -28.959 1.0 98.65 236 A 1 +ATOM 1757 C C . PRO A ? 236 ? 13.792 -2.296 -28.742 1.0 98.69 236 A 1 +ATOM 1758 O O . PRO A ? 236 ? 13.354 -1.507 -29.582 1.0 98.33 236 A 1 +ATOM 1759 C CB . PRO A ? 236 ? 16.315 -2.045 -28.669 1.0 98.26 236 A 1 +ATOM 1760 C CG . PRO A ? 236 ? 17.379 -2.458 -29.682 1.0 96.27 236 A 1 +ATOM 1761 C CD . PRO A ? 236 ? 16.547 -2.865 -30.896 1.0 98.31 236 A 1 +ATOM 1762 N N . ALA A ? 237 ? 13.130 -2.606 -27.635 1.0 98.64 237 A 1 +ATOM 1763 C CA . ALA A ? 237 ? 11.778 -2.121 -27.351 1.0 98.62 237 A 1 +ATOM 1764 C C . ALA A ? 237 ? 11.738 -0.809 -26.547 1.0 98.61 237 A 1 +ATOM 1765 O O . ALA A ? 237 ? 10.731 -0.102 -26.593 1.0 98.01 237 A 1 +ATOM 1766 C CB . ALA A ? 237 ? 11.009 -3.240 -26.633 1.0 98.44 237 A 1 +ATOM 1767 N N . PHE A ? 238 ? 12.805 -0.494 -25.813 1.0 98.68 238 A 1 +ATOM 1768 C CA . PHE A ? 238 ? 12.811 0.609 -24.844 1.0 98.62 238 A 1 +ATOM 1769 C C . PHE A ? 238 ? 13.886 1.659 -25.114 1.0 98.46 238 A 1 +ATOM 1770 O O . PHE A ? 238 ? 13.596 2.855 -25.073 1.0 97.28 238 A 1 +ATOM 1771 C CB . PHE A ? 238 ? 12.959 0.032 -23.437 1.0 98.52 238 A 1 +ATOM 1772 C CG . PHE A ? 238 ? 11.821 -0.878 -23.034 1.0 98.71 238 A 1 +ATOM 1773 C CD1 . PHE A ? 238 ? 10.603 -0.330 -22.592 1.0 98.28 238 A 1 +ATOM 1774 C CD2 . PHE A ? 238 ? 11.952 -2.276 -23.132 1.0 98.29 238 A 1 +ATOM 1775 C CE1 . PHE A ? 238 ? 9.533 -1.167 -22.239 1.0 98.02 238 A 1 +ATOM 1776 C CE2 . PHE A ? 238 ? 10.883 -3.122 -22.784 1.0 97.96 238 A 1 +ATOM 1777 C CZ . PHE A ? 238 ? 9.675 -2.565 -22.335 1.0 98.38 238 A 1 +ATOM 1778 N N . THR A ? 239 ? 15.114 1.244 -25.395 1.0 98.42 239 A 1 +ATOM 1779 C CA . THR A ? 239 ? 16.231 2.133 -25.734 1.0 98.27 239 A 1 +ATOM 1780 C C . THR A ? 239 ? 16.857 1.707 -27.060 1.0 98.3 239 A 1 +ATOM 1781 O O . THR A ? 239 ? 16.856 0.534 -27.415 1.0 97.66 239 A 1 +ATOM 1782 C CB . THR A ? 239 ? 17.279 2.213 -24.613 1.0 97.64 239 A 1 +ATOM 1783 O OG1 . THR A ? 239 ? 17.960 1.005 -24.451 1.0 92.71 239 A 1 +ATOM 1784 C CG2 . THR A ? 239 ? 16.667 2.578 -23.259 1.0 91.98 239 A 1 +ATOM 1785 N N . SER A ? 240 ? 17.377 2.671 -27.819 1.0 98.01 240 A 1 +ATOM 1786 C CA . SER A ? 240 ? 17.877 2.426 -29.180 1.0 97.5 240 A 1 +ATOM 1787 C C . SER A ? 240 ? 19.063 1.457 -29.235 1.0 97.43 240 A 1 +ATOM 1788 O O . SER A ? 240 ? 19.196 0.708 -30.198 1.0 95.16 240 A 1 +ATOM 1789 C CB . SER A ? 240 ? 18.251 3.752 -29.850 1.0 96.31 240 A 1 +ATOM 1790 O OG . SER A ? 240 ? 18.897 4.625 -28.947 1.0 83.74 240 A 1 +ATOM 1791 N N . GLU A ? 241 ? 19.892 1.431 -28.186 1.0 97.31 241 A 1 +ATOM 1792 C CA . GLU A ? 241 ? 21.029 0.512 -28.026 1.0 96.73 241 A 1 +ATOM 1793 C C . GLU A ? 241 ? 20.757 -0.590 -26.987 1.0 97.41 241 A 1 +ATOM 1794 O O . GLU A ? 241 ? 21.679 -1.272 -26.545 1.0 95.34 241 A 1 +ATOM 1795 C CB . GLU A ? 241 ? 22.287 1.298 -27.638 1.0 94.59 241 A 1 +ATOM 1796 C CG . GLU A ? 241 ? 22.699 2.370 -28.650 1.0 85.56 241 A 1 +ATOM 1797 C CD . GLU A ? 241 ? 24.052 3.010 -28.294 1.0 73.68 241 A 1 +ATOM 1798 O OE1 . GLU A ? 241 ? 24.533 3.823 -29.116 1.0 65.25 241 A 1 +ATOM 1799 O OE2 . GLU A ? 241 ? 24.613 2.698 -27.206 1.0 66.81 241 A 1 +ATOM 1800 N N . GLY A ? 242 ? 19.508 -0.754 -26.585 1.0 97.87 242 A 1 +ATOM 1801 C CA . GLY A ? 242 ? 19.115 -1.718 -25.571 1.0 98.23 242 A 1 +ATOM 1802 C C . GLY A ? 242 ? 19.123 -3.163 -26.069 1.0 98.62 242 A 1 +ATOM 1803 O O . GLY A ? 242 ? 19.125 -3.452 -27.267 1.0 98.25 242 A 1 +ATOM 1804 N N . SER A ? 243 ? 19.090 -4.085 -25.129 1.0 98.66 243 A 1 +ATOM 1805 C CA . SER A ? 243 ? 19.024 -5.530 -25.369 1.0 98.72 243 A 1 +ATOM 1806 C C . SER A ? 243 ? 17.638 -6.121 -25.091 1.0 98.78 243 A 1 +ATOM 1807 O O . SER A ? 243 ? 17.323 -7.211 -25.565 1.0 98.42 243 A 1 +ATOM 1808 C CB . SER A ? 243 ? 20.095 -6.222 -24.524 1.0 98.49 243 A 1 +ATOM 1809 O OG . SER A ? 243 ? 19.964 -5.877 -23.163 1.0 97.94 243 A 1 +ATOM 1810 N N . VAL A ? 244 ? 16.800 -5.396 -24.360 1.0 98.84 244 A 1 +ATOM 1811 C CA . VAL A ? 244 ? 15.428 -5.812 -24.055 1.0 98.87 244 A 1 +ATOM 1812 C C . VAL A ? 244 ? 14.530 -5.600 -25.277 1.0 98.85 244 A 1 +ATOM 1813 O O . VAL A ? 244 ? 14.489 -4.525 -25.879 1.0 98.73 244 A 1 +ATOM 1814 C CB . VAL A ? 244 ? 14.879 -5.104 -22.808 1.0 98.83 244 A 1 +ATOM 1815 C CG1 . VAL A ? 244 ? 13.486 -5.621 -22.445 1.0 98.38 244 A 1 +ATOM 1816 C CG2 . VAL A ? 244 ? 15.783 -5.341 -21.588 1.0 98.26 244 A 1 +ATOM 1817 N N . THR A ? 245 ? 13.793 -6.649 -25.639 1.0 98.82 245 A 1 +ATOM 1818 C CA . THR A ? 245 ? 12.873 -6.665 -26.786 1.0 98.81 245 A 1 +ATOM 1819 C C . THR A ? 245 ? 11.476 -7.113 -26.368 1.0 98.81 245 A 1 +ATOM 1820 O O . THR A ? 245 ? 11.270 -7.582 -25.250 1.0 98.63 245 A 1 +ATOM 1821 C CB . THR A ? 245 ? 13.383 -7.574 -27.911 1.0 98.71 245 A 1 +ATOM 1822 O OG1 . THR A ? 245 ? 13.284 -8.929 -27.548 1.0 97.9 245 A 1 +ATOM 1823 C CG2 . THR A ? 245 ? 14.818 -7.277 -28.327 1.0 97.44 245 A 1 +ATOM 1824 N N . ALA A ? 246 ? 10.520 -7.038 -27.282 1.0 98.77 246 A 1 +ATOM 1825 C CA . ALA A ? 246 ? 9.168 -7.539 -27.038 1.0 98.71 246 A 1 +ATOM 1826 C C . ALA A ? 246 ? 9.108 -9.053 -26.738 1.0 98.76 246 A 1 +ATOM 1827 O O . ALA A ? 246 ? 8.139 -9.507 -26.143 1.0 98.43 246 A 1 +ATOM 1828 C CB . ALA A ? 246 ? 8.299 -7.183 -28.247 1.0 98.35 246 A 1 +ATOM 1829 N N . ALA A ? 247 ? 10.119 -9.833 -27.137 1.0 98.73 247 A 1 +ATOM 1830 C CA . ALA A ? 247 ? 10.148 -11.284 -26.930 1.0 98.73 247 A 1 +ATOM 1831 C C . ALA A ? 247 ? 10.881 -11.723 -25.651 1.0 98.8 247 A 1 +ATOM 1832 O O . ALA A ? 247 ? 10.614 -12.811 -25.154 1.0 98.56 247 A 1 +ATOM 1833 C CB . ALA A ? 247 ? 10.773 -11.940 -28.162 1.0 98.46 247 A 1 +ATOM 1834 N N . ASN A ? 248 ? 11.802 -10.910 -25.123 1.0 98.76 248 A 1 +ATOM 1835 C CA . ASN A ? 248 ? 12.554 -11.202 -23.892 1.0 98.81 248 A 1 +ATOM 1836 C C . ASN A ? 248 ? 12.129 -10.334 -22.691 1.0 98.88 248 A 1 +ATOM 1837 O O . ASN A ? 248 ? 12.745 -10.395 -21.623 1.0 98.77 248 A 1 +ATOM 1838 C CB . ASN A ? 248 ? 14.067 -11.196 -24.199 1.0 98.64 248 A 1 +ATOM 1839 C CG . ASN A ? 248 ? 14.653 -9.821 -24.494 1.0 98.79 248 A 1 +ATOM 1840 O OD1 . ASN A ? 248 ? 14.179 -8.792 -24.055 1.0 94.09 248 A 1 +ATOM 1841 N ND2 . ASN A ? 248 ? 15.739 -9.769 -25.232 1.0 93.31 248 A 1 +ATOM 1842 N N . ALA A ? 249 ? 11.074 -9.543 -22.862 1.0 98.9 249 A 1 +ATOM 1843 C CA . ALA A ? 249 ? 10.339 -8.859 -21.811 1.0 98.89 249 A 1 +ATOM 1844 C C . ALA A ? 249 ? 9.001 -9.564 -21.548 1.0 98.89 249 A 1 +ATOM 1845 O O . ALA A ? 249 ? 8.442 -10.197 -22.440 1.0 98.74 249 A 1 +ATOM 1846 C CB . ALA A ? 249 ? 10.115 -7.405 -22.238 1.0 98.76 249 A 1 +ATOM 1847 N N . SER A ? 250 ? 8.458 -9.401 -20.348 1.0 98.88 250 A 1 +ATOM 1848 C CA . SER A ? 250 ? 7.058 -9.730 -20.092 1.0 98.85 250 A 1 +ATOM 1849 C C . SER A ? 250 ? 6.124 -8.750 -20.815 1.0 98.82 250 A 1 +ATOM 1850 O O . SER A ? 250 ? 6.497 -7.624 -21.147 1.0 98.57 250 A 1 +ATOM 1851 C CB . SER A ? 250 ? 6.772 -9.772 -18.587 1.0 98.72 250 A 1 +ATOM 1852 O OG . SER A ? 250 ? 6.985 -8.514 -17.981 1.0 98.33 250 A 1 +ATOM 1853 N N . THR A ? 251 ? 4.887 -9.170 -21.033 1.0 98.75 251 A 1 +ATOM 1854 C CA . THR A ? 251 ? 3.853 -8.397 -21.729 1.0 98.75 251 A 1 +ATOM 1855 C C . THR A ? 251 ? 2.930 -7.646 -20.758 1.0 98.78 251 A 1 +ATOM 1856 O O . THR A ? 251 ? 3.047 -7.764 -19.534 1.0 98.41 251 A 1 +ATOM 1857 C CB . THR A ? 251 ? 3.067 -9.327 -22.663 1.0 98.46 251 A 1 +ATOM 1858 O OG1 . THR A ? 251 ? 2.696 -10.496 -21.971 1.0 97.26 251 A 1 +ATOM 1859 C CG2 . THR A ? 251 ? 3.902 -9.758 -23.870 1.0 96.99 251 A 1 +ATOM 1860 N N . LEU A ? 252 ? 2.019 -6.850 -21.300 1.0 98.78 252 A 1 +ATOM 1861 C CA . LEU A ? 252 ? 0.904 -6.259 -20.559 1.0 98.77 252 A 1 +ATOM 1862 C C . LEU A ? 252 ? -0.220 -7.298 -20.466 1.0 98.78 252 A 1 +ATOM 1863 O O . LEU A ? 252 ? -0.643 -7.821 -21.500 1.0 98.4 252 A 1 +ATOM 1864 C CB . LEU A ? 252 ? 0.408 -4.991 -21.267 1.0 98.53 252 A 1 +ATOM 1865 C CG . LEU A ? 252 ? 1.475 -3.906 -21.510 1.0 97.38 252 A 1 +ATOM 1866 C CD1 . LEU A ? 252 ? 0.838 -2.721 -22.238 1.0 95.5 252 A 1 +ATOM 1867 C CD2 . LEU A ? 252 ? 2.094 -3.392 -20.213 1.0 95.0 252 A 1 +ATOM 1868 N N . ASN A ? 253 ? -0.700 -7.596 -19.256 1.0 98.84 253 A 1 +ATOM 1869 C CA . ASN A ? 253 ? -1.608 -8.726 -19.055 1.0 98.9 253 A 1 +ATOM 1870 C C . ASN A ? 253 ? -2.687 -8.469 -18.000 1.0 98.92 253 A 1 +ATOM 1871 O O . ASN A ? 253 ? -2.591 -7.553 -17.182 1.0 98.82 253 A 1 +ATOM 1872 C CB . ASN A ? 253 ? -0.773 -9.968 -18.705 1.0 98.84 253 A 1 +ATOM 1873 C CG . ASN A ? 253 ? 0.162 -10.401 -19.820 1.0 98.81 253 A 1 +ATOM 1874 O OD1 . ASN A ? 253 ? 1.356 -10.161 -19.776 1.0 89.2 253 A 1 +ATOM 1875 N ND2 . ASN A ? 253 ? -0.353 -11.042 -20.844 1.0 89.06 253 A 1 +ATOM 1876 N N . ASP A ? 254 ? -3.686 -9.351 -18.014 1.0 98.92 254 A 1 +ATOM 1877 C CA . ASP A ? 254 ? -4.803 -9.382 -17.077 1.0 98.92 254 A 1 +ATOM 1878 C C . ASP A ? 254 ? -4.849 -10.735 -16.358 1.0 98.93 254 A 1 +ATOM 1879 O O . ASP A ? 254 ? -4.624 -11.782 -16.966 1.0 98.84 254 A 1 +ATOM 1880 C CB . ASP A ? 254 ? -6.118 -9.138 -17.831 1.0 98.83 254 A 1 +ATOM 1881 C CG . ASP A ? 254 ? -6.109 -7.885 -18.708 1.0 98.72 254 A 1 +ATOM 1882 O OD1 . ASP A ? 254 ? -5.635 -6.823 -18.252 1.0 97.92 254 A 1 +ATOM 1883 O OD2 . ASP A ? 254 ? -6.605 -7.945 -19.852 1.0 97.7 254 A 1 +ATOM 1884 N N . GLY A ? 255 ? -5.168 -10.735 -15.064 1.0 98.92 255 A 1 +ATOM 1885 C CA . GLY A ? 255 ? -5.327 -11.970 -14.301 1.0 98.94 255 A 1 +ATOM 1886 C C . GLY A ? 255 ? -5.318 -11.780 -12.790 1.0 98.96 255 A 1 +ATOM 1887 O O . GLY A ? 255 ? -5.023 -10.704 -12.265 1.0 98.92 255 A 1 +ATOM 1888 N N . ALA A ? 256 ? -5.630 -12.860 -12.071 1.0 98.96 256 A 1 +ATOM 1889 C CA . ALA A ? 256 ? -5.582 -12.891 -10.614 1.0 98.97 256 A 1 +ATOM 1890 C C . ALA A ? 256 ? -5.137 -14.259 -10.087 1.0 98.97 256 A 1 +ATOM 1891 O O . ALA A ? 256 ? -5.433 -15.297 -10.679 1.0 98.92 256 A 1 +ATOM 1892 C CB . ALA A ? 256 ? -6.949 -12.489 -10.055 1.0 98.94 256 A 1 +ATOM 1893 N N . ALA A ? 257 ? -4.447 -14.257 -8.945 1.0 98.96 257 A 1 +ATOM 1894 C CA . ALA A ? 257 ? -4.034 -15.452 -8.224 1.0 98.97 257 A 1 +ATOM 1895 C C . ALA A ? 257 ? -4.297 -15.278 -6.727 1.0 98.97 257 A 1 +ATOM 1896 O O . ALA A ? 257 ? -3.986 -14.231 -6.158 1.0 98.93 257 A 1 +ATOM 1897 C CB . ALA A ? 257 ? -2.556 -15.735 -8.507 1.0 98.93 257 A 1 +ATOM 1898 N N . MET A ? 258 ? -4.857 -16.304 -6.086 1.0 98.98 258 A 1 +ATOM 1899 C CA . MET A ? 258 ? -5.210 -16.275 -4.669 1.0 98.98 258 A 1 +ATOM 1900 C C . MET A ? 258 ? -4.737 -17.539 -3.953 1.0 98.98 258 A 1 +ATOM 1901 O O . MET A ? 258 ? -4.656 -18.619 -4.538 1.0 98.92 258 A 1 +ATOM 1902 C CB . MET A ? 258 ? -6.722 -16.095 -4.493 1.0 98.94 258 A 1 +ATOM 1903 C CG . MET A ? 258 ? -7.263 -14.791 -5.085 1.0 98.42 258 A 1 +ATOM 1904 S SD . MET A ? 258 ? -6.752 -13.276 -4.241 1.0 98.21 258 A 1 +ATOM 1905 C CE . MET A ? 258 ? -7.299 -12.062 -5.456 1.0 95.13 258 A 1 +ATOM 1906 N N . VAL A ? 259 ? -4.457 -17.390 -2.659 1.0 98.96 259 A 1 +ATOM 1907 C CA . VAL A ? 259 ? -4.114 -18.490 -1.753 1.0 98.97 259 A 1 +ATOM 1908 C C . VAL A ? 259 ? -4.991 -18.433 -0.506 1.0 98.97 259 A 1 +ATOM 1909 O O . VAL A ? 259 ? -5.393 -17.355 -0.060 1.0 98.94 259 A 1 +ATOM 1910 C CB . VAL A ? 259 ? -2.616 -18.512 -1.383 1.0 98.92 259 A 1 +ATOM 1911 C CG1 . VAL A ? 259 ? -1.730 -18.708 -2.615 1.0 98.54 259 A 1 +ATOM 1912 C CG2 . VAL A ? 259 ? -2.146 -17.244 -0.653 1.0 98.05 259 A 1 +ATOM 1913 N N . VAL A ? 260 ? -5.270 -19.597 0.070 1.0 98.95 260 A 1 +ATOM 1914 C CA . VAL A ? 260 ? -5.947 -19.735 1.364 1.0 98.95 260 A 1 +ATOM 1915 C C . VAL A ? 260 ? -4.921 -20.201 2.386 1.0 98.95 260 A 1 +ATOM 1916 O O . VAL A ? 260 ? -4.232 -21.202 2.173 1.0 98.89 260 A 1 +ATOM 1917 C CB . VAL A ? 260 ? -7.147 -20.692 1.293 1.0 98.92 260 A 1 +ATOM 1918 C CG1 . VAL A ? 260 ? -7.935 -20.673 2.607 1.0 98.64 260 A 1 +ATOM 1919 C CG2 . VAL A ? 260 ? -8.111 -20.323 0.157 1.0 98.63 260 A 1 +ATOM 1920 N N . MET A ? 261 ? -4.823 -19.464 3.485 1.0 98.94 261 A 1 +ATOM 1921 C CA . MET A ? 261 ? -3.827 -19.657 4.534 1.0 98.93 261 A 1 +ATOM 1922 C C . MET A ? 261 ? -4.502 -19.811 5.899 1.0 98.92 261 A 1 +ATOM 1923 O O . MET A ? 261 ? -5.515 -19.179 6.192 1.0 98.77 261 A 1 +ATOM 1924 C CB . MET A ? 261 ? -2.844 -18.481 4.549 1.0 98.86 261 A 1 +ATOM 1925 C CG . MET A ? 261 ? -2.110 -18.276 3.211 1.0 98.46 261 A 1 +ATOM 1926 S SD . MET A ? 261 ? -1.115 -16.760 3.124 1.0 98.42 261 A 1 +ATOM 1927 C CE . MET A ? 261 ? 0.144 -17.109 4.375 1.0 94.78 261 A 1 +ATOM 1928 N N . THR A ? 262 ? -3.912 -20.651 6.738 1.0 98.84 262 A 1 +ATOM 1929 C CA . THR A ? 262 ? -4.345 -20.859 8.124 1.0 98.83 262 A 1 +ATOM 1930 C C . THR A ? 262 ? -3.143 -21.266 8.980 1.0 98.79 262 A 1 +ATOM 1931 O O . THR A ? 262 ? -1.999 -21.270 8.508 1.0 98.58 262 A 1 +ATOM 1932 C CB . THR A ? 262 ? -5.510 -21.875 8.166 1.0 98.73 262 A 1 +ATOM 1933 O OG1 . THR A ? 262 ? -6.068 -21.957 9.457 1.0 97.72 262 A 1 +ATOM 1934 C CG2 . THR A ? 262 ? -5.110 -23.292 7.750 1.0 97.67 262 A 1 +ATOM 1935 N N . THR A ? 263 ? -3.375 -21.598 10.245 1.0 98.66 263 A 1 +ATOM 1936 C CA . THR A ? 263 ? -2.372 -22.214 11.118 1.0 98.54 263 A 1 +ATOM 1937 C C . THR A ? 263 ? -2.479 -23.741 11.073 1.0 98.57 263 A 1 +ATOM 1938 O O . THR A ? 263 ? -3.498 -24.297 10.645 1.0 98.31 263 A 1 +ATOM 1939 C CB . THR A ? 263 ? -2.496 -21.698 12.558 1.0 98.09 263 A 1 +ATOM 1940 O OG1 . THR A ? 263 ? -3.734 -22.074 13.115 1.0 96.46 263 A 1 +ATOM 1941 C CG2 . THR A ? 263 ? -2.381 -20.174 12.637 1.0 96.17 263 A 1 +ATOM 1942 N N . VAL A ? 264 ? -1.449 -24.437 11.558 1.0 98.36 264 A 1 +ATOM 1943 C CA . VAL A ? 264 ? -1.495 -25.904 11.730 1.0 98.21 264 A 1 +ATOM 1944 C C . VAL A ? 264 ? -2.708 -26.327 12.571 1.0 98.25 264 A 1 +ATOM 1945 O O . VAL A ? 264 ? -3.406 -27.279 12.211 1.0 97.74 264 A 1 +ATOM 1946 C CB . VAL A ? 264 ? -0.183 -26.406 12.368 1.0 97.41 264 A 1 +ATOM 1947 C CG1 . VAL A ? 264 ? -0.244 -27.887 12.755 1.0 90.88 264 A 1 +ATOM 1948 C CG2 . VAL A ? 264 ? 0.987 -26.237 11.390 1.0 91.22 264 A 1 +ATOM 1949 N N . ASP A ? 265 ? -3.012 -25.589 13.642 1.0 98.09 265 A 1 +ATOM 1950 C CA . ASP A ? 265 ? -4.185 -25.848 14.484 1.0 97.87 265 A 1 +ATOM 1951 C C . ASP A ? 265 ? -5.501 -25.571 13.745 1.0 98.22 265 A 1 +ATOM 1952 O O . ASP A ? 265 ? -6.428 -26.381 13.814 1.0 97.8 265 A 1 +ATOM 1953 C CB . ASP A ? 265 ? -4.130 -24.985 15.749 1.0 96.89 265 A 1 +ATOM 1954 C CG . ASP A ? 265 ? -2.971 -25.335 16.674 1.0 94.49 265 A 1 +ATOM 1955 O OD1 . ASP A ? 265 ? -2.628 -26.536 16.765 1.0 90.45 265 A 1 +ATOM 1956 O OD2 . ASP A ? 265 ? -2.454 -24.375 17.287 1.0 89.3 265 A 1 +ATOM 1957 N N . GLY A ? 266 ? -5.571 -24.479 12.989 1.0 98.05 266 A 1 +ATOM 1958 C CA . GLY A ? 266 ? -6.733 -24.137 12.171 1.0 98.23 266 A 1 +ATOM 1959 C C . GLY A ? 266 ? -7.027 -25.197 11.104 1.0 98.47 266 A 1 +ATOM 1960 O O . GLY A ? 266 ? -8.177 -25.604 10.931 1.0 98.3 266 A 1 +ATOM 1961 N N . ALA A ? 267 ? -5.982 -25.723 10.456 1.0 98.52 267 A 1 +ATOM 1962 C CA . ALA A ? 267 ? -6.129 -26.816 9.494 1.0 98.6 267 A 1 +ATOM 1963 C C . ALA A ? 267 ? -6.689 -28.089 10.157 1.0 98.57 267 A 1 +ATOM 1964 O O . ALA A ? 267 ? -7.633 -28.687 9.640 1.0 98.31 267 A 1 +ATOM 1965 C CB . ALA A ? 267 ? -4.778 -27.071 8.818 1.0 98.54 267 A 1 +ATOM 1966 N N . LYS A ? 268 ? -6.171 -28.471 11.335 1.0 98.48 268 A 1 +ATOM 1967 C CA . LYS A ? 268 ? -6.703 -29.602 12.114 1.0 98.36 268 A 1 +ATOM 1968 C C . LYS A ? 268 ? -8.160 -29.393 12.515 1.0 98.37 268 A 1 +ATOM 1969 O O . LYS A ? 268 ? -8.979 -30.279 12.306 1.0 97.72 268 A 1 +ATOM 1970 C CB . LYS A ? 268 ? -5.851 -29.833 13.372 1.0 97.78 268 A 1 +ATOM 1971 C CG . LYS A ? 268 ? -4.808 -30.935 13.173 1.0 84.65 268 A 1 +ATOM 1972 C CD . LYS A ? 268 ? -4.028 -31.145 14.468 1.0 81.9 268 A 1 +ATOM 1973 C CE . LYS A ? 268 ? -3.061 -32.324 14.336 1.0 70.74 268 A 1 +ATOM 1974 N NZ . LYS A ? 268 ? -2.201 -32.443 15.540 1.0 62.4 268 A 1 +ATOM 1975 N N . LYS A ? 269 ? -8.474 -28.231 13.072 1.0 98.16 269 A 1 +ATOM 1976 C CA . LYS A ? 269 ? -9.815 -27.870 13.552 1.0 98.07 269 A 1 +ATOM 1977 C C . LYS A ? 269 ? -10.875 -27.946 12.454 1.0 98.18 269 A 1 +ATOM 1978 O O . LYS A ? 269 ? -11.991 -28.391 12.707 1.0 97.49 269 A 1 +ATOM 1979 C CB . LYS A ? 269 ? -9.717 -26.455 14.134 1.0 97.32 269 A 1 +ATOM 1980 C CG . LYS A ? 269 ? -11.041 -25.860 14.634 1.0 94.04 269 A 1 +ATOM 1981 C CD . LYS A ? 269 ? -10.729 -24.448 15.125 1.0 92.51 269 A 1 +ATOM 1982 C CE . LYS A ? 269 ? -11.952 -23.602 15.448 1.0 85.95 269 A 1 +ATOM 1983 N NZ . LYS A ? 269 ? -11.511 -22.202 15.630 1.0 82.03 269 A 1 +ATOM 1984 N N . HIS A ? 270 ? -10.518 -27.542 11.244 1.0 98.3 270 A 1 +ATOM 1985 C CA . HIS A ? 270 ? -11.423 -27.527 10.092 1.0 98.25 270 A 1 +ATOM 1986 C C . HIS A ? 270 ? -11.297 -28.766 9.187 1.0 98.28 270 A 1 +ATOM 1987 O O . HIS A ? 270 ? -11.969 -28.837 8.161 1.0 97.33 270 A 1 +ATOM 1988 C CB . HIS A ? 270 ? -11.247 -26.202 9.343 1.0 98.06 270 A 1 +ATOM 1989 C CG . HIS A ? 270 ? -11.716 -25.018 10.147 1.0 97.73 270 A 1 +ATOM 1990 N ND1 . HIS A ? 270 ? -13.028 -24.756 10.499 1.0 89.3 270 A 1 +ATOM 1991 C CD2 . HIS A ? 270 ? -10.944 -24.031 10.703 1.0 89.79 270 A 1 +ATOM 1992 C CE1 . HIS A ? 270 ? -13.039 -23.643 11.241 1.0 90.3 270 A 1 +ATOM 1993 N NE2 . HIS A ? 270 ? -11.795 -23.169 11.390 1.0 92.0 270 A 1 +ATOM 1994 N N . GLY A ? 271 ? -10.457 -29.748 9.550 1.0 98.13 271 A 1 +ATOM 1995 C CA . GLY A ? 271 ? -10.254 -30.969 8.760 1.0 98.01 271 A 1 +ATOM 1996 C C . GLY A ? 271 ? -9.619 -30.720 7.390 1.0 98.18 271 A 1 +ATOM 1997 O O . GLY A ? 271 ? -9.879 -31.459 6.442 1.0 97.06 271 A 1 +ATOM 1998 N N . LEU A ? 272 ? -8.801 -29.677 7.277 1.0 98.26 272 A 1 +ATOM 1999 C CA . LEU A ? 272 ? -8.142 -29.289 6.033 1.0 98.35 272 A 1 +ATOM 2000 C C . LEU A ? 272 ? -6.794 -29.993 5.904 1.0 98.29 272 A 1 +ATOM 2001 O O . LEU A ? 272 ? -6.076 -30.192 6.886 1.0 97.58 272 A 1 +ATOM 2002 C CB . LEU A ? 272 ? -7.968 -27.762 5.973 1.0 98.28 272 A 1 +ATOM 2003 C CG . LEU A ? 272 ? -9.252 -26.955 6.221 1.0 97.96 272 A 1 +ATOM 2004 C CD1 . LEU A ? 272 ? -8.922 -25.470 6.249 1.0 97.29 272 A 1 +ATOM 2005 C CD2 . LEU A ? 272 ? -10.307 -27.207 5.143 1.0 97.16 272 A 1 +ATOM 2006 N N . LYS A ? 273 ? -6.413 -30.320 4.667 1.0 97.88 273 A 1 +ATOM 2007 C CA . LYS A ? 273 ? -5.102 -30.894 4.372 1.0 97.55 273 A 1 +ATOM 2008 C C . LYS A ? 273 ? -4.127 -29.778 3.994 1.0 98.09 273 A 1 +ATOM 2009 O O . LYS A ? 273 ? -4.283 -29.206 2.914 1.0 97.38 273 A 1 +ATOM 2010 C CB . LYS A ? 273 ? -5.254 -31.969 3.289 1.0 95.61 273 A 1 +ATOM 2011 C CG . LYS A ? 273 ? -3.971 -32.802 3.178 1.0 87.65 273 A 1 +ATOM 2012 C CD . LYS A ? 273 ? -4.148 -33.933 2.156 1.0 81.84 273 A 1 +ATOM 2013 C CE . LYS A ? 273 ? -2.874 -34.781 2.135 1.0 71.34 273 A 1 +ATOM 2014 N NZ . LYS A ? 273 ? -2.961 -35.888 1.160 1.0 62.38 273 A 1 +ATOM 2015 N N . PRO A ? 274 ? -3.108 -29.474 4.822 1.0 98.4 274 A 1 +ATOM 2016 C CA . PRO A ? 274 ? -2.082 -28.514 4.440 1.0 98.48 274 A 1 +ATOM 2017 C C . PRO A ? 274 ? -1.327 -28.985 3.195 1.0 98.6 274 A 1 +ATOM 2018 O O . PRO A ? 274 ? -0.955 -30.154 3.084 1.0 98.15 274 A 1 +ATOM 2019 C CB . PRO A ? 274 ? -1.166 -28.357 5.655 1.0 97.84 274 A 1 +ATOM 2020 C CG . PRO A ? 274 ? -2.014 -28.857 6.822 1.0 95.24 274 A 1 +ATOM 2021 C CD . PRO A ? 274 ? -2.875 -29.938 6.178 1.0 97.79 274 A 1 +ATOM 2022 N N . LEU A ? 275 ? -1.091 -28.073 2.259 1.0 98.75 275 A 1 +ATOM 2023 C CA . LEU A ? 275 ? -0.354 -28.332 1.019 1.0 98.74 275 A 1 +ATOM 2024 C C . LEU A ? 275 ? 1.132 -27.999 1.171 1.0 98.77 275 A 1 +ATOM 2025 O O . LEU A ? 275 ? 1.985 -28.756 0.716 1.0 98.42 275 A 1 +ATOM 2026 C CB . LEU A ? 275 ? -0.985 -27.522 -0.128 1.0 98.6 275 A 1 +ATOM 2027 C CG . LEU A ? 275 ? -2.467 -27.828 -0.424 1.0 98.11 275 A 1 +ATOM 2028 C CD1 . LEU A ? 275 ? -2.955 -26.915 -1.540 1.0 97.22 275 A 1 +ATOM 2029 C CD2 . LEU A ? 275 ? -2.679 -29.280 -0.857 1.0 96.88 275 A 1 +ATOM 2030 N N . ALA A ? 276 ? 1.426 -26.878 1.824 1.0 98.79 276 A 1 +ATOM 2031 C CA . ALA A ? 276 ? 2.775 -26.422 2.124 1.0 98.86 276 A 1 +ATOM 2032 C C . ALA A ? 276 ? 2.782 -25.569 3.400 1.0 98.9 276 A 1 +ATOM 2033 O O . ALA A ? 276 ? 1.759 -24.985 3.762 1.0 98.81 276 A 1 +ATOM 2034 C CB . ALA A ? 276 ? 3.310 -25.635 0.921 1.0 98.78 276 A 1 +ATOM 2035 N N . ARG A ? 277 ? 3.932 -25.467 4.069 1.0 98.8 277 A 1 +ATOM 2036 C CA . ARG A ? 277 ? 4.168 -24.538 5.185 1.0 98.74 277 A 1 +ATOM 2037 C C . ARG A ? 277 ? 5.083 -23.392 4.761 1.0 98.83 277 A 1 +ATOM 2038 O O . ARG A ? 277 ? 5.940 -23.566 3.897 1.0 98.7 277 A 1 +ATOM 2039 C CB . ARG A ? 277 ? 4.706 -25.286 6.414 1.0 98.05 277 A 1 +ATOM 2040 C CG . ARG A ? 277 ? 6.086 -25.925 6.186 1.0 95.02 277 A 1 +ATOM 2041 C CD . ARG A ? 277 ? 6.591 -26.688 7.417 1.0 93.98 277 A 1 +ATOM 2042 N NE . ARG A ? 277 ? 5.681 -27.799 7.772 1.0 88.66 277 A 1 +ATOM 2043 C CZ . ARG A ? 277 ? 5.868 -28.691 8.722 1.0 87.92 277 A 1 +ATOM 2044 N NH1 . ARG A ? 277 ? 6.937 -28.701 9.455 1.0 79.35 277 A 1 +ATOM 2045 N NH2 . ARG A ? 277 ? 4.967 -29.603 8.945 1.0 79.53 277 A 1 +ATOM 2046 N N . MET A ? 278 ? 4.934 -22.248 5.406 1.0 98.75 278 A 1 +ATOM 2047 C CA . MET A ? 278 ? 5.850 -21.119 5.260 1.0 98.73 278 A 1 +ATOM 2048 C C . MET A ? 278 ? 7.145 -21.404 6.031 1.0 98.66 278 A 1 +ATOM 2049 O O . MET A ? 278 ? 7.096 -21.821 7.186 1.0 98.27 278 A 1 +ATOM 2050 C CB . MET A ? 278 ? 5.148 -19.852 5.772 1.0 98.5 278 A 1 +ATOM 2051 C CG . MET A ? 278 ? 5.931 -18.569 5.470 1.0 96.71 278 A 1 +ATOM 2052 S SD . MET A ? 278 ? 6.023 -18.101 3.719 1.0 96.88 278 A 1 +ATOM 2053 C CE . MET A ? 278 ? 4.342 -17.492 3.472 1.0 93.16 278 A 1 +ATOM 2054 N N . LEU A ? 279 ? 8.304 -21.165 5.422 1.0 98.67 279 A 1 +ATOM 2055 C CA . LEU A ? 279 ? 9.607 -21.229 6.097 1.0 98.6 279 A 1 +ATOM 2056 C C . LEU A ? 279 ? 10.223 -19.844 6.302 1.0 98.39 279 A 1 +ATOM 2057 O O . LEU A ? 279 ? 10.869 -19.602 7.316 1.0 97.8 279 A 1 +ATOM 2058 C CB . LEU A ? 279 ? 10.579 -22.134 5.323 1.0 98.61 279 A 1 +ATOM 2059 C CG . LEU A ? 279 ? 10.155 -23.599 5.140 1.0 98.18 279 A 1 +ATOM 2060 C CD1 . LEU A ? 279 ? 11.297 -24.362 4.465 1.0 97.57 279 A 1 +ATOM 2061 C CD2 . LEU A ? 279 ? 9.829 -24.302 6.456 1.0 97.38 279 A 1 +ATOM 2062 N N . ALA A ? 280 ? 10.032 -18.940 5.346 1.0 98.63 280 A 1 +ATOM 2063 C CA . ALA A ? 280 ? 10.471 -17.555 5.448 1.0 98.66 280 A 1 +ATOM 2064 C C . ALA A ? 280 ? 9.702 -16.655 4.478 1.0 98.76 280 A 1 +ATOM 2065 O O . ALA A ? 280 ? 9.296 -17.080 3.397 1.0 98.64 280 A 1 +ATOM 2066 C CB . ALA A ? 280 ? 11.976 -17.472 5.158 1.0 98.41 280 A 1 +ATOM 2067 N N . TYR A ? 281 ? 9.588 -15.386 4.836 1.0 98.71 281 A 1 +ATOM 2068 C CA . TYR A ? 281 ? 9.196 -14.303 3.935 1.0 98.63 281 A 1 +ATOM 2069 C C . TYR A ? 281 ? 10.032 -13.064 4.245 1.0 98.55 281 A 1 +ATOM 2070 O O . TYR A ? 281 ? 10.495 -12.880 5.373 1.0 98.08 281 A 1 +ATOM 2071 C CB . TYR A ? 281 ? 7.688 -14.032 4.034 1.0 98.46 281 A 1 +ATOM 2072 C CG . TYR A ? 281 ? 7.200 -13.642 5.415 1.0 98.52 281 A 1 +ATOM 2073 C CD1 . TYR A ? 281 ? 6.736 -14.632 6.313 1.0 98.08 281 A 1 +ATOM 2074 C CD2 . TYR A ? 281 ? 7.198 -12.293 5.818 1.0 98.05 281 A 1 +ATOM 2075 C CE1 . TYR A ? 281 ? 6.281 -14.280 7.593 1.0 97.69 281 A 1 +ATOM 2076 C CE2 . TYR A ? 281 ? 6.746 -11.929 7.100 1.0 97.67 281 A 1 +ATOM 2077 C CZ . TYR A ? 281 ? 6.289 -12.928 7.985 1.0 97.86 281 A 1 +ATOM 2078 O OH . TYR A ? 281 ? 5.848 -12.573 9.231 1.0 96.96 281 A 1 +ATOM 2079 N N . GLY A ? 282 ? 10.266 -12.224 3.246 1.0 98.68 282 A 1 +ATOM 2080 C CA . GLY A ? 282 ? 11.074 -11.027 3.421 1.0 98.67 282 A 1 +ATOM 2081 C C . GLY A ? 282 ? 11.079 -10.132 2.193 1.0 98.82 282 A 1 +ATOM 2082 O O . GLY A ? 282 ? 10.578 -10.488 1.127 1.0 98.62 282 A 1 +ATOM 2083 N N . ASP A ? 283 ? 11.678 -8.964 2.370 1.0 98.79 283 A 1 +ATOM 2084 C CA . ASP A ? 283 ? 11.811 -7.953 1.332 1.0 98.74 283 A 1 +ATOM 2085 C C . ASP A ? 283 ? 13.245 -7.407 1.322 1.0 98.75 283 A 1 +ATOM 2086 O O . ASP A ? 283 ? 13.931 -7.346 2.349 1.0 98.31 283 A 1 +ATOM 2087 C CB . ASP A ? 283 ? 10.799 -6.825 1.573 1.0 98.38 283 A 1 +ATOM 2088 C CG . ASP A ? 283 ? 9.330 -7.250 1.468 1.0 97.13 283 A 1 +ATOM 2089 O OD1 . ASP A ? 283 ? 8.811 -7.294 0.329 1.0 92.27 283 A 1 +ATOM 2090 O OD2 . ASP A ? 283 ? 8.665 -7.406 2.512 1.0 91.59 283 A 1 +ATOM 2091 N N . ALA A ? 284 ? 13.693 -6.980 0.147 1.0 98.74 284 A 1 +ATOM 2092 C CA . ALA A ? 284 ? 14.907 -6.203 -0.041 1.0 98.73 284 A 1 +ATOM 2093 C C . ALA A ? 284 ? 14.616 -5.027 -0.978 1.0 98.78 284 A 1 +ATOM 2094 O O . ALA A ? 284 ? 13.662 -5.062 -1.754 1.0 98.37 284 A 1 +ATOM 2095 C CB . ALA A ? 284 ? 16.027 -7.109 -0.571 1.0 98.39 284 A 1 +ATOM 2096 N N . ALA A ? 285 ? 15.435 -3.986 -0.913 1.0 98.62 285 A 1 +ATOM 2097 C CA . ALA A ? 285 ? 15.344 -2.849 -1.816 1.0 98.65 285 A 1 +ATOM 2098 C C . ALA A ? 285 ? 16.724 -2.238 -2.081 1.0 98.65 285 A 1 +ATOM 2099 O O . ALA A ? 285 ? 17.653 -2.385 -1.287 1.0 98.19 285 A 1 +ATOM 2100 C CB . ALA A ? 285 ? 14.338 -1.832 -1.255 1.0 98.36 285 A 1 +ATOM 2101 N N . THR A ? 286 ? 16.842 -1.555 -3.225 1.0 98.48 286 A 1 +ATOM 2102 C CA . THR A ? 286 ? 18.040 -0.848 -3.690 1.0 98.46 286 A 1 +ATOM 2103 C C . THR A ? 286 ? 17.628 0.383 -4.510 1.0 98.5 286 A 1 +ATOM 2104 O O . THR A ? 286 ? 16.470 0.812 -4.450 1.0 98.04 286 A 1 +ATOM 2105 C CB . THR A ? 286 ? 18.949 -1.830 -4.456 1.0 98.01 286 A 1 +ATOM 2106 O OG1 . THR A ? 286 ? 20.184 -1.208 -4.735 1.0 96.27 286 A 1 +ATOM 2107 C CG2 . THR A ? 286 ? 18.361 -2.328 -5.778 1.0 95.91 286 A 1 +ATOM 2108 N N . HIS A ? 287 ? 18.548 0.970 -5.266 1.0 98.36 287 A 1 +ATOM 2109 C CA . HIS A ? 287 ? 18.238 2.094 -6.151 1.0 98.28 287 A 1 +ATOM 2110 C C . HIS A ? 287 ? 17.110 1.739 -7.135 1.0 98.41 287 A 1 +ATOM 2111 O O . HIS A ? 287 ? 17.127 0.651 -7.711 1.0 98.17 287 A 1 +ATOM 2112 C CB . HIS A ? 287 ? 19.496 2.530 -6.905 1.0 98.02 287 A 1 +ATOM 2113 C CG . HIS A ? 287 ? 20.516 3.160 -6.003 1.0 95.47 287 A 1 +ATOM 2114 N ND1 . HIS A ? 287 ? 20.454 4.433 -5.476 1.0 84.3 287 A 1 +ATOM 2115 C CD2 . HIS A ? 287 ? 21.658 2.580 -5.505 1.0 84.43 287 A 1 +ATOM 2116 C CE1 . HIS A ? 287 ? 21.530 4.614 -4.696 1.0 86.93 287 A 1 +ATOM 2117 N NE2 . HIS A ? 287 ? 22.286 3.509 -4.685 1.0 87.94 287 A 1 +ATOM 2118 N N . PRO A ? 288 ? 16.146 2.648 -7.372 1.0 98.27 288 A 1 +ATOM 2119 C CA . PRO A ? 288 ? 14.967 2.371 -8.205 1.0 98.22 288 A 1 +ATOM 2120 C C . PRO A ? 288 ? 15.285 1.774 -9.582 1.0 98.29 288 A 1 +ATOM 2121 O O . PRO A ? 288 ? 14.676 0.780 -9.982 1.0 98.17 288 A 1 +ATOM 2122 C CB . PRO A ? 288 ? 14.253 3.720 -8.318 1.0 98.14 288 A 1 +ATOM 2123 C CG . PRO A ? 288 ? 14.554 4.375 -6.973 1.0 97.71 288 A 1 +ATOM 2124 C CD . PRO A ? 288 ? 15.995 3.939 -6.706 1.0 98.35 288 A 1 +ATOM 2125 N N . ILE A ? 289 ? 16.287 2.327 -10.269 1.0 98.46 289 A 1 +ATOM 2126 C CA . ILE A ? 289 ? 16.712 1.869 -11.599 1.0 98.56 289 A 1 +ATOM 2127 C C . ILE A ? 289 ? 17.272 0.433 -11.593 1.0 98.62 289 A 1 +ATOM 2128 O O . ILE A ? 289 ? 17.291 -0.235 -12.625 1.0 98.35 289 A 1 +ATOM 2129 C CB . ILE A ? 289 ? 17.719 2.888 -12.183 1.0 98.31 289 A 1 +ATOM 2130 C CG1 . ILE A ? 289 ? 17.837 2.717 -13.710 1.0 96.72 289 A 1 +ATOM 2131 C CG2 . ILE A ? 289 ? 19.104 2.803 -11.495 1.0 96.35 289 A 1 +ATOM 2132 C CD1 . ILE A ? 289 ? 18.591 3.852 -14.410 1.0 94.81 289 A 1 +ATOM 2133 N N . ASP A ? 290 ? 17.696 -0.058 -10.434 1.0 98.62 290 A 1 +ATOM 2134 C CA . ASP A ? 290 ? 18.326 -1.364 -10.253 1.0 98.64 290 A 1 +ATOM 2135 C C . ASP A ? 290 ? 17.359 -2.438 -9.733 1.0 98.68 290 A 1 +ATOM 2136 O O . ASP A ? 290 ? 17.801 -3.474 -9.229 1.0 98.36 290 A 1 +ATOM 2137 C CB . ASP A ? 290 ? 19.590 -1.207 -9.386 1.0 98.48 290 A 1 +ATOM 2138 C CG . ASP A ? 290 ? 20.709 -0.493 -10.141 1.0 98.32 290 A 1 +ATOM 2139 O OD1 . ASP A ? 290 ? 20.952 -0.857 -11.313 1.0 96.8 290 A 1 +ATOM 2140 O OD2 . ASP A ? 290 ? 21.356 0.421 -9.599 1.0 96.78 290 A 1 +ATOM 2141 N N . PHE A ? 291 ? 16.039 -2.261 -9.885 1.0 98.7 291 A 1 +ATOM 2142 C CA . PHE A ? 291 ? 15.062 -3.267 -9.432 1.0 98.69 291 A 1 +ATOM 2143 C C . PHE A ? 291 ? 15.372 -4.687 -9.942 1.0 98.77 291 A 1 +ATOM 2144 O O . PHE A ? 291 ? 15.090 -5.667 -9.254 1.0 98.59 291 A 1 +ATOM 2145 C CB . PHE A ? 291 ? 13.635 -2.853 -9.831 1.0 98.45 291 A 1 +ATOM 2146 C CG . PHE A ? 291 ? 13.309 -3.013 -11.305 1.0 98.53 291 A 1 +ATOM 2147 C CD1 . PHE A ? 291 ? 13.333 -1.904 -12.161 1.0 97.35 291 A 1 +ATOM 2148 C CD2 . PHE A ? 291 ? 13.026 -4.286 -11.842 1.0 97.3 291 A 1 +ATOM 2149 C CE1 . PHE A ? 291 ? 13.099 -2.066 -13.538 1.0 96.34 291 A 1 +ATOM 2150 C CE2 . PHE A ? 291 ? 12.803 -4.455 -13.221 1.0 95.97 291 A 1 +ATOM 2151 C CZ . PHE A ? 291 ? 12.845 -3.342 -14.066 1.0 97.17 291 A 1 +ATOM 2152 N N . GLY A ? 292 ? 15.978 -4.805 -11.117 1.0 98.63 292 A 1 +ATOM 2153 C CA . GLY A ? 292 ? 16.318 -6.090 -11.732 1.0 98.65 292 A 1 +ATOM 2154 C C . GLY A ? 292 ? 17.322 -6.929 -10.932 1.0 98.76 292 A 1 +ATOM 2155 O O . GLY A ? 292 ? 17.324 -8.153 -11.052 1.0 98.49 292 A 1 +ATOM 2156 N N . ILE A ? 293 ? 18.134 -6.304 -10.077 1.0 98.81 293 A 1 +ATOM 2157 C CA . ILE A ? 293 ? 19.112 -7.000 -9.222 1.0 98.76 293 A 1 +ATOM 2158 C C . ILE A ? 293 ? 18.555 -7.339 -7.830 1.0 98.8 293 A 1 +ATOM 2159 O O . ILE A ? 293 ? 19.136 -8.153 -7.114 1.0 98.43 293 A 1 +ATOM 2160 C CB . ILE A ? 293 ? 20.454 -6.234 -9.140 1.0 98.4 293 A 1 +ATOM 2161 C CG1 . ILE A ? 293 ? 20.385 -4.991 -8.228 1.0 96.55 293 A 1 +ATOM 2162 C CG2 . ILE A ? 293 ? 20.951 -5.862 -10.554 1.0 95.32 293 A 1 +ATOM 2163 C CD1 . ILE A ? 293 ? 21.734 -4.298 -7.987 1.0 94.17 293 A 1 +ATOM 2164 N N . ALA A ? 294 ? 17.426 -6.742 -7.437 1.0 98.8 294 A 1 +ATOM 2165 C CA . ALA A ? 294 ? 16.874 -6.885 -6.092 1.0 98.83 294 A 1 +ATOM 2166 C C . ALA A ? 294 ? 16.475 -8.332 -5.706 1.0 98.87 294 A 1 +ATOM 2167 O O . ALA A ? 294 ? 16.649 -8.685 -4.536 1.0 98.8 294 A 1 +ATOM 2168 C CB . ALA A ? 294 ? 15.731 -5.876 -5.912 1.0 98.74 294 A 1 +ATOM 2169 N N . PRO A ? 295 ? 16.029 -9.219 -6.624 1.0 98.88 295 A 1 +ATOM 2170 C CA . PRO A ? 295 ? 15.832 -10.638 -6.306 1.0 98.89 295 A 1 +ATOM 2171 C C . PRO A ? 295 ? 17.097 -11.326 -5.779 1.0 98.9 295 A 1 +ATOM 2172 O O . PRO A ? 295 ? 17.022 -12.093 -4.820 1.0 98.85 295 A 1 +ATOM 2173 C CB . PRO A ? 295 ? 15.327 -11.287 -7.597 1.0 98.83 295 A 1 +ATOM 2174 C CG . PRO A ? 295 ? 14.617 -10.137 -8.299 1.0 98.45 295 A 1 +ATOM 2175 C CD . PRO A ? 295 ? 15.505 -8.942 -7.950 1.0 98.83 295 A 1 +ATOM 2176 N N . ALA A ? 296 ? 18.271 -10.993 -6.327 1.0 98.87 296 A 1 +ATOM 2177 C CA . ALA A ? 296 ? 19.548 -11.525 -5.849 1.0 98.84 296 A 1 +ATOM 2178 C C . ALA A ? 296 ? 19.907 -11.051 -4.426 1.0 98.84 296 A 1 +ATOM 2179 O O . ALA A ? 296 ? 20.702 -11.696 -3.748 1.0 98.59 296 A 1 +ATOM 2180 C CB . ALA A ? 296 ? 20.644 -11.158 -6.856 1.0 98.68 296 A 1 +ATOM 2181 N N . SER A ? 297 ? 19.297 -9.964 -3.947 1.0 98.84 297 A 1 +ATOM 2182 C CA . SER A ? 297 ? 19.448 -9.466 -2.574 1.0 98.76 297 A 1 +ATOM 2183 C C . SER A ? 297 ? 18.429 -10.070 -1.604 1.0 98.84 297 A 1 +ATOM 2184 O O . SER A ? 297 ? 18.758 -10.322 -0.447 1.0 98.56 297 A 1 +ATOM 2185 C CB . SER A ? 297 ? 19.328 -7.939 -2.549 1.0 98.27 297 A 1 +ATOM 2186 O OG . SER A ? 297 ? 20.331 -7.353 -3.350 1.0 90.91 297 A 1 +ATOM 2187 N N . VAL A ? 298 ? 17.194 -10.323 -2.048 1.0 98.85 298 A 1 +ATOM 2188 C CA . VAL A ? 298 ? 16.157 -10.891 -1.172 1.0 98.89 298 A 1 +ATOM 2189 C C . VAL A ? 298 ? 16.361 -12.385 -0.919 1.0 98.91 298 A 1 +ATOM 2190 O O . VAL A ? 298 ? 16.130 -12.846 0.196 1.0 98.86 298 A 1 +ATOM 2191 C CB . VAL A ? 298 ? 14.735 -10.566 -1.673 1.0 98.77 298 A 1 +ATOM 2192 C CG1 . VAL A ? 298 ? 14.242 -11.461 -2.803 1.0 98.03 298 A 1 +ATOM 2193 C CG2 . VAL A ? 298 ? 13.730 -10.644 -0.517 1.0 97.05 298 A 1 +ATOM 2194 N N . ILE A ? 299 ? 16.841 -13.136 -1.915 1.0 98.9 299 A 1 +ATOM 2195 C CA . ILE A ? 299 ? 17.052 -14.587 -1.800 1.0 98.91 299 A 1 +ATOM 2196 C C . ILE A ? 299 ? 18.001 -14.942 -0.639 1.0 98.89 299 A 1 +ATOM 2197 O O . ILE A ? 299 ? 17.598 -15.727 0.218 1.0 98.86 299 A 1 +ATOM 2198 C CB . ILE A ? 299 ? 17.463 -15.196 -3.160 1.0 98.91 299 A 1 +ATOM 2199 C CG1 . ILE A ? 299 ? 16.236 -15.248 -4.097 1.0 98.75 299 A 1 +ATOM 2200 C CG2 . ILE A ? 299 ? 18.067 -16.606 -2.989 1.0 98.77 299 A 1 +ATOM 2201 C CD1 . ILE A ? 299 ? 16.589 -15.515 -5.567 1.0 98.43 299 A 1 +ATOM 2202 N N . PRO A ? 300 ? 19.207 -14.353 -0.512 1.0 98.89 300 A 1 +ATOM 2203 C CA . PRO A ? 300 ? 20.075 -14.603 0.647 1.0 98.83 300 A 1 +ATOM 2204 C C . PRO A ? 300 ? 19.423 -14.242 1.987 1.0 98.79 300 A 1 +ATOM 2205 O O . PRO A ? 300 ? 19.655 -14.915 2.993 1.0 98.57 300 A 1 +ATOM 2206 C CB . PRO A ? 300 ? 21.336 -13.765 0.409 1.0 98.66 300 A 1 +ATOM 2207 C CG . PRO A ? 300 ? 21.381 -13.608 -1.108 1.0 97.73 300 A 1 +ATOM 2208 C CD . PRO A ? 300 ? 19.903 -13.517 -1.477 1.0 98.72 300 A 1 +ATOM 2209 N N . LYS A ? 301 ? 18.582 -13.204 2.012 1.0 98.79 301 A 1 +ATOM 2210 C CA . LYS A ? 301 ? 17.853 -12.770 3.210 1.0 98.64 301 A 1 +ATOM 2211 C C . LYS A ? 301 ? 16.869 -13.839 3.687 1.0 98.64 301 A 1 +ATOM 2212 O O . LYS A ? 301 ? 16.901 -14.222 4.853 1.0 98.22 301 A 1 +ATOM 2213 C CB . LYS A ? 301 ? 17.137 -11.435 2.927 1.0 98.14 301 A 1 +ATOM 2214 C CG . LYS A ? 301 ? 17.550 -10.303 3.873 1.0 90.5 301 A 1 +ATOM 2215 C CD . LYS A ? 301 ? 16.775 -9.029 3.524 1.0 90.17 301 A 1 +ATOM 2216 C CE . LYS A ? 301 ? 17.145 -7.854 4.442 1.0 82.51 301 A 1 +ATOM 2217 N NZ . LYS A ? 301 ? 16.352 -6.643 4.111 1.0 75.42 301 A 1 +ATOM 2218 N N . VAL A ? 302 ? 16.026 -14.350 2.782 1.0 98.69 302 A 1 +ATOM 2219 C CA . VAL A ? 302 ? 15.024 -15.371 3.139 1.0 98.75 302 A 1 +ATOM 2220 C C . VAL A ? 302 ? 15.656 -16.743 3.392 1.0 98.73 302 A 1 +ATOM 2221 O O . VAL A ? 302 ? 15.226 -17.440 4.306 1.0 98.61 302 A 1 +ATOM 2222 C CB . VAL A ? 302 ? 13.858 -15.456 2.130 1.0 98.69 302 A 1 +ATOM 2223 C CG1 . VAL A ? 302 ? 13.057 -14.150 2.130 1.0 98.13 302 A 1 +ATOM 2224 C CG2 . VAL A ? 302 ? 14.284 -15.777 0.698 1.0 97.21 302 A 1 +ATOM 2225 N N . LEU A ? 303 ? 16.736 -17.101 2.684 1.0 98.8 303 A 1 +ATOM 2226 C CA . LEU A ? 303 ? 17.524 -18.302 2.991 1.0 98.77 303 A 1 +ATOM 2227 C C . LEU A ? 303 ? 18.063 -18.255 4.426 1.0 98.64 303 A 1 +ATOM 2228 O O . LEU A ? 303 ? 17.876 -19.202 5.190 1.0 98.44 303 A 1 +ATOM 2229 C CB . LEU A ? 303 ? 18.690 -18.440 1.995 1.0 98.81 303 A 1 +ATOM 2230 C CG . LEU A ? 303 ? 18.297 -18.952 0.597 1.0 98.58 303 A 1 +ATOM 2231 C CD1 . LEU A ? 303 ? 19.489 -18.806 -0.347 1.0 98.23 303 A 1 +ATOM 2232 C CD2 . LEU A ? 303 ? 17.898 -20.427 0.618 1.0 98.21 303 A 1 +ATOM 2233 N N . LYS A ? 304 ? 18.662 -17.128 4.825 1.0 98.61 304 A 1 +ATOM 2234 C CA . LYS A ? 304 ? 19.174 -16.941 6.188 1.0 98.43 304 A 1 +ATOM 2235 C C . LYS A ? 304 ? 18.063 -17.016 7.241 1.0 98.24 304 A 1 +ATOM 2236 O O . LYS A ? 304 ? 18.275 -17.615 8.291 1.0 97.77 304 A 1 +ATOM 2237 C CB . LYS A ? 304 ? 19.941 -15.614 6.256 1.0 98.28 304 A 1 +ATOM 2238 C CG . LYS A ? 304 ? 20.656 -15.437 7.605 1.0 94.77 304 A 1 +ATOM 2239 C CD . LYS A ? 304 ? 21.455 -14.131 7.632 1.0 90.11 304 A 1 +ATOM 2240 C CE . LYS A ? 304 ? 22.163 -13.996 8.984 1.0 80.7 304 A 1 +ATOM 2241 N NZ . LYS A ? 304 ? 22.948 -12.742 9.080 1.0 70.96 304 A 1 +ATOM 2242 N N . LEU A ? 305 ? 16.896 -16.433 6.967 1.0 98.2 305 A 1 +ATOM 2243 C CA . LEU A ? 305 ? 15.732 -16.503 7.864 1.0 97.78 305 A 1 +ATOM 2244 C C . LEU A ? 305 ? 15.210 -17.939 8.025 1.0 97.78 305 A 1 +ATOM 2245 O O . LEU A ? 305 ? 14.829 -18.327 9.127 1.0 97.04 305 A 1 +ATOM 2246 C CB . LEU A ? 305 ? 14.614 -15.586 7.332 1.0 97.26 305 A 1 +ATOM 2247 C CG . LEU A ? 305 ? 14.868 -14.076 7.523 1.0 95.82 305 A 1 +ATOM 2248 C CD1 . LEU A ? 305 ? 13.832 -13.279 6.736 1.0 94.15 305 A 1 +ATOM 2249 C CD2 . LEU A ? 305 ? 14.783 -13.658 8.993 1.0 93.96 305 A 1 +ATOM 2250 N N . ALA A ? 306 ? 15.239 -18.735 6.955 1.0 97.99 306 A 1 +ATOM 2251 C CA . ALA A ? 306 ? 14.838 -20.143 6.983 1.0 98.16 306 A 1 +ATOM 2252 C C . ALA A ? 306 ? 15.929 -21.088 7.533 1.0 98.21 306 A 1 +ATOM 2253 O O . ALA A ? 306 ? 15.657 -22.265 7.762 1.0 97.86 306 A 1 +ATOM 2254 C CB . ALA A ? 306 ? 14.413 -20.543 5.565 1.0 98.24 306 A 1 +ATOM 2255 N N . GLY A ? 307 ? 17.158 -20.601 7.727 1.0 98.11 307 A 1 +ATOM 2256 C CA . GLY A ? 307 ? 18.308 -21.434 8.110 1.0 98.13 307 A 1 +ATOM 2257 C C . GLY A ? 307 ? 18.751 -22.395 7.000 1.0 98.42 307 A 1 +ATOM 2258 O O . GLY A ? 307 ? 19.216 -23.494 7.295 1.0 97.95 307 A 1 +ATOM 2259 N N . LEU A ? 308 ? 18.594 -21.996 5.741 1.0 98.46 308 A 1 +ATOM 2260 C CA . LEU A ? 308 ? 18.860 -22.818 4.560 1.0 98.65 308 A 1 +ATOM 2261 C C . LEU A ? 308 ? 19.997 -22.249 3.702 1.0 98.72 308 A 1 +ATOM 2262 O O . LEU A ? 308 ? 20.370 -21.079 3.791 1.0 98.5 308 A 1 +ATOM 2263 C CB . LEU A ? 308 ? 17.566 -22.975 3.740 1.0 98.59 308 A 1 +ATOM 2264 C CG . LEU A ? 308 ? 16.416 -23.705 4.453 1.0 98.27 308 A 1 +ATOM 2265 C CD1 . LEU A ? 308 ? 15.190 -23.710 3.542 1.0 97.65 308 A 1 +ATOM 2266 C CD2 . LEU A ? 308 ? 16.758 -25.156 4.803 1.0 97.6 308 A 1 +ATOM 2267 N N . GLN A ? 309 ? 20.517 -23.089 2.815 1.0 98.71 309 A 1 +ATOM 2268 C CA . GLN A ? 309 ? 21.452 -22.722 1.756 1.0 98.7 309 A 1 +ATOM 2269 C C . GLN A ? 309 ? 20.797 -22.918 0.384 1.0 98.81 309 A 1 +ATOM 2270 O O . GLN A ? 309 ? 19.776 -23.591 0.257 1.0 98.56 309 A 1 +ATOM 2271 C CB . GLN A ? 309 ? 22.738 -23.554 1.879 1.0 98.29 309 A 1 +ATOM 2272 C CG . GLN A ? 309 ? 23.463 -23.318 3.213 1.0 94.91 309 A 1 +ATOM 2273 C CD . GLN A ? 309 ? 24.826 -24.010 3.296 1.0 87.88 309 A 1 +ATOM 2274 O OE1 . GLN A ? 309 ? 25.244 -24.796 2.457 1.0 76.53 309 A 1 +ATOM 2275 N NE2 . GLN A ? 309 ? 25.587 -23.733 4.330 1.0 73.39 309 A 1 +ATOM 2276 N N . ILE A ? 310 ? 21.421 -22.376 -0.665 1.0 98.77 310 A 1 +ATOM 2277 C CA . ILE A ? 310 ? 20.942 -22.512 -2.056 1.0 98.77 310 A 1 +ATOM 2278 C C . ILE A ? 310 ? 20.687 -23.984 -2.435 1.0 98.77 310 A 1 +ATOM 2279 O O . ILE A ? 310 ? 19.664 -24.299 -3.034 1.0 98.51 310 A 1 +ATOM 2280 C CB . ILE A ? 310 ? 21.958 -21.842 -3.013 1.0 98.56 310 A 1 +ATOM 2281 C CG1 . ILE A ? 310 ? 21.879 -20.308 -2.845 1.0 97.38 310 A 1 +ATOM 2282 C CG2 . ILE A ? 310 ? 21.724 -22.239 -4.484 1.0 97.75 310 A 1 +ATOM 2283 C CD1 . ILE A ? 310 ? 23.030 -19.542 -3.500 1.0 93.79 310 A 1 +ATOM 2284 N N . LYS A ? 311 ? 21.587 -24.894 -2.035 1.0 98.64 311 A 1 +ATOM 2285 C CA . LYS A ? 311 ? 21.490 -26.336 -2.326 1.0 98.49 311 A 1 +ATOM 2286 C C . LYS A ? 311 ? 20.258 -27.025 -1.723 1.0 98.61 311 A 1 +ATOM 2287 O O . LYS A ? 311 ? 19.901 -28.104 -2.180 1.0 98.16 311 A 1 +ATOM 2288 C CB . LYS A ? 311 ? 22.782 -27.036 -1.867 1.0 97.88 311 A 1 +ATOM 2289 C CG . LYS A ? 311 ? 22.930 -27.028 -0.336 1.0 91.96 311 A 1 +ATOM 2290 C CD . LYS A ? 311 ? 24.192 -27.760 0.134 1.0 87.77 311 A 1 +ATOM 2291 C CE . LYS A ? 311 ? 24.131 -27.769 1.660 1.0 76.02 311 A 1 +ATOM 2292 N NZ . LYS A ? 311 ? 25.306 -28.428 2.272 1.0 68.23 311 A 1 +ATOM 2293 N N . ASP A ? 312 ? 19.643 -26.425 -0.700 1.0 98.69 312 A 1 +ATOM 2294 C CA . ASP A ? 312 ? 18.481 -26.992 -0.004 1.0 98.72 312 A 1 +ATOM 2295 C C . ASP A ? 312 ? 17.156 -26.671 -0.718 1.0 98.81 312 A 1 +ATOM 2296 O O . ASP A ? 312 ? 16.105 -27.206 -0.341 1.0 98.61 312 A 1 +ATOM 2297 C CB . ASP A ? 312 ? 18.450 -26.485 1.449 1.0 98.61 312 A 1 +ATOM 2298 C CG . ASP A ? 312 ? 19.736 -26.773 2.232 1.0 98.41 312 A 1 +ATOM 2299 O OD1 . ASP A ? 312 ? 20.238 -27.920 2.168 1.0 96.98 312 A 1 +ATOM 2300 O OD2 . ASP A ? 312 ? 20.240 -25.834 2.890 1.0 96.98 312 A 1 +ATOM 2301 N N . ILE A ? 313 ? 17.204 -25.810 -1.737 1.0 98.82 313 A 1 +ATOM 2302 C CA . ILE A ? 313 ? 16.049 -25.444 -2.558 1.0 98.88 313 A 1 +ATOM 2303 C C . ILE A ? 313 ? 15.959 -26.377 -3.772 1.0 98.88 313 A 1 +ATOM 2304 O O . ILE A ? 313 ? 16.887 -26.475 -4.575 1.0 98.77 313 A 1 +ATOM 2305 C CB . ILE A ? 313 ? 16.112 -23.960 -2.972 1.0 98.86 313 A 1 +ATOM 2306 C CG1 . ILE A ? 313 ? 16.248 -22.998 -1.768 1.0 98.53 313 A 1 +ATOM 2307 C CG2 . ILE A ? 313 ? 14.884 -23.575 -3.821 1.0 98.68 313 A 1 +ATOM 2308 C CD1 . ILE A ? 313 ? 15.123 -23.081 -0.715 1.0 98.25 313 A 1 +ATOM 2309 N N . ASP A ? 314 ? 14.821 -27.032 -3.916 1.0 98.86 314 A 1 +ATOM 2310 C CA . ASP A ? 314 ? 14.543 -27.961 -5.016 1.0 98.83 314 A 1 +ATOM 2311 C C . ASP A ? 314 ? 14.071 -27.238 -6.284 1.0 98.84 314 A 1 +ATOM 2312 O O . ASP A ? 314 ? 14.454 -27.627 -7.390 1.0 98.53 314 A 1 +ATOM 2313 C CB . ASP A ? 314 ? 13.479 -28.963 -4.564 1.0 98.72 314 A 1 +ATOM 2314 C CG . ASP A ? 314 ? 13.970 -29.835 -3.412 1.0 98.29 314 A 1 +ATOM 2315 O OD1 . ASP A ? 314 ? 14.683 -30.826 -3.712 1.0 95.12 314 A 1 +ATOM 2316 O OD2 . ASP A ? 314 ? 13.603 -29.540 -2.254 1.0 95.5 314 A 1 +ATOM 2317 N N . LEU A ? 315 ? 13.240 -26.199 -6.121 1.0 98.9 315 A 1 +ATOM 2318 C CA . LEU A ? 315 ? 12.673 -25.395 -7.205 1.0 98.91 315 A 1 +ATOM 2319 C C . LEU A ? 315 ? 12.699 -23.903 -6.869 1.0 98.94 315 A 1 +ATOM 2320 O O . LEU A ? 315 ? 12.420 -23.485 -5.741 1.0 98.87 315 A 1 +ATOM 2321 C CB . LEU A ? 315 ? 11.230 -25.836 -7.511 1.0 98.78 315 A 1 +ATOM 2322 C CG . LEU A ? 315 ? 11.064 -27.265 -8.065 1.0 97.81 315 A 1 +ATOM 2323 C CD1 . LEU A ? 315 ? 9.581 -27.544 -8.298 1.0 96.49 315 A 1 +ATOM 2324 C CD2 . LEU A ? 315 ? 11.794 -27.474 -9.392 1.0 96.65 315 A 1 +ATOM 2325 N N . TRP A ? 316 ? 12.967 -23.100 -7.887 1.0 98.95 316 A 1 +ATOM 2326 C CA . TRP A ? 316 ? 12.980 -21.644 -7.841 1.0 98.95 316 A 1 +ATOM 2327 C C . TRP A ? 316 ? 11.933 -21.076 -8.795 1.0 98.94 316 A 1 +ATOM 2328 O O . TRP A ? 316 ? 11.880 -21.458 -9.964 1.0 98.84 316 A 1 +ATOM 2329 C CB . TRP A ? 316 ? 14.369 -21.122 -8.217 1.0 98.92 316 A 1 +ATOM 2330 C CG . TRP A ? 316 ? 15.502 -21.629 -7.381 1.0 98.93 316 A 1 +ATOM 2331 C CD1 . TRP A ? 316 ? 16.170 -22.788 -7.586 1.0 98.72 316 A 1 +ATOM 2332 C CD2 . TRP A ? 316 ? 16.094 -21.013 -6.197 1.0 98.91 316 A 1 +ATOM 2333 N NE1 . TRP A ? 316 ? 17.148 -22.933 -6.610 1.0 98.76 316 A 1 +ATOM 2334 C CE2 . TRP A ? 316 ? 17.139 -21.864 -5.738 1.0 98.85 316 A 1 +ATOM 2335 C CE3 . TRP A ? 316 ? 15.851 -19.818 -5.482 1.0 98.83 316 A 1 +ATOM 2336 C CZ2 . TRP A ? 316 ? 17.915 -21.546 -4.602 1.0 98.68 316 A 1 +ATOM 2337 C CZ3 . TRP A ? 316 ? 16.624 -19.500 -4.349 1.0 98.54 316 A 1 +ATOM 2338 C CH2 . TRP A ? 316 ? 17.647 -20.359 -3.914 1.0 98.49 316 A 1 +ATOM 2339 N N . GLU A ? 317 ? 11.166 -20.118 -8.314 1.0 98.97 317 A 1 +ATOM 2340 C CA . GLU A ? 317 ? 10.314 -19.254 -9.121 1.0 98.97 317 A 1 +ATOM 2341 C C . GLU A ? 317 ? 10.832 -17.819 -8.998 1.0 98.97 317 A 1 +ATOM 2342 O O . GLU A ? 317 ? 10.635 -17.153 -7.984 1.0 98.91 317 A 1 +ATOM 2343 C CB . GLU A ? 317 ? 8.855 -19.380 -8.668 1.0 98.91 317 A 1 +ATOM 2344 C CG . GLU A ? 317 ? 8.141 -20.600 -9.275 1.0 97.66 317 A 1 +ATOM 2345 C CD . GLU A ? 317 ? 7.820 -20.434 -10.764 1.0 98.46 317 A 1 +ATOM 2346 O OE1 . GLU A ? 317 ? 7.751 -21.462 -11.471 1.0 96.26 317 A 1 +ATOM 2347 O OE2 . GLU A ? 317 ? 7.613 -19.282 -11.217 1.0 96.71 317 A 1 +ATOM 2348 N N . ILE A ? 318 ? 11.533 -17.350 -10.021 1.0 98.95 318 A 1 +ATOM 2349 C CA . ILE A ? 318 ? 12.038 -15.973 -10.104 1.0 98.95 318 A 1 +ATOM 2350 C C . ILE A ? 318 ? 11.242 -15.270 -11.198 1.0 98.95 318 A 1 +ATOM 2351 O O . ILE A ? 318 ? 11.388 -15.600 -12.374 1.0 98.84 318 A 1 +ATOM 2352 C CB . ILE A ? 318 ? 13.559 -15.936 -10.363 1.0 98.87 318 A 1 +ATOM 2353 C CG1 . ILE A ? 318 ? 14.328 -16.708 -9.260 1.0 98.03 318 A 1 +ATOM 2354 C CG2 . ILE A ? 318 ? 14.036 -14.468 -10.431 1.0 98.57 318 A 1 +ATOM 2355 C CD1 . ILE A ? 318 ? 15.820 -16.882 -9.556 1.0 94.85 318 A 1 +ATOM 2356 N N . ASN A ? 319 ? 10.393 -14.320 -10.830 1.0 98.9 319 A 1 +ATOM 2357 C CA . ASN A ? 319 ? 9.479 -13.713 -11.790 1.0 98.9 319 A 1 +ATOM 2358 C C . ASN A ? 319 ? 10.228 -13.023 -12.939 1.0 98.89 319 A 1 +ATOM 2359 O O . ASN A ? 319 ? 11.014 -12.103 -12.724 1.0 98.81 319 A 1 +ATOM 2360 C CB . ASN A ? 319 ? 8.512 -12.759 -11.084 1.0 98.87 319 A 1 +ATOM 2361 C CG . ASN A ? 319 ? 7.447 -12.260 -12.048 1.0 98.82 319 A 1 +ATOM 2362 O OD1 . ASN A ? 319 ? 6.633 -13.012 -12.553 1.0 92.47 319 A 1 +ATOM 2363 N ND2 . ASN A ? 319 ? 7.435 -10.985 -12.351 1.0 92.49 319 A 1 +ATOM 2364 N N . GLU A ? 320 ? 9.929 -13.433 -14.160 1.0 98.92 320 A 1 +ATOM 2365 C CA . GLU A ? 320 ? 10.580 -12.997 -15.399 1.0 98.9 320 A 1 +ATOM 2366 C C . GLU A ? 320 ? 10.035 -11.645 -15.892 1.0 98.9 320 A 1 +ATOM 2367 O O . GLU A ? 320 ? 9.585 -11.531 -17.034 1.0 98.7 320 A 1 +ATOM 2368 C CB . GLU A ? 320 ? 10.415 -14.087 -16.478 1.0 98.79 320 A 1 +ATOM 2369 C CG . GLU A ? 320 ? 11.004 -15.449 -16.092 1.0 98.72 320 A 1 +ATOM 2370 C CD . GLU A ? 320 ? 10.703 -16.556 -17.117 1.0 98.86 320 A 1 +ATOM 2371 O OE1 . GLU A ? 320 ? 11.267 -17.663 -16.962 1.0 98.14 320 A 1 +ATOM 2372 O OE2 . GLU A ? 320 ? 9.890 -16.349 -18.047 1.0 98.39 320 A 1 +ATOM 2373 N N . ALA A ? 321 ? 10.075 -10.604 -15.057 1.0 98.91 321 A 1 +ATOM 2374 C CA . ALA A ? 321 ? 9.681 -9.257 -15.493 1.0 98.88 321 A 1 +ATOM 2375 C C . ALA A ? 321 ? 10.375 -8.866 -16.812 1.0 98.9 321 A 1 +ATOM 2376 O O . ALA A ? 321 ? 9.759 -8.324 -17.728 1.0 98.69 321 A 1 +ATOM 2377 C CB . ALA A ? 321 ? 10.027 -8.277 -14.369 1.0 98.67 321 A 1 +ATOM 2378 N N . PHE A ? 322 ? 11.642 -9.211 -16.896 1.0 98.94 322 A 1 +ATOM 2379 C CA . PHE A ? 322 ? 12.462 -9.246 -18.106 1.0 98.94 322 A 1 +ATOM 2380 C C . PHE A ? 322 ? 13.414 -10.438 -17.978 1.0 98.94 322 A 1 +ATOM 2381 O O . PHE A ? 322 ? 13.813 -10.764 -16.861 1.0 98.81 322 A 1 +ATOM 2382 C CB . PHE A ? 322 ? 13.247 -7.934 -18.240 1.0 98.88 322 A 1 +ATOM 2383 C CG . PHE A ? 322 ? 12.380 -6.691 -18.234 1.0 98.91 322 A 1 +ATOM 2384 C CD1 . PHE A ? 322 ? 11.790 -6.242 -19.424 1.0 98.58 322 A 1 +ATOM 2385 C CD2 . PHE A ? 322 ? 12.091 -6.021 -17.030 1.0 98.6 322 A 1 +ATOM 2386 C CE1 . PHE A ? 322 ? 10.911 -5.148 -19.417 1.0 98.52 322 A 1 +ATOM 2387 C CE2 . PHE A ? 322 ? 11.207 -4.925 -17.014 1.0 98.44 322 A 1 +ATOM 2388 C CZ . PHE A ? 322 ? 10.613 -4.497 -18.210 1.0 98.68 322 A 1 +ATOM 2389 N N . ALA A ? 323 ? 13.826 -11.066 -19.094 1.0 98.9 323 A 1 +ATOM 2390 C CA . ALA A ? 323 ? 14.757 -12.204 -19.068 1.0 98.9 323 A 1 +ATOM 2391 C C . ALA A ? 323 ? 16.067 -11.892 -18.318 1.0 98.91 323 A 1 +ATOM 2392 O O . ALA A ? 323 ? 16.642 -12.767 -17.669 1.0 98.82 323 A 1 +ATOM 2393 C CB . ALA A ? 323 ? 15.046 -12.628 -20.511 1.0 98.85 323 A 1 +ATOM 2394 N N . VAL A ? 324 ? 16.506 -10.639 -18.328 1.0 98.87 324 A 1 +ATOM 2395 C CA . VAL A ? 324 ? 17.694 -10.178 -17.589 1.0 98.8 324 A 1 +ATOM 2396 C C . VAL A ? 324 ? 17.602 -10.436 -16.079 1.0 98.88 324 A 1 +ATOM 2397 O O . VAL A ? 324 ? 18.622 -10.679 -15.444 1.0 98.66 324 A 1 +ATOM 2398 C CB . VAL A ? 324 ? 17.970 -8.689 -17.901 1.0 97.57 324 A 1 +ATOM 2399 C CG1 . VAL A ? 324 ? 17.012 -7.718 -17.203 1.0 90.42 324 A 1 +ATOM 2400 C CG2 . VAL A ? 324 ? 19.399 -8.288 -17.530 1.0 91.8 324 A 1 +ATOM 2401 N N . VAL A ? 325 ? 16.401 -10.431 -15.495 1.0 98.88 325 A 1 +ATOM 2402 C CA . VAL A ? 325 ? 16.196 -10.564 -14.040 1.0 98.9 325 A 1 +ATOM 2403 C C . VAL A ? 325 ? 16.578 -11.965 -13.535 1.0 98.92 325 A 1 +ATOM 2404 O O . VAL A ? 325 ? 17.460 -12.059 -12.680 1.0 98.86 325 A 1 +ATOM 2405 C CB . VAL A ? 325 ? 14.763 -10.166 -13.626 1.0 98.83 325 A 1 +ATOM 2406 C CG1 . VAL A ? 325 ? 14.547 -10.331 -12.116 1.0 98.47 325 A 1 +ATOM 2407 C CG2 . VAL A ? 325 ? 14.459 -8.706 -13.992 1.0 98.45 325 A 1 +ATOM 2408 N N . PRO A ? 326 ? 15.993 -13.068 -14.040 1.0 98.94 326 A 1 +ATOM 2409 C CA . PRO A ? 326 ? 16.428 -14.409 -13.648 1.0 98.93 326 A 1 +ATOM 2410 C C . PRO A ? 326 ? 17.869 -14.695 -14.084 1.0 98.93 326 A 1 +ATOM 2411 O O . PRO A ? 326 ? 18.610 -15.292 -13.310 1.0 98.86 326 A 1 +ATOM 2412 C CB . PRO A ? 326 ? 15.419 -15.376 -14.271 1.0 98.82 326 A 1 +ATOM 2413 C CG . PRO A ? 326 ? 14.862 -14.593 -15.458 1.0 98.17 326 A 1 +ATOM 2414 C CD . PRO A ? 326 ? 14.858 -13.159 -14.948 1.0 98.81 326 A 1 +ATOM 2415 N N . LEU A ? 327 ? 18.315 -14.210 -15.253 1.0 98.9 327 A 1 +ATOM 2416 C CA . LEU A ? 327 ? 19.699 -14.394 -15.717 1.0 98.88 327 A 1 +ATOM 2417 C C . LEU A ? 327 ? 20.720 -13.783 -14.753 1.0 98.84 327 A 1 +ATOM 2418 O O . LEU A ? 327 ? 21.667 -14.460 -14.352 1.0 98.72 327 A 1 +ATOM 2419 C CB . LEU A ? 327 ? 19.874 -13.780 -17.116 1.0 98.86 327 A 1 +ATOM 2420 C CG . LEU A ? 327 ? 19.248 -14.599 -18.257 1.0 98.61 327 A 1 +ATOM 2421 C CD1 . LEU A ? 327 ? 19.278 -13.770 -19.539 1.0 98.08 327 A 1 +ATOM 2422 C CD2 . LEU A ? 327 ? 20.010 -15.899 -18.509 1.0 98.14 327 A 1 +ATOM 2423 N N . TYR A ? 328 ? 20.522 -12.522 -14.349 1.0 98.89 328 A 1 +ATOM 2424 C CA . TYR A ? 328 ? 21.375 -11.869 -13.353 1.0 98.87 328 A 1 +ATOM 2425 C C . TYR A ? 328 ? 21.364 -12.635 -12.028 1.0 98.87 328 A 1 +ATOM 2426 O O . TYR A ? 328 ? 22.417 -12.893 -11.445 1.0 98.78 328 A 1 +ATOM 2427 C CB . TYR A ? 328 ? 20.915 -10.422 -13.142 1.0 98.84 328 A 1 +ATOM 2428 C CG . TYR A ? 328 ? 21.700 -9.723 -12.048 1.0 98.77 328 A 1 +ATOM 2429 C CD1 . TYR A ? 328 ? 21.253 -9.759 -10.712 1.0 98.41 328 A 1 +ATOM 2430 C CD2 . TYR A ? 328 ? 22.930 -9.103 -12.347 1.0 98.44 328 A 1 +ATOM 2431 C CE1 . TYR A ? 328 ? 22.023 -9.181 -9.685 1.0 98.04 328 A 1 +ATOM 2432 C CE2 . TYR A ? 328 ? 23.706 -8.519 -11.329 1.0 98.03 328 A 1 +ATOM 2433 C CZ . TYR A ? 328 ? 23.249 -8.565 -9.999 1.0 98.15 328 A 1 +ATOM 2434 O OH . TYR A ? 328 ? 24.012 -8.013 -9.002 1.0 97.3 328 A 1 +ATOM 2435 N N . THR A ? 329 ? 20.179 -13.040 -11.575 1.0 98.9 329 A 1 +ATOM 2436 C CA . THR A ? 329 ? 20.006 -13.746 -10.299 1.0 98.88 329 A 1 +ATOM 2437 C C . THR A ? 329 ? 20.719 -15.098 -10.310 1.0 98.87 329 A 1 +ATOM 2438 O O . THR A ? 329 ? 21.477 -15.397 -9.389 1.0 98.78 329 A 1 +ATOM 2439 C CB . THR A ? 329 ? 18.519 -13.927 -9.969 1.0 98.85 329 A 1 +ATOM 2440 O OG1 . THR A ? 329 ? 17.839 -12.695 -10.040 1.0 97.9 329 A 1 +ATOM 2441 C CG2 . THR A ? 329 ? 18.324 -14.451 -8.550 1.0 97.94 329 A 1 +ATOM 2442 N N . MET A ? 330 ? 20.552 -15.891 -11.368 1.0 98.88 330 A 1 +ATOM 2443 C CA . MET A ? 330 ? 21.229 -17.184 -11.535 1.0 98.81 330 A 1 +ATOM 2444 C C . MET A ? 330 ? 22.754 -17.029 -11.576 1.0 98.78 330 A 1 +ATOM 2445 O O . MET A ? 330 ? 23.451 -17.738 -10.851 1.0 98.47 330 A 1 +ATOM 2446 C CB . MET A ? 330 ? 20.749 -17.880 -12.812 1.0 98.61 330 A 1 +ATOM 2447 C CG . MET A ? 330 ? 19.309 -18.393 -12.700 1.0 97.28 330 A 1 +ATOM 2448 S SD . MET A ? 330 ? 18.774 -19.425 -14.098 1.0 97.0 330 A 1 +ATOM 2449 C CE . MET A ? 330 ? 18.843 -18.256 -15.468 1.0 90.3 330 A 1 +ATOM 2450 N N . LYS A ? 331 ? 23.280 -16.084 -12.366 1.0 98.71 331 A 1 +ATOM 2451 C CA . LYS A ? 331 ? 24.727 -15.819 -12.454 1.0 98.46 331 A 1 +ATOM 2452 C C . LYS A ? 331 ? 25.309 -15.369 -11.114 1.0 98.54 331 A 1 +ATOM 2453 O O . LYS A ? 331 ? 26.369 -15.837 -10.719 1.0 98.0 331 A 1 +ATOM 2454 C CB . LYS A ? 331 ? 25.020 -14.754 -13.529 1.0 97.54 331 A 1 +ATOM 2455 C CG . LYS A ? 331 ? 25.016 -15.321 -14.960 1.0 83.42 331 A 1 +ATOM 2456 C CD . LYS A ? 331 ? 25.405 -14.229 -15.974 1.0 81.97 331 A 1 +ATOM 2457 C CE . LYS A ? 331 ? 25.551 -14.821 -17.378 1.0 71.21 331 A 1 +ATOM 2458 N NZ . LYS A ? 331 ? 25.952 -13.807 -18.394 1.0 64.71 331 A 1 +ATOM 2459 N N . THR A ? 332 ? 24.622 -14.473 -10.422 1.0 98.67 332 A 1 +ATOM 2460 C CA . THR A ? 332 ? 25.115 -13.863 -9.177 1.0 98.66 332 A 1 +ATOM 2461 C C . THR A ? 332 ? 25.105 -14.845 -8.010 1.0 98.7 332 A 1 +ATOM 2462 O O . THR A ? 332 ? 26.023 -14.841 -7.193 1.0 98.29 332 A 1 +ATOM 2463 C CB . THR A ? 332 ? 24.281 -12.623 -8.821 1.0 98.38 332 A 1 +ATOM 2464 O OG1 . THR A ? 332 ? 24.338 -11.707 -9.892 1.0 95.54 332 A 1 +ATOM 2465 C CG2 . THR A ? 332 ? 24.807 -11.877 -7.594 1.0 95.21 332 A 1 +ATOM 2466 N N . LEU A ? 333 ? 24.094 -15.702 -7.922 1.0 98.74 333 A 1 +ATOM 2467 C CA . LEU A ? 333 ? 23.927 -16.656 -6.819 1.0 98.76 333 A 1 +ATOM 2468 C C . LEU A ? 333 ? 24.403 -18.078 -7.156 1.0 98.72 333 A 1 +ATOM 2469 O O . LEU A ? 333 ? 24.455 -18.921 -6.261 1.0 98.28 333 A 1 +ATOM 2470 C CB . LEU A ? 333 ? 22.462 -16.646 -6.359 1.0 98.74 333 A 1 +ATOM 2471 C CG . LEU A ? 333 ? 21.933 -15.285 -5.863 1.0 98.42 333 A 1 +ATOM 2472 C CD1 . LEU A ? 333 ? 20.484 -15.453 -5.406 1.0 97.88 333 A 1 +ATOM 2473 C CD2 . LEU A ? 333 ? 22.734 -14.729 -4.681 1.0 97.75 333 A 1 +ATOM 2474 N N . GLY A ? 334 ? 24.747 -18.354 -8.421 1.0 98.54 334 A 1 +ATOM 2475 C CA . GLY A ? 334 ? 25.123 -19.696 -8.876 1.0 98.43 334 A 1 +ATOM 2476 C C . GLY A ? 334 ? 23.951 -20.685 -8.828 1.0 98.55 334 A 1 +ATOM 2477 O O . GLY A ? 334 ? 24.112 -21.804 -8.350 1.0 97.56 334 A 1 +ATOM 2478 N N . LEU A ? 335 ? 22.770 -20.264 -9.279 1.0 98.62 335 A 1 +ATOM 2479 C CA . LEU A ? 335 ? 21.586 -21.129 -9.304 1.0 98.65 335 A 1 +ATOM 2480 C C . LEU A ? 335 ? 21.625 -22.073 -10.508 1.0 98.54 335 A 1 +ATOM 2481 O O . LEU A ? 335 ? 22.029 -21.689 -11.604 1.0 98.02 335 A 1 +ATOM 2482 C CB . LEU A ? 335 ? 20.286 -20.305 -9.293 1.0 98.62 335 A 1 +ATOM 2483 C CG . LEU A ? 335 ? 20.168 -19.262 -8.169 1.0 98.18 335 A 1 +ATOM 2484 C CD1 . LEU A ? 335 ? 18.796 -18.590 -8.239 1.0 97.71 335 A 1 +ATOM 2485 C CD2 . LEU A ? 335 ? 20.333 -19.870 -6.774 1.0 97.69 335 A 1 +ATOM 2486 N N . ASP A ? 336 ? 21.143 -23.293 -10.312 1.0 98.34 336 A 1 +ATOM 2487 C CA . ASP A ? 336 ? 20.979 -24.283 -11.379 1.0 98.31 336 A 1 +ATOM 2488 C C . ASP A ? 336 ? 19.754 -23.937 -12.241 1.0 98.5 336 A 1 +ATOM 2489 O O . ASP A ? 336 ? 18.610 -24.040 -11.787 1.0 98.13 336 A 1 +ATOM 2490 C CB . ASP A ? 336 ? 20.873 -25.674 -10.739 1.0 97.75 336 A 1 +ATOM 2491 C CG . ASP A ? 336 ? 20.655 -26.816 -11.733 1.0 97.18 336 A 1 +ATOM 2492 O OD1 . ASP A ? 336 ? 20.604 -26.573 -12.960 1.0 95.59 336 A 1 +ATOM 2493 O OD2 . ASP A ? 336 ? 20.495 -27.956 -11.250 1.0 94.17 336 A 1 +ATOM 2494 N N . GLU A ? 337 ? 19.987 -23.567 -13.502 1.0 98.32 337 A 1 +ATOM 2495 C CA . GLU A ? 337 ? 18.930 -23.211 -14.458 1.0 98.26 337 A 1 +ATOM 2496 C C . GLU A ? 337 ? 17.883 -24.329 -14.640 1.0 98.51 337 A 1 +ATOM 2497 O O . GLU A ? 337 ? 16.721 -24.052 -14.925 1.0 98.17 337 A 1 +ATOM 2498 C CB . GLU A ? 337 ? 19.575 -22.844 -15.806 1.0 97.18 337 A 1 +ATOM 2499 C CG . GLU A ? 337 ? 18.559 -22.253 -16.802 1.0 90.74 337 A 1 +ATOM 2500 C CD . GLU A ? 337 ? 19.190 -21.862 -18.148 1.0 87.73 337 A 1 +ATOM 2501 O OE1 . GLU A ? 337 ? 18.961 -20.714 -18.596 1.0 80.64 337 A 1 +ATOM 2502 O OE2 . GLU A ? 337 ? 19.871 -22.720 -18.751 1.0 81.61 337 A 1 +ATOM 2503 N N . SER A ? 338 ? 18.263 -25.596 -14.436 1.0 98.56 338 A 1 +ATOM 2504 C CA . SER A ? 338 ? 17.327 -26.725 -14.525 1.0 98.55 338 A 1 +ATOM 2505 C C . SER A ? 338 ? 16.278 -26.747 -13.403 1.0 98.69 338 A 1 +ATOM 2506 O O . SER A ? 338 ? 15.275 -27.445 -13.520 1.0 98.28 338 A 1 +ATOM 2507 C CB . SER A ? 338 ? 18.090 -28.052 -14.570 1.0 98.18 338 A 1 +ATOM 2508 O OG . SER A ? 338 ? 18.567 -28.445 -13.302 1.0 93.79 338 A 1 +ATOM 2509 N N . LYS A ? 339 ? 16.488 -25.963 -12.344 1.0 98.72 339 A 1 +ATOM 2510 C CA . LYS A ? 339 ? 15.578 -25.813 -11.201 1.0 98.81 339 A 1 +ATOM 2511 C C . LYS A ? 339 ? 14.832 -24.479 -11.179 1.0 98.88 339 A 1 +ATOM 2512 O O . LYS A ? 339 ? 13.932 -24.304 -10.359 1.0 98.72 339 A 1 +ATOM 2513 C CB . LYS A ? 339 ? 16.365 -25.986 -9.900 1.0 98.62 339 A 1 +ATOM 2514 C CG . LYS A ? 339 ? 17.016 -27.370 -9.776 1.0 97.72 339 A 1 +ATOM 2515 C CD . LYS A ? 339 ? 17.677 -27.479 -8.406 1.0 95.65 339 A 1 +ATOM 2516 C CE . LYS A ? 339 ? 18.297 -28.861 -8.214 1.0 89.57 339 A 1 +ATOM 2517 N NZ . LYS A ? 339 ? 18.808 -28.991 -6.834 1.0 81.7 339 A 1 +ATOM 2518 N N . VAL A ? 340 ? 15.212 -23.529 -12.030 1.0 98.86 340 A 1 +ATOM 2519 C CA . VAL A ? 340 ? 14.630 -22.180 -12.070 1.0 98.89 340 A 1 +ATOM 2520 C C . VAL A ? 340 ? 13.536 -22.116 -13.128 1.0 98.9 340 A 1 +ATOM 2521 O O . VAL A ? 340 ? 13.795 -22.412 -14.290 1.0 98.77 340 A 1 +ATOM 2522 C CB . VAL A ? 340 ? 15.710 -21.108 -12.323 1.0 98.81 340 A 1 +ATOM 2523 C CG1 . VAL A ? 340 ? 15.105 -19.700 -12.356 1.0 98.36 340 A 1 +ATOM 2524 C CG2 . VAL A ? 340 ? 16.783 -21.127 -11.230 1.0 98.35 340 A 1 +ATOM 2525 N N . ASN A ? 341 ? 12.344 -21.691 -12.734 1.0 98.88 341 A 1 +ATOM 2526 C CA . ASN A ? 341 ? 11.188 -21.479 -13.622 1.0 98.89 341 A 1 +ATOM 2527 C C . ASN A ? 341 ? 10.946 -22.667 -14.572 1.0 98.87 341 A 1 +ATOM 2528 O O . ASN A ? 341 ? 10.826 -22.500 -15.786 1.0 98.57 341 A 1 +ATOM 2529 C CB . ASN A ? 341 ? 11.326 -20.135 -14.366 1.0 98.82 341 A 1 +ATOM 2530 C CG . ASN A ? 341 ? 11.435 -18.921 -13.461 1.0 98.85 341 A 1 +ATOM 2531 O OD1 . ASN A ? 341 ? 11.272 -18.962 -12.256 1.0 95.11 341 A 1 +ATOM 2532 N ND2 . ASN A ? 341 ? 11.730 -17.776 -14.033 1.0 94.17 341 A 1 +ATOM 2533 N N . ILE A ? 342 ? 10.889 -23.882 -14.025 1.0 98.92 342 A 1 +ATOM 2534 C CA . ILE A ? 342 ? 10.847 -25.124 -14.818 1.0 98.88 342 A 1 +ATOM 2535 C C . ILE A ? 342 ? 9.627 -25.242 -15.744 1.0 98.9 342 A 1 +ATOM 2536 O O . ILE A ? 342 ? 9.670 -25.969 -16.731 1.0 98.66 342 A 1 +ATOM 2537 C CB . ILE A ? 342 ? 10.956 -26.366 -13.913 1.0 98.68 342 A 1 +ATOM 2538 C CG1 . ILE A ? 342 ? 9.798 -26.473 -12.898 1.0 97.01 342 A 1 +ATOM 2539 C CG2 . ILE A ? 342 ? 12.333 -26.382 -13.210 1.0 95.53 342 A 1 +ATOM 2540 C CD1 . ILE A ? 342 ? 9.687 -27.865 -12.259 1.0 94.76 342 A 1 +ATOM 2541 N N . HIS A ? 343 ? 8.567 -24.502 -15.449 1.0 98.83 343 A 1 +ATOM 2542 C CA . HIS A ? 343 ? 7.338 -24.447 -16.248 1.0 98.84 343 A 1 +ATOM 2543 C C . HIS A ? 343 ? 7.162 -23.111 -16.992 1.0 98.83 343 A 1 +ATOM 2544 O O . HIS A ? 343 ? 6.047 -22.739 -17.361 1.0 98.47 343 A 1 +ATOM 2545 C CB . HIS A ? 343 ? 6.145 -24.798 -15.352 1.0 98.72 343 A 1 +ATOM 2546 C CG . HIS A ? 343 ? 6.254 -26.141 -14.677 1.0 98.79 343 A 1 +ATOM 2547 N ND1 . HIS A ? 343 ? 5.922 -26.416 -13.371 1.0 91.93 343 A 1 +ATOM 2548 C CD2 . HIS A ? 343 ? 6.695 -27.323 -15.219 1.0 92.82 343 A 1 +ATOM 2549 C CE1 . HIS A ? 343 ? 6.146 -27.715 -13.139 1.0 94.58 343 A 1 +ATOM 2550 N NE2 . HIS A ? 343 ? 6.626 -28.308 -14.241 1.0 95.67 343 A 1 +ATOM 2551 N N . GLY A ? 344 ? 8.271 -22.401 -17.239 1.0 98.77 344 A 1 +ATOM 2552 C CA . GLY A ? 344 ? 8.266 -21.054 -17.806 1.0 98.77 344 A 1 +ATOM 2553 C C . GLY A ? 344 ? 8.001 -19.988 -16.746 1.0 98.84 344 A 1 +ATOM 2554 O O . GLY A ? 344 ? 7.955 -20.259 -15.547 1.0 98.37 344 A 1 +ATOM 2555 N N . GLY A ? 345 ? 7.839 -18.749 -17.200 1.0 98.86 345 A 1 +ATOM 2556 C CA . GLY A ? 345 ? 7.613 -17.611 -16.327 1.0 98.88 345 A 1 +ATOM 2557 C C . GLY A ? 345 ? 6.977 -16.442 -17.071 1.0 98.93 345 A 1 +ATOM 2558 O O . GLY A ? 345 ? 6.430 -16.601 -18.164 1.0 98.78 345 A 1 +ATOM 2559 N N . ALA A ? 346 ? 7.048 -15.252 -16.486 1.0 98.92 346 A 1 +ATOM 2560 C CA . ALA A ? 346 ? 6.312 -14.083 -16.966 1.0 98.93 346 A 1 +ATOM 2561 C C . ALA A ? 346 ? 6.642 -13.657 -18.408 1.0 98.92 346 A 1 +ATOM 2562 O O . ALA A ? 346 ? 5.781 -13.084 -19.065 1.0 98.74 346 A 1 +ATOM 2563 C CB . ALA A ? 346 ? 6.540 -12.933 -15.982 1.0 98.86 346 A 1 +ATOM 2564 N N . VAL A ? 347 ? 7.831 -13.960 -18.932 1.0 98.94 347 A 1 +ATOM 2565 C CA . VAL A ? 347 ? 8.174 -13.696 -20.346 1.0 98.93 347 A 1 +ATOM 2566 C C . VAL A ? 347 ? 7.231 -14.447 -21.294 1.0 98.92 347 A 1 +ATOM 2567 O O . VAL A ? 347 ? 6.796 -13.888 -22.298 1.0 98.75 347 A 1 +ATOM 2568 C CB . VAL A ? 347 ? 9.647 -14.055 -20.634 1.0 98.82 347 A 1 +ATOM 2569 C CG1 . VAL A ? 347 ? 9.982 -14.122 -22.130 1.0 97.64 347 A 1 +ATOM 2570 C CG2 . VAL A ? 347 ? 10.581 -13.002 -20.020 1.0 97.47 347 A 1 +ATOM 2571 N N . SER A ? 348 ? 6.892 -15.694 -20.981 1.0 98.9 348 A 1 +ATOM 2572 C CA . SER A ? 348 ? 6.075 -16.558 -21.844 1.0 98.88 348 A 1 +ATOM 2573 C C . SER A ? 348 ? 4.635 -16.752 -21.365 1.0 98.84 348 A 1 +ATOM 2574 O O . SER A ? 348 ? 3.757 -17.020 -22.179 1.0 98.5 348 A 1 +ATOM 2575 C CB . SER A ? 348 ? 6.758 -17.914 -22.014 1.0 98.77 348 A 1 +ATOM 2576 O OG . SER A ? 348 ? 6.885 -18.594 -20.780 1.0 98.48 348 A 1 +ATOM 2577 N N . LEU A ? 349 ? 4.376 -16.608 -20.070 1.0 98.91 349 A 1 +ATOM 2578 C CA . LEU A ? 349 ? 3.031 -16.713 -19.487 1.0 98.88 349 A 1 +ATOM 2579 C C . LEU A ? 349 ? 2.314 -15.358 -19.412 1.0 98.85 349 A 1 +ATOM 2580 O O . LEU A ? 349 ? 1.087 -15.307 -19.432 1.0 98.52 349 A 1 +ATOM 2581 C CB . LEU A ? 349 ? 3.122 -17.354 -18.093 1.0 98.79 349 A 1 +ATOM 2582 C CG . LEU A ? 349 ? 3.618 -18.811 -18.074 1.0 98.54 349 A 1 +ATOM 2583 C CD1 . LEU A ? 349 ? 3.811 -19.271 -16.631 1.0 97.98 349 A 1 +ATOM 2584 C CD2 . LEU A ? 349 ? 2.622 -19.764 -18.745 1.0 97.81 349 A 1 +ATOM 2585 N N . GLY A ? 350 ? 3.067 -14.262 -19.325 1.0 98.87 350 A 1 +ATOM 2586 C CA . GLY A ? 350 ? 2.560 -12.914 -19.095 1.0 98.89 350 A 1 +ATOM 2587 C C . GLY A ? 350 ? 2.731 -12.443 -17.651 1.0 98.93 350 A 1 +ATOM 2588 O O . GLY A ? 350 ? 3.037 -13.218 -16.739 1.0 98.8 350 A 1 +ATOM 2589 N N . HIS A ? 351 ? 2.530 -11.136 -17.444 1.0 98.88 351 A 1 +ATOM 2590 C CA . HIS A ? 351 ? 2.760 -10.471 -16.165 1.0 98.91 351 A 1 +ATOM 2591 C C . HIS A ? 351 ? 1.674 -9.437 -15.814 1.0 98.93 351 A 1 +ATOM 2592 O O . HIS A ? 351 ? 1.896 -8.231 -15.954 1.0 98.82 351 A 1 +ATOM 2593 C CB . HIS A ? 351 ? 4.181 -9.880 -16.167 1.0 98.79 351 A 1 +ATOM 2594 C CG . HIS A ? 351 ? 4.589 -9.258 -14.855 1.0 98.79 351 A 1 +ATOM 2595 N ND1 . HIS A ? 351 ? 4.093 -9.565 -13.604 1.0 96.42 351 A 1 +ATOM 2596 C CD2 . HIS A ? 351 ? 5.558 -8.303 -14.671 1.0 96.33 351 A 1 +ATOM 2597 C CE1 . HIS A ? 351 ? 4.733 -8.805 -12.701 1.0 97.22 351 A 1 +ATOM 2598 N NE2 . HIS A ? 351 ? 5.635 -8.035 -13.311 1.0 97.41 351 A 1 +ATOM 2599 N N . PRO A ? 352 ? 0.511 -9.861 -15.314 1.0 98.94 352 A 1 +ATOM 2600 C CA . PRO A ? 352 ? -0.400 -8.973 -14.600 1.0 98.94 352 A 1 +ATOM 2601 C C . PRO A ? 352 ? 0.308 -8.555 -13.304 1.0 98.93 352 A 1 +ATOM 2602 O O . PRO A ? 352 ? 0.537 -9.383 -12.421 1.0 98.84 352 A 1 +ATOM 2603 C CB . PRO A ? 352 ? -1.683 -9.771 -14.352 1.0 98.9 352 A 1 +ATOM 2604 C CG . PRO A ? 352 ? -1.520 -11.057 -15.175 1.0 98.58 352 A 1 +ATOM 2605 C CD . PRO A ? 352 ? -0.007 -11.214 -15.308 1.0 98.91 352 A 1 +ATOM 2606 N N . ILE A ? 353 ? 0.738 -7.295 -13.206 1.0 98.94 353 A 1 +ATOM 2607 C CA . ILE A ? 353 ? 1.793 -6.878 -12.269 1.0 98.92 353 A 1 +ATOM 2608 C C . ILE A ? 353 ? 1.455 -7.116 -10.790 1.0 98.93 353 A 1 +ATOM 2609 O O . ILE A ? 353 ? 2.300 -7.594 -10.041 1.0 98.8 353 A 1 +ATOM 2610 C CB . ILE A ? 353 ? 2.268 -5.430 -12.561 1.0 98.79 353 A 1 +ATOM 2611 C CG1 . ILE A ? 353 ? 1.101 -4.417 -12.612 1.0 98.31 353 A 1 +ATOM 2612 C CG2 . ILE A ? 353 ? 3.080 -5.414 -13.876 1.0 98.1 353 A 1 +ATOM 2613 C CD1 . ILE A ? 353 ? 1.531 -2.958 -12.856 1.0 97.74 353 A 1 +ATOM 2614 N N . GLY A ? 354 ? 0.208 -6.877 -10.373 1.0 98.91 354 A 1 +ATOM 2615 C CA . GLY A ? 354 ? -0.248 -7.186 -9.012 1.0 98.92 354 A 1 +ATOM 2616 C C . GLY A ? 354 ? -0.421 -8.685 -8.736 1.0 98.94 354 A 1 +ATOM 2617 O O . GLY A ? 354 ? -0.247 -9.126 -7.599 1.0 98.83 354 A 1 +ATOM 2618 N N . MET A ? 355 ? -0.710 -9.480 -9.764 1.0 98.93 355 A 1 +ATOM 2619 C CA . MET A ? 355 ? -0.960 -10.927 -9.651 1.0 98.94 355 A 1 +ATOM 2620 C C . MET A ? 355 ? 0.316 -11.746 -9.440 1.0 98.95 355 A 1 +ATOM 2621 O O . MET A ? 355 ? 0.331 -12.687 -8.647 1.0 98.85 355 A 1 +ATOM 2622 C CB . MET A ? 355 ? -1.677 -11.408 -10.928 1.0 98.79 355 A 1 +ATOM 2623 C CG . MET A ? 355 ? -1.840 -12.930 -11.048 1.0 98.54 355 A 1 +ATOM 2624 S SD . MET A ? 355 ? -2.428 -13.446 -12.682 1.0 98.25 355 A 1 +ATOM 2625 C CE . MET A ? 355 ? -2.469 -15.239 -12.514 1.0 95.93 355 A 1 +ATOM 2626 N N . SER A ? 356 ? 1.373 -11.437 -10.182 1.0 98.94 356 A 1 +ATOM 2627 C CA . SER A ? 356 ? 2.496 -12.358 -10.404 1.0 98.94 356 A 1 +ATOM 2628 C C . SER A ? 356 ? 3.176 -12.855 -9.126 1.0 98.94 356 A 1 +ATOM 2629 O O . SER A ? 356 ? 3.516 -14.031 -9.040 1.0 98.9 356 A 1 +ATOM 2630 C CB . SER A ? 356 ? 3.527 -11.708 -11.323 1.0 98.89 356 A 1 +ATOM 2631 O OG . SER A ? 356 ? 2.970 -11.569 -12.619 1.0 98.48 356 A 1 +ATOM 2632 N N . GLY A ? 357 ? 3.320 -12.007 -8.111 1.0 98.94 357 A 1 +ATOM 2633 C CA . GLY A ? 357 ? 3.902 -12.398 -6.825 1.0 98.94 357 A 1 +ATOM 2634 C C . GLY A ? 357 ? 3.119 -13.493 -6.092 1.0 98.96 357 A 1 +ATOM 2635 O O . GLY A ? 357 ? 3.719 -14.320 -5.410 1.0 98.88 357 A 1 +ATOM 2636 N N . ALA A ? 358 ? 1.798 -13.540 -6.260 1.0 98.96 358 A 1 +ATOM 2637 C CA . ALA A ? 358 ? 0.972 -14.622 -5.719 1.0 98.97 358 A 1 +ATOM 2638 C C . ALA A ? 358 ? 0.955 -15.851 -6.641 1.0 98.97 358 A 1 +ATOM 2639 O O . ALA A ? 358 ? 0.981 -16.977 -6.150 1.0 98.93 358 A 1 +ATOM 2640 C CB . ALA A ? 358 ? -0.438 -14.089 -5.459 1.0 98.94 358 A 1 +ATOM 2641 N N . ARG A ? 359 ? 0.969 -15.645 -7.972 1.0 98.98 359 A 1 +ATOM 2642 C CA . ARG A ? 359 ? 0.997 -16.730 -8.966 1.0 98.97 359 A 1 +ATOM 2643 C C . ARG A ? 359 ? 2.167 -17.683 -8.740 1.0 98.97 359 A 1 +ATOM 2644 O O . ARG A ? 359 ? 1.963 -18.886 -8.684 1.0 98.93 359 A 1 +ATOM 2645 C CB . ARG A ? 359 ? 1.047 -16.142 -10.388 1.0 98.92 359 A 1 +ATOM 2646 C CG . ARG A ? 359 ? 0.961 -17.247 -11.458 1.0 98.42 359 A 1 +ATOM 2647 C CD . ARG A ? 359 ? 1.216 -16.725 -12.884 1.0 97.43 359 A 1 +ATOM 2648 N NE . ARG A ? 359 ? 2.579 -16.223 -13.100 1.0 95.53 359 A 1 +ATOM 2649 C CZ . ARG A ? 359 ? 3.685 -16.948 -13.254 1.0 96.14 359 A 1 +ATOM 2650 N NH1 . ARG A ? 359 ? 3.685 -18.251 -13.219 1.0 90.26 359 A 1 +ATOM 2651 N NH2 . ARG A ? 359 ? 4.824 -16.357 -13.461 1.0 92.25 359 A 1 +ATOM 2652 N N . ILE A ? 360 ? 3.375 -17.137 -8.584 1.0 98.97 360 A 1 +ATOM 2653 C CA . ILE A ? 360 ? 4.589 -17.959 -8.445 1.0 98.97 360 A 1 +ATOM 2654 C C . ILE A ? 360 ? 4.616 -18.741 -7.123 1.0 98.97 360 A 1 +ATOM 2655 O O . ILE A ? 360 ? 5.068 -19.878 -7.095 1.0 98.92 360 A 1 +ATOM 2656 C CB . ILE A ? 360 ? 5.869 -17.116 -8.652 1.0 98.93 360 A 1 +ATOM 2657 C CG1 . ILE A ? 360 ? 6.048 -16.023 -7.580 1.0 98.63 360 A 1 +ATOM 2658 C CG2 . ILE A ? 360 ? 5.894 -16.527 -10.081 1.0 98.36 360 A 1 +ATOM 2659 C CD1 . ILE A ? 360 ? 7.343 -15.211 -7.711 1.0 98.33 360 A 1 +ATOM 2660 N N . VAL A ? 361 ? 4.069 -18.181 -6.039 1.0 98.97 361 A 1 +ATOM 2661 C CA . VAL A ? 361 ? 3.933 -18.900 -4.760 1.0 98.97 361 A 1 +ATOM 2662 C C . VAL A ? 361 ? 2.895 -20.020 -4.883 1.0 98.96 361 A 1 +ATOM 2663 O O . VAL A ? 361 ? 3.172 -21.153 -4.501 1.0 98.9 361 A 1 +ATOM 2664 C CB . VAL A ? 361 ? 3.583 -17.941 -3.604 1.0 98.93 361 A 1 +ATOM 2665 C CG1 . VAL A ? 361 ? 3.356 -18.686 -2.283 1.0 98.58 361 A 1 +ATOM 2666 C CG2 . VAL A ? 361 ? 4.716 -16.931 -3.369 1.0 98.56 361 A 1 +ATOM 2667 N N . GLY A ? 362 ? 1.734 -19.730 -5.464 1.0 98.95 362 A 1 +ATOM 2668 C CA . GLY A ? 362 ? 0.693 -20.734 -5.708 1.0 98.92 362 A 1 +ATOM 2669 C C . GLY A ? 362 ? 1.173 -21.878 -6.607 1.0 98.91 362 A 1 +ATOM 2670 O O . GLY A ? 362 ? 0.879 -23.042 -6.341 1.0 98.73 362 A 1 +ATOM 2671 N N . HIS A ? 363 ? 1.990 -21.562 -7.612 1.0 98.92 363 A 1 +ATOM 2672 C CA . HIS A ? 363 ? 2.595 -22.563 -8.490 1.0 98.9 363 A 1 +ATOM 2673 C C . HIS A ? 363 ? 3.523 -23.516 -7.725 1.0 98.88 363 A 1 +ATOM 2674 O O . HIS A ? 363 ? 3.404 -24.735 -7.863 1.0 98.71 363 A 1 +ATOM 2675 C CB . HIS A ? 363 ? 3.330 -21.866 -9.637 1.0 98.83 363 A 1 +ATOM 2676 C CG . HIS A ? 363 ? 3.775 -22.853 -10.680 1.0 98.76 363 A 1 +ATOM 2677 N ND1 . HIS A ? 363 ? 2.932 -23.678 -11.399 1.0 96.04 363 A 1 +ATOM 2678 C CD2 . HIS A ? 363 ? 5.061 -23.161 -11.036 1.0 96.66 363 A 1 +ATOM 2679 C CE1 . HIS A ? 363 ? 3.693 -24.457 -12.168 1.0 97.25 363 A 1 +ATOM 2680 N NE2 . HIS A ? 363 ? 4.986 -24.172 -11.984 1.0 97.28 363 A 1 +ATOM 2681 N N . LEU A ? 364 ? 4.388 -22.984 -6.848 1.0 98.92 364 A 1 +ATOM 2682 C CA . LEU A ? 364 ? 5.221 -23.819 -5.972 1.0 98.92 364 A 1 +ATOM 2683 C C . LEU A ? 364 ? 4.378 -24.687 -5.029 1.0 98.9 364 A 1 +ATOM 2684 O O . LEU A ? 364 ? 4.667 -25.872 -4.873 1.0 98.78 364 A 1 +ATOM 2685 C CB . LEU A ? 364 ? 6.191 -22.944 -5.165 1.0 98.88 364 A 1 +ATOM 2686 C CG . LEU A ? 364 ? 7.342 -22.323 -5.977 1.0 98.6 364 A 1 +ATOM 2687 C CD1 . LEU A ? 364 ? 8.138 -21.394 -5.062 1.0 98.36 364 A 1 +ATOM 2688 C CD2 . LEU A ? 364 ? 8.300 -23.377 -6.535 1.0 98.35 364 A 1 +ATOM 2689 N N . VAL A ? 365 ? 3.303 -24.144 -4.441 1.0 98.91 365 A 1 +ATOM 2690 C CA . VAL A ? 365 ? 2.386 -24.897 -3.559 1.0 98.88 365 A 1 +ATOM 2691 C C . VAL A ? 365 ? 1.819 -26.144 -4.252 1.0 98.8 365 A 1 +ATOM 2692 O O . VAL A ? 365 ? 1.642 -27.185 -3.607 1.0 98.43 365 A 1 +ATOM 2693 C CB . VAL A ? 365 ? 1.243 -23.982 -3.055 1.0 98.75 365 A 1 +ATOM 2694 C CG1 . VAL A ? 365 ? 0.094 -24.738 -2.378 1.0 98.02 365 A 1 +ATOM 2695 C CG2 . VAL A ? 365 ? 1.765 -22.970 -2.024 1.0 98.13 365 A 1 +ATOM 2696 N N . HIS A ? 366 ? 1.569 -26.080 -5.564 1.0 98.78 366 A 1 +ATOM 2697 C CA . HIS A ? 366 ? 1.043 -27.209 -6.338 1.0 98.64 366 A 1 +ATOM 2698 C C . HIS A ? 366 ? 2.126 -28.105 -6.951 1.0 98.47 366 A 1 +ATOM 2699 O O . HIS A ? 366 ? 1.912 -29.314 -7.085 1.0 97.68 366 A 1 +ATOM 2700 C CB . HIS A ? 366 ? 0.083 -26.679 -7.406 1.0 98.39 366 A 1 +ATOM 2701 C CG . HIS A ? 366 ? -1.239 -26.259 -6.819 1.0 98.41 366 A 1 +ATOM 2702 N ND1 . HIS A ? 366 ? -2.112 -27.088 -6.126 1.0 93.04 366 A 1 +ATOM 2703 C CD2 . HIS A ? 366 ? -1.794 -25.005 -6.858 1.0 93.13 366 A 1 +ATOM 2704 C CE1 . HIS A ? 366 ? -3.166 -26.347 -5.768 1.0 95.16 366 A 1 +ATOM 2705 N NE2 . HIS A ? 366 ? -3.012 -25.080 -6.188 1.0 95.63 366 A 1 +ATOM 2706 N N . THR A ? 367 ? 3.281 -27.531 -7.298 1.0 98.73 367 A 1 +ATOM 2707 C CA . THR A ? 367 ? 4.321 -28.205 -8.094 1.0 98.61 367 A 1 +ATOM 2708 C C . THR A ? 367 ? 5.327 -28.990 -7.255 1.0 98.66 367 A 1 +ATOM 2709 O O . THR A ? 367 ? 5.755 -30.072 -7.662 1.0 98.04 367 A 1 +ATOM 2710 C CB . THR A ? 367 ? 5.047 -27.176 -8.969 1.0 97.79 367 A 1 +ATOM 2711 O OG1 . THR A ? 367 ? 4.101 -26.585 -9.833 1.0 87.46 367 A 1 +ATOM 2712 C CG2 . THR A ? 367 ? 6.124 -27.802 -9.855 1.0 85.59 367 A 1 +ATOM 2713 N N . LEU A ? 368 ? 5.708 -28.469 -6.085 1.0 98.72 368 A 1 +ATOM 2714 C CA . LEU A ? 368 ? 6.641 -29.155 -5.192 1.0 98.74 368 A 1 +ATOM 2715 C C . LEU A ? 368 ? 6.112 -30.546 -4.809 1.0 98.65 368 A 1 +ATOM 2716 O O . LEU A ? 368 ? 4.909 -30.755 -4.610 1.0 98.36 368 A 1 +ATOM 2717 C CB . LEU A ? 368 ? 6.897 -28.309 -3.935 1.0 98.73 368 A 1 +ATOM 2718 C CG . LEU A ? 368 ? 7.727 -27.033 -4.157 1.0 98.49 368 A 1 +ATOM 2719 C CD1 . LEU A ? 368 ? 7.631 -26.151 -2.910 1.0 98.27 368 A 1 +ATOM 2720 C CD2 . LEU A ? 368 ? 9.200 -27.339 -4.412 1.0 98.26 368 A 1 +ATOM 2721 N N . LYS A ? 369 ? 7.034 -31.502 -4.649 1.0 98.71 369 A 1 +ATOM 2722 C CA . LYS A ? 369 ? 6.746 -32.827 -4.090 1.0 98.66 369 A 1 +ATOM 2723 C C . LYS A ? 369 ? 6.882 -32.788 -2.564 1.0 98.76 369 A 1 +ATOM 2724 O O . LYS A ? 369 ? 7.633 -31.955 -2.053 1.0 98.43 369 A 1 +ATOM 2725 C CB . LYS A ? 369 ? 7.672 -33.874 -4.714 1.0 98.25 369 A 1 +ATOM 2726 C CG . LYS A ? 369 ? 7.443 -34.012 -6.227 1.0 95.95 369 A 1 +ATOM 2727 C CD . LYS A ? 369 ? 8.396 -35.054 -6.817 1.0 89.8 369 A 1 +ATOM 2728 C CE . LYS A ? 369 ? 8.205 -35.113 -8.335 1.0 82.56 369 A 1 +ATOM 2729 N NZ . LYS A ? 369 ? 9.196 -36.015 -8.972 1.0 71.37 369 A 1 +ATOM 2730 N N . PRO A ? 370 ? 6.213 -33.686 -1.820 1.0 98.55 370 A 1 +ATOM 2731 C CA . PRO A ? 370 ? 6.332 -33.749 -0.363 1.0 98.53 370 A 1 +ATOM 2732 C C . PRO A ? 370 ? 7.792 -33.754 0.111 1.0 98.55 370 A 1 +ATOM 2733 O O . PRO A ? 370 ? 8.609 -34.504 -0.417 1.0 97.82 370 A 1 +ATOM 2734 C CB . PRO A ? 370 ? 5.594 -35.024 0.048 1.0 98.17 370 A 1 +ATOM 2735 C CG . PRO A ? 370 ? 4.526 -35.167 -1.037 1.0 97.12 370 A 1 +ATOM 2736 C CD . PRO A ? 370 ? 5.248 -34.680 -2.289 1.0 98.29 370 A 1 +ATOM 2737 N N . GLY A ? 371 ? 8.110 -32.898 1.090 1.0 98.24 371 A 1 +ATOM 2738 C CA . GLY A ? 371 ? 9.455 -32.702 1.638 1.0 98.14 371 A 1 +ATOM 2739 C C . GLY A ? 371 ? 10.357 -31.753 0.838 1.0 98.46 371 A 1 +ATOM 2740 O O . GLY A ? 371 ? 11.382 -31.320 1.365 1.0 97.51 371 A 1 +ATOM 2741 N N . GLN A ? 372 ? 9.999 -31.399 -0.394 1.0 98.7 372 A 1 +ATOM 2742 C CA . GLN A ? 372 ? 10.762 -30.428 -1.181 1.0 98.77 372 A 1 +ATOM 2743 C C . GLN A ? 372 ? 10.542 -28.993 -0.692 1.0 98.84 372 A 1 +ATOM 2744 O O . GLN A ? 372 ? 9.461 -28.630 -0.224 1.0 98.68 372 A 1 +ATOM 2745 C CB . GLN A ? 372 ? 10.426 -30.527 -2.676 1.0 98.61 372 A 1 +ATOM 2746 C CG . GLN A ? 372 ? 10.912 -31.841 -3.303 1.0 98.11 372 A 1 +ATOM 2747 C CD . GLN A ? 372 ? 10.811 -31.811 -4.829 1.0 98.08 372 A 1 +ATOM 2748 O OE1 . GLN A ? 372 ? 9.811 -31.435 -5.423 1.0 94.86 372 A 1 +ATOM 2749 N NE2 . GLN A ? 372 ? 11.851 -32.210 -5.519 1.0 94.5 372 A 1 +ATOM 2750 N N . LYS A ? 373 ? 11.571 -28.152 -0.874 1.0 98.88 373 A 1 +ATOM 2751 C CA . LYS A ? 373 ? 11.536 -26.719 -0.584 1.0 98.92 373 A 1 +ATOM 2752 C C . LYS A ? 373 ? 11.543 -25.907 -1.873 1.0 98.94 373 A 1 +ATOM 2753 O O . LYS A ? 373 ? 12.282 -26.215 -2.807 1.0 98.83 373 A 1 +ATOM 2754 C CB . LYS A ? 373 ? 12.701 -26.335 0.332 1.0 98.79 373 A 1 +ATOM 2755 C CG . LYS A ? 373 ? 12.676 -27.112 1.656 1.0 97.95 373 A 1 +ATOM 2756 C CD . LYS A ? 373 ? 13.853 -26.718 2.543 1.0 96.44 373 A 1 +ATOM 2757 C CE . LYS A ? 373 ? 13.960 -27.639 3.765 1.0 91.93 373 A 1 +ATOM 2758 N NZ . LYS A ? 373 ? 14.508 -28.967 3.401 1.0 86.87 373 A 1 +ATOM 2759 N N . GLY A ? 374 ? 10.746 -24.863 -1.912 1.0 98.94 374 A 1 +ATOM 2760 C CA . GLY A ? 374 ? 10.686 -23.927 -3.027 1.0 98.95 374 A 1 +ATOM 2761 C C . GLY A ? 374 ? 10.962 -22.501 -2.577 1.0 98.96 374 A 1 +ATOM 2762 O O . GLY A ? 374 ? 10.520 -22.091 -1.506 1.0 98.88 374 A 1 +ATOM 2763 N N . CYS A ? 375 ? 11.677 -21.743 -3.392 1.0 98.94 375 A 1 +ATOM 2764 C CA . CYS A ? 375 ? 11.898 -20.315 -3.173 1.0 98.96 375 A 1 +ATOM 2765 C C . CYS A ? 375 ? 11.270 -19.503 -4.309 1.0 98.96 375 A 1 +ATOM 2766 O O . CYS A ? 375 ? 11.582 -19.718 -5.478 1.0 98.92 375 A 1 +ATOM 2767 C CB . CYS A ? 375 ? 13.401 -20.047 -3.021 1.0 98.92 375 A 1 +ATOM 2768 S SG . CYS A ? 375 ? 13.710 -18.284 -2.675 1.0 98.76 375 A 1 +ATOM 2769 N N . ALA A ? 376 ? 10.417 -18.555 -3.961 1.0 98.97 376 A 1 +ATOM 2770 C CA . ALA A ? 376 ? 9.852 -17.585 -4.886 1.0 98.97 376 A 1 +ATOM 2771 C C . ALA A ? 376 ? 10.481 -16.208 -4.652 1.0 98.97 376 A 1 +ATOM 2772 O O . ALA A ? 376 ? 10.602 -15.769 -3.508 1.0 98.91 376 A 1 +ATOM 2773 C CB . ALA A ? 376 ? 8.328 -17.557 -4.726 1.0 98.91 376 A 1 +ATOM 2774 N N . ALA A ? 377 ? 10.860 -15.507 -5.718 1.0 98.96 377 A 1 +ATOM 2775 C CA . ALA A ? 377 ? 11.351 -14.138 -5.654 1.0 98.97 377 A 1 +ATOM 2776 C C . ALA A ? 377 ? 10.793 -13.296 -6.809 1.0 98.97 377 A 1 +ATOM 2777 O O . ALA A ? 377 ? 10.659 -13.762 -7.935 1.0 98.91 377 A 1 +ATOM 2778 C CB . ALA A ? 377 ? 12.887 -14.141 -5.632 1.0 98.92 377 A 1 +ATOM 2779 N N . ILE A ? 378 ? 10.477 -12.035 -6.527 1.0 98.95 378 A 1 +ATOM 2780 C CA . ILE A ? 378 ? 9.903 -11.119 -7.514 1.0 98.96 378 A 1 +ATOM 2781 C C . ILE A ? 378 ? 10.443 -9.705 -7.305 1.0 98.95 378 A 1 +ATOM 2782 O O . ILE A ? 378 ? 10.338 -9.151 -6.216 1.0 98.83 378 A 1 +ATOM 2783 C CB . ILE A ? 378 ? 8.359 -11.205 -7.502 1.0 98.92 378 A 1 +ATOM 2784 C CG1 . ILE A ? 378 ? 7.747 -10.287 -8.582 1.0 98.78 378 A 1 +ATOM 2785 C CG2 . ILE A ? 378 ? 7.745 -10.904 -6.116 1.0 98.74 378 A 1 +ATOM 2786 C CD1 . ILE A ? 378 ? 6.281 -10.598 -8.898 1.0 98.37 378 A 1 +ATOM 2787 N N . CYS A ? 379 ? 11.008 -9.106 -8.359 1.0 98.9 379 A 1 +ATOM 2788 C CA . CYS A ? 379 ? 11.389 -7.698 -8.339 1.0 98.86 379 A 1 +ATOM 2789 C C . CYS A ? 379 ? 10.150 -6.792 -8.404 1.0 98.86 379 A 1 +ATOM 2790 O O . CYS A ? 379 ? 9.090 -7.192 -8.886 1.0 98.69 379 A 1 +ATOM 2791 C CB . CYS A ? 379 ? 12.382 -7.401 -9.474 1.0 98.55 379 A 1 +ATOM 2792 S SG . CYS A ? 379 ? 11.659 -7.741 -11.104 1.0 97.97 379 A 1 +ATOM 2793 N N . ASN A ? 380 ? 10.298 -5.551 -7.951 1.0 98.76 380 A 1 +ATOM 2794 C CA . ASN A ? 380 ? 9.258 -4.538 -8.085 1.0 98.73 380 A 1 +ATOM 2795 C C . ASN A ? 380 ? 9.841 -3.164 -8.413 1.0 98.73 380 A 1 +ATOM 2796 O O . ASN A ? 380 ? 10.951 -2.842 -7.991 1.0 98.23 380 A 1 +ATOM 2797 C CB . ASN A ? 380 ? 8.361 -4.541 -6.835 1.0 98.33 380 A 1 +ATOM 2798 C CG . ASN A ? 380 ? 9.061 -4.170 -5.534 1.0 98.45 380 A 1 +ATOM 2799 O OD1 . ASN A ? 380 ? 9.301 -5.011 -4.680 1.0 93.73 380 A 1 +ATOM 2800 N ND2 . ASN A ? 380 ? 9.321 -2.909 -5.291 1.0 92.71 380 A 1 +ATOM 2801 N N . GLY A ? 381 ? 9.081 -2.336 -9.135 1.0 98.34 381 A 1 +ATOM 2802 C CA . GLY A ? 381 ? 9.455 -0.954 -9.406 1.0 98.11 381 A 1 +ATOM 2803 C C . GLY A ? 381 ? 9.797 -0.187 -8.116 1.0 98.19 381 A 1 +ATOM 2804 O O . GLY A ? 381 ? 9.367 -0.553 -7.022 1.0 97.42 381 A 1 +ATOM 2805 N N . GLY A ? 382 ? 10.614 0.853 -8.231 1.0 97.93 382 A 1 +ATOM 2806 C CA . GLY A ? 382 ? 11.176 1.534 -7.062 1.0 98.04 382 A 1 +ATOM 2807 C C . GLY A ? 382 ? 12.357 0.791 -6.414 1.0 98.38 382 A 1 +ATOM 2808 O O . GLY A ? 382 ? 12.767 1.151 -5.315 1.0 97.34 382 A 1 +ATOM 2809 N N . GLY A ? 383 ? 12.906 -0.229 -7.079 1.0 98.43 383 A 1 +ATOM 2810 C CA . GLY A ? 383 ? 14.155 -0.890 -6.676 1.0 98.52 383 A 1 +ATOM 2811 C C . GLY A ? 383 ? 14.004 -2.016 -5.653 1.0 98.64 383 A 1 +ATOM 2812 O O . GLY A ? 383 ? 14.990 -2.407 -5.032 1.0 97.91 383 A 1 +ATOM 2813 N N . GLY A ? 384 ? 12.798 -2.552 -5.454 1.0 98.59 384 A 1 +ATOM 2814 C CA . GLY A ? 384 ? 12.539 -3.583 -4.456 1.0 98.65 384 A 1 +ATOM 2815 C C . GLY A ? 384 ? 12.440 -5.010 -5.005 1.0 98.8 384 A 1 +ATOM 2816 O O . GLY A ? 384 ? 12.377 -5.249 -6.210 1.0 98.57 384 A 1 +ATOM 2817 N N . ALA A ? 385 ? 12.375 -5.961 -4.076 1.0 98.84 385 A 1 +ATOM 2818 C CA . ALA A ? 385 ? 11.956 -7.331 -4.332 1.0 98.89 385 A 1 +ATOM 2819 C C . ALA A ? 385 ? 11.265 -7.932 -3.103 1.0 98.89 385 A 1 +ATOM 2820 O O . ALA A ? 385 ? 11.557 -7.562 -1.966 1.0 98.77 385 A 1 +ATOM 2821 C CB . ALA A ? 385 ? 13.159 -8.181 -4.751 1.0 98.78 385 A 1 +ATOM 2822 N N . GLY A ? 386 ? 10.366 -8.888 -3.339 1.0 98.9 386 A 1 +ATOM 2823 C CA . GLY A ? 386 ? 9.843 -9.797 -2.321 1.0 98.92 386 A 1 +ATOM 2824 C C . GLY A ? 386 ? 10.424 -11.198 -2.500 1.0 98.94 386 A 1 +ATOM 2825 O O . GLY A ? 386 ? 10.742 -11.605 -3.622 1.0 98.88 386 A 1 +ATOM 2826 N N . GLY A ? 387 ? 10.539 -11.943 -1.407 1.0 98.93 387 A 1 +ATOM 2827 C CA . GLY A ? 387 ? 10.991 -13.327 -1.408 1.0 98.93 387 A 1 +ATOM 2828 C C . GLY A ? 387 ? 10.241 -14.177 -0.385 1.0 98.93 387 A 1 +ATOM 2829 O O . GLY A ? 387 ? 9.872 -13.704 0.686 1.0 98.76 387 A 1 +ATOM 2830 N N . MET A ? 388 ? 10.023 -15.452 -0.729 1.0 98.9 388 A 1 +ATOM 2831 C CA . MET A ? 388 ? 9.409 -16.445 0.154 1.0 98.88 388 A 1 +ATOM 2832 C C . MET A ? 388 ? 10.070 -17.806 -0.020 1.0 98.94 388 A 1 +ATOM 2833 O O . MET A ? 388 ? 10.454 -18.175 -1.122 1.0 98.82 388 A 1 +ATOM 2834 C CB . MET A ? 388 ? 7.904 -16.576 -0.125 1.0 97.91 388 A 1 +ATOM 2835 C CG . MET A ? 388 ? 7.126 -15.429 0.500 1.0 88.65 388 A 1 +ATOM 2836 S SD . MET A ? 388 ? 5.334 -15.546 0.336 1.0 93.95 388 A 1 +ATOM 2837 C CE . MET A ? 388 ? 4.899 -14.206 1.455 1.0 90.03 388 A 1 +ATOM 2838 N N . ILE A ? 389 ? 10.142 -18.568 1.067 1.0 98.87 389 A 1 +ATOM 2839 C CA . ILE A ? 389 ? 10.517 -19.984 1.038 1.0 98.89 389 A 1 +ATOM 2840 C C . ILE A ? 389 ? 9.389 -20.784 1.678 1.0 98.87 389 A 1 +ATOM 2841 O O . ILE A ? 389 ? 8.922 -20.456 2.766 1.0 98.77 389 A 1 +ATOM 2842 C CB . ILE A ? 389 ? 11.880 -20.250 1.707 1.0 98.87 389 A 1 +ATOM 2843 C CG1 . ILE A ? 389 ? 12.986 -19.398 1.040 1.0 98.49 389 A 1 +ATOM 2844 C CG2 . ILE A ? 389 ? 12.234 -21.749 1.618 1.0 98.65 389 A 1 +ATOM 2845 C CD1 . ILE A ? 389 ? 14.357 -19.518 1.701 1.0 97.91 389 A 1 +ATOM 2846 N N . ILE A ? 390 ? 8.967 -21.839 0.997 1.0 98.9 390 A 1 +ATOM 2847 C CA . ILE A ? 390 ? 7.945 -22.774 1.466 1.0 98.91 390 A 1 +ATOM 2848 C C . ILE A ? 390 ? 8.464 -24.210 1.402 1.0 98.91 390 A 1 +ATOM 2849 O O . ILE A ? 390 ? 9.367 -24.527 0.632 1.0 98.84 390 A 1 +ATOM 2850 C CB . ILE A ? 390 ? 6.613 -22.602 0.696 1.0 98.83 390 A 1 +ATOM 2851 C CG1 . ILE A ? 390 ? 6.727 -23.025 -0.783 1.0 98.16 390 A 1 +ATOM 2852 C CG2 . ILE A ? 390 ? 6.104 -21.154 0.824 1.0 97.92 390 A 1 +ATOM 2853 C CD1 . ILE A ? 390 ? 5.380 -23.056 -1.516 1.0 97.59 390 A 1 +ATOM 2854 N N . GLU A ? 391 ? 7.867 -25.093 2.200 1.0 98.87 391 A 1 +ATOM 2855 C CA . GLU A ? 391 ? 8.118 -26.537 2.173 1.0 98.85 391 A 1 +ATOM 2856 C C . GLU A ? 391 ? 6.814 -27.279 1.889 1.0 98.86 391 A 1 +ATOM 2857 O O . GLU A ? 391 ? 5.801 -27.041 2.549 1.0 98.7 391 A 1 +ATOM 2858 C CB . GLU A ? 391 ? 8.741 -26.964 3.507 1.0 98.67 391 A 1 +ATOM 2859 C CG . GLU A ? 391 ? 9.009 -28.469 3.614 1.0 97.96 391 A 1 +ATOM 2860 C CD . GLU A ? 391 ? 9.665 -28.851 4.949 1.0 97.54 391 A 1 +ATOM 2861 O OE1 . GLU A ? 391 ? 10.484 -29.794 4.953 1.0 93.87 391 A 1 +ATOM 2862 O OE2 . GLU A ? 391 ? 9.354 -28.206 5.978 1.0 93.98 391 A 1 +ATOM 2863 N N . LYS A ? 392 ? 6.843 -28.187 0.915 1.0 98.83 392 A 1 +ATOM 2864 C CA . LYS A ? 392 ? 5.693 -29.027 0.566 1.0 98.79 392 A 1 +ATOM 2865 C C . LYS A ? 392 ? 5.439 -30.056 1.664 1.0 98.76 392 A 1 +ATOM 2866 O O . LYS A ? 392 ? 6.368 -30.710 2.131 1.0 98.17 392 A 1 +ATOM 2867 C CB . LYS A ? 392 ? 5.931 -29.696 -0.788 1.0 98.44 392 A 1 +ATOM 2868 C CG . LYS A ? 392 ? 4.711 -30.456 -1.331 1.0 96.47 392 A 1 +ATOM 2869 C CD . LYS A ? 392 ? 3.609 -29.509 -1.796 1.0 94.43 392 A 1 +ATOM 2870 C CE . LYS A ? 392 ? 2.481 -30.285 -2.475 1.0 92.4 392 A 1 +ATOM 2871 N NZ . LYS A ? 392 ? 1.620 -29.384 -3.277 1.0 90.18 392 A 1 +ATOM 2872 N N . LEU A ? 393 ? 4.179 -30.214 2.036 1.0 97.88 393 A 1 +ATOM 2873 C CA . LEU A ? 393 ? 3.718 -31.184 3.018 1.0 97.54 393 A 1 +ATOM 2874 C C . LEU A ? 393 ? 3.135 -32.445 2.365 1.0 95.84 393 A 1 +ATOM 2875 O O . LEU A ? 393 ? 2.644 -32.382 1.226 1.0 90.07 393 A 1 +ATOM 2876 C CB . LEU A ? 393 ? 2.735 -30.504 3.984 1.0 96.55 393 A 1 +ATOM 2877 C CG . LEU A ? 393 ? 3.346 -29.357 4.818 1.0 96.7 393 A 1 +ATOM 2878 C CD1 . LEU A ? 393 ? 2.265 -28.691 5.661 1.0 94.56 393 A 1 +ATOM 2879 C CD2 . LEU A ? 393 ? 4.446 -29.854 5.759 1.0 94.26 393 A 1 +ATOM 2880 O OXT . LEU A ? 393 ? 3.175 -33.514 3.047 1.0 91.88 393 A 1 +ATOM 2881 N N . GLY B ? 1 ? 14.919 -12.086 19.001 1.0 34.02 1 B 1 +ATOM 2882 C CA . GLY B ? 1 ? 14.481 -13.169 19.914 1.0 34.32 1 B 1 +ATOM 2883 C C . GLY B ? 1 ? 13.514 -14.081 19.196 1.0 36.5 1 B 1 +ATOM 2884 O O . GLY B ? 1 ? 12.933 -13.670 18.203 1.0 34.3 1 B 1 +ATOM 2885 N N . THR B ? 2 ? 13.353 -15.317 19.684 1.0 41.5 2 B 1 +ATOM 2886 C CA . THR B ? 2 ? 12.496 -16.327 19.030 1.0 41.3 2 B 1 +ATOM 2887 C C . THR B ? 2 ? 10.995 -16.153 19.288 1.0 43.27 2 B 1 +ATOM 2888 O O . THR B ? 2 ? 10.188 -16.829 18.658 1.0 40.29 2 B 1 +ATOM 2889 C CB . THR B ? 2 ? 12.911 -17.738 19.488 1.0 37.13 2 B 1 +ATOM 2890 O OG1 . THR B ? 2 ? 13.072 -17.748 20.898 1.0 34.67 2 B 1 +ATOM 2891 C CG2 . THR B ? 2 ? 14.251 -18.171 18.890 1.0 33.69 2 B 1 +ATOM 2892 N N . GLY B ? 3 ? 10.610 -15.294 20.225 1.0 55.52 3 B 1 +ATOM 2893 C CA . GLY B ? 3 ? 9.215 -14.994 20.553 1.0 57.4 3 B 1 +ATOM 2894 C C . GLY B ? 3 ? 8.780 -13.638 20.008 1.0 62.58 3 B 1 +ATOM 2895 O O . GLY B ? 3 ? 9.611 -12.752 19.799 1.0 58.39 3 B 1 +ATOM 2896 N N . SER B ? 4 ? 7.474 -13.460 19.840 1.0 75.71 4 B 1 +ATOM 2897 C CA . SER B ? 4 ? 6.919 -12.135 19.560 1.0 81.58 4 B 1 +ATOM 2898 C C . SER B ? 4 ? 7.028 -11.241 20.777 1.0 87.01 4 B 1 +ATOM 2899 O O . SER B ? 4 ? 6.842 -11.679 21.915 1.0 82.92 4 B 1 +ATOM 2900 C CB . SER B ? 4 ? 5.447 -12.176 19.159 1.0 71.8 4 B 1 +ATOM 2901 O OG . SER B ? 4 ? 4.689 -12.889 20.122 1.0 63.39 4 B 1 +ATOM 2902 N N . ARG B ? 5 ? 7.214 -9.966 20.520 1.0 89.37 5 B 1 +ATOM 2903 C CA . ARG B ? 5 ? 7.079 -8.938 21.549 1.0 92.12 5 B 1 +ATOM 2904 C C . ARG B ? 5 ? 5.608 -8.762 21.929 1.0 94.17 5 B 1 +ATOM 2905 O O . ARG B ? 5 ? 4.729 -8.861 21.064 1.0 92.87 5 B 1 +ATOM 2906 C CB . ARG B ? 5 ? 7.685 -7.633 21.038 1.0 90.43 5 B 1 +ATOM 2907 C CG . ARG B ? 5 ? 9.199 -7.770 20.844 1.0 87.84 5 B 1 +ATOM 2908 C CD . ARG B ? 5 ? 9.771 -6.489 20.262 1.0 84.71 5 B 1 +ATOM 2909 N NE . ARG B ? 5 ? 11.219 -6.614 20.076 1.0 85.37 5 B 1 +ATOM 2910 C CZ . ARG B ? 5 ? 12.165 -6.258 20.926 1.0 86.52 5 B 1 +ATOM 2911 N NH1 . ARG B ? 5 ? 11.909 -5.649 22.046 1.0 78.94 5 B 1 +ATOM 2912 N NH2 . ARG B ? 5 ? 13.399 -6.519 20.640 1.0 81.92 5 B 1 +ATOM 2913 N N . PRO B ? 6 ? 5.316 -8.471 23.213 1.0 93.6 6 B 1 +ATOM 2914 C CA . PRO B ? 6 ? 3.979 -8.028 23.579 1.0 94.71 6 B 1 +ATOM 2915 C C . PRO B ? 6 ? 3.650 -6.723 22.843 1.0 96.13 6 B 1 +ATOM 2916 O O . PRO B ? 6 ? 4.535 -5.919 22.543 1.0 95.47 6 B 1 +ATOM 2917 C CB . PRO B ? 6 ? 4.010 -7.855 25.099 1.0 92.83 6 B 1 +ATOM 2918 C CG . PRO B ? 6 ? 5.478 -7.528 25.390 1.0 91.39 6 B 1 +ATOM 2919 C CD . PRO B ? 6 ? 6.232 -8.341 24.338 1.0 93.58 6 B 1 +ATOM 2920 N N . ILE B ? 7 ? 2.371 -6.471 22.600 1.0 95.83 7 B 1 +ATOM 2921 C CA . ILE B ? 7 ? 1.912 -5.246 21.921 1.0 96.93 7 B 1 +ATOM 2922 C C . ILE B ? 7 ? 2.434 -3.966 22.598 1.0 97.61 7 B 1 +ATOM 2923 O O . ILE B ? 7 ? 2.727 -2.980 21.929 1.0 96.96 7 B 1 +ATOM 2924 C CB . ILE B ? 7 ? 0.373 -5.268 21.825 1.0 96.08 7 B 1 +ATOM 2925 C CG1 . ILE B ? 7 ? -0.206 -4.121 20.966 1.0 90.71 7 B 1 +ATOM 2926 C CG2 . ILE B ? 7 ? -0.315 -5.224 23.210 1.0 90.06 7 B 1 +ATOM 2927 C CD1 . ILE B ? 7 ? 0.219 -4.156 19.515 1.0 84.25 7 B 1 +ATOM 2928 N N . THR B ? 8 ? 2.628 -4.010 23.923 1.0 95.31 8 B 1 +ATOM 2929 C CA . THR B ? 8 ? 3.122 -2.889 24.739 1.0 95.83 8 B 1 +ATOM 2930 C C . THR B ? 8 ? 4.595 -2.540 24.504 1.0 97.06 8 B 1 +ATOM 2931 O O . THR B ? 8 ? 5.037 -1.483 24.953 1.0 96.22 8 B 1 +ATOM 2932 C CB . THR B ? 8 ? 2.911 -3.183 26.228 1.0 94.37 8 B 1 +ATOM 2933 O OG1 . THR B ? 8 ? 3.440 -4.450 26.563 1.0 91.4 8 B 1 +ATOM 2934 C CG2 . THR B ? 8 ? 1.424 -3.203 26.588 1.0 90.31 8 B 1 +ATOM 2935 N N . ASP B ? 9 ? 5.354 -3.378 23.795 1.0 96.68 9 B 1 +ATOM 2936 C CA . ASP B ? 9 ? 6.716 -3.057 23.353 1.0 97.4 9 B 1 +ATOM 2937 C C . ASP B ? 9 ? 6.736 -2.148 22.116 1.0 98.13 9 B 1 +ATOM 2938 O O . ASP B ? 9 ? 7.767 -1.549 21.812 1.0 97.68 9 B 1 +ATOM 2939 C CB . ASP B ? 9 ? 7.506 -4.339 23.061 1.0 96.21 9 B 1 +ATOM 2940 C CG . ASP B ? 9 ? 8.168 -4.975 24.282 1.0 91.64 9 B 1 +ATOM 2941 O OD1 . ASP B ? 9 ? 7.871 -4.568 25.427 1.0 87.59 9 B 1 +ATOM 2942 O OD2 . ASP B ? 9 ? 9.013 -5.873 24.045 1.0 87.27 9 B 1 +ATOM 2943 N N . VAL B ? 10 ? 5.610 -2.022 21.413 1.0 98.33 10 B 1 +ATOM 2944 C CA . VAL B ? 10 ? 5.464 -1.102 20.281 1.0 98.6 10 B 1 +ATOM 2945 C C . VAL B ? 10 ? 5.210 0.308 20.808 1.0 98.74 10 B 1 +ATOM 2946 O O . VAL B ? 10 ? 4.217 0.563 21.490 1.0 98.66 10 B 1 +ATOM 2947 C CB . VAL B ? 10 ? 4.342 -1.543 19.325 1.0 98.45 10 B 1 +ATOM 2948 C CG1 . VAL B ? 10 ? 4.190 -0.565 18.154 1.0 97.87 10 B 1 +ATOM 2949 C CG2 . VAL B ? 10 ? 4.622 -2.935 18.742 1.0 97.89 10 B 1 +ATOM 2950 N N . VAL B ? 11 ? 6.090 1.236 20.457 1.0 98.77 11 B 1 +ATOM 2951 C CA . VAL B ? 11 ? 6.019 2.633 20.897 1.0 98.84 11 B 1 +ATOM 2952 C C . VAL B ? 11 ? 6.024 3.609 19.722 1.0 98.9 11 B 1 +ATOM 2953 O O . VAL B ? 11 ? 6.695 3.401 18.712 1.0 98.86 11 B 1 +ATOM 2954 C CB . VAL B ? 11 ? 7.125 2.981 21.915 1.0 98.67 11 B 1 +ATOM 2955 C CG1 . VAL B ? 11 ? 6.955 2.184 23.212 1.0 97.89 11 B 1 +ATOM 2956 C CG2 . VAL B ? 11 ? 8.550 2.754 21.390 1.0 97.44 11 B 1 +ATOM 2957 N N . PHE B ? 12 ? 5.298 4.707 19.886 1.0 98.91 12 B 1 +ATOM 2958 C CA . PHE B ? 12 ? 5.383 5.886 19.034 1.0 98.93 12 B 1 +ATOM 2959 C C . PHE B ? 12 ? 6.471 6.808 19.580 1.0 98.91 12 B 1 +ATOM 2960 O O . PHE B ? 12 ? 6.466 7.140 20.765 1.0 98.75 12 B 1 +ATOM 2961 C CB . PHE B ? 12 ? 4.032 6.603 18.990 1.0 98.91 12 B 1 +ATOM 2962 C CG . PHE B ? 12 ? 2.900 5.753 18.453 1.0 98.91 12 B 1 +ATOM 2963 C CD1 . PHE B ? 12 ? 2.626 5.736 17.077 1.0 98.7 12 B 1 +ATOM 2964 C CD2 . PHE B ? 12 ? 2.125 4.961 19.324 1.0 98.67 12 B 1 +ATOM 2965 C CE1 . PHE B ? 12 ? 1.582 4.945 16.571 1.0 98.56 12 B 1 +ATOM 2966 C CE2 . PHE B ? 12 ? 1.083 4.162 18.821 1.0 98.53 12 B 1 +ATOM 2967 C CZ . PHE B ? 12 ? 0.813 4.157 17.444 1.0 98.73 12 B 1 +ATOM 2968 N N . VAL B ? 13 ? 7.386 7.232 18.722 1.0 98.91 13 B 1 +ATOM 2969 C CA . VAL B ? 13 ? 8.470 8.166 19.071 1.0 98.88 13 B 1 +ATOM 2970 C C . VAL B ? 13 ? 8.336 9.520 18.374 1.0 98.84 13 B 1 +ATOM 2971 O O . VAL B ? 13 ? 8.986 10.481 18.768 1.0 98.46 13 B 1 +ATOM 2972 C CB . VAL B ? 13 ? 9.859 7.548 18.829 1.0 98.74 13 B 1 +ATOM 2973 C CG1 . VAL B ? 13 ? 10.112 6.376 19.780 1.0 98.01 13 B 1 +ATOM 2974 C CG2 . VAL B ? 13 ? 10.056 7.058 17.384 1.0 97.7 13 B 1 +ATOM 2975 N N . GLY B ? 14 ? 7.466 9.618 17.372 1.0 98.81 14 B 1 +ATOM 2976 C CA . GLY B ? 14 ? 7.154 10.868 16.685 1.0 98.83 14 B 1 +ATOM 2977 C C . GLY B ? 14 ? 5.850 10.787 15.906 1.0 98.91 14 B 1 +ATOM 2978 O O . GLY B ? 14 ? 5.439 9.716 15.464 1.0 98.82 14 B 1 +ATOM 2979 N N . ALA B ? 15 ? 5.209 11.938 15.733 1.0 98.87 15 B 1 +ATOM 2980 C CA . ALA B ? 15 ? 4.035 12.094 14.889 1.0 98.89 15 B 1 +ATOM 2981 C C . ALA B ? 15 ? 3.979 13.525 14.344 1.0 98.88 15 B 1 +ATOM 2982 O O . ALA B ? 15 ? 4.271 14.478 15.067 1.0 98.66 15 B 1 +ATOM 2983 C CB . ALA B ? 15 ? 2.773 11.751 15.693 1.0 98.76 15 B 1 +ATOM 2984 N N . ALA B ? 16 ? 3.597 13.674 13.082 1.0 98.9 16 B 1 +ATOM 2985 C CA . ALA B ? 16 ? 3.365 14.974 12.464 1.0 98.93 16 B 1 +ATOM 2986 C C . ALA B ? 16 ? 2.369 14.855 11.308 1.0 98.95 16 B 1 +ATOM 2987 O O . ALA B ? 16 ? 2.187 13.782 10.728 1.0 98.88 16 B 1 +ATOM 2988 C CB . ALA B ? 16 ? 4.698 15.568 11.987 1.0 98.79 16 B 1 +ATOM 2989 N N . ARG B ? 17 ? 1.767 15.970 10.933 1.0 98.93 17 B 1 +ATOM 2990 C CA . ARG B ? 17 ? 0.875 16.077 9.780 1.0 98.92 17 B 1 +ATOM 2991 C C . ARG B ? 17 ? 1.060 17.397 9.042 1.0 98.91 17 B 1 +ATOM 2992 O O . ARG B ? 17 ? 1.514 18.382 9.621 1.0 98.74 17 B 1 +ATOM 2993 C CB . ARG B ? 17 ? -0.578 15.860 10.215 1.0 98.72 17 B 1 +ATOM 2994 C CG . ARG B ? 17 ? -1.148 16.995 11.088 1.0 98.37 17 B 1 +ATOM 2995 C CD . ARG B ? 17 ? -2.617 16.707 11.385 1.0 98.27 17 B 1 +ATOM 2996 N NE . ARG B ? 17 ? -3.279 17.761 12.154 1.0 98.06 17 B 1 +ATOM 2997 C CZ . ARG B ? 17 ? -3.906 18.829 11.677 1.0 98.45 17 B 1 +ATOM 2998 N NH1 . ARG B ? 17 ? -3.856 19.170 10.429 1.0 96.06 17 B 1 +ATOM 2999 N NH2 . ARG B ? 17 ? -4.619 19.571 12.464 1.0 96.46 17 B 1 +ATOM 3000 N N . THR B ? 18 ? 0.644 17.429 7.797 1.0 98.92 18 B 1 +ATOM 3001 C CA . THR B ? 18 ? 0.427 18.698 7.093 1.0 98.91 18 B 1 +ATOM 3002 C C . THR B ? 18 ? -0.822 19.395 7.652 1.0 98.91 18 B 1 +ATOM 3003 O O . THR B ? 18 ? -1.658 18.736 8.287 1.0 98.82 18 B 1 +ATOM 3004 C CB . THR B ? 18 ? 0.258 18.482 5.584 1.0 98.84 18 B 1 +ATOM 3005 O OG1 . THR B ? 18 ? -0.940 17.805 5.289 1.0 98.39 18 B 1 +ATOM 3006 C CG2 . THR B ? 18 ? 1.408 17.676 4.981 1.0 98.03 18 B 1 +ATOM 3007 N N . PRO B ? 19 ? -1.018 20.693 7.389 1.0 98.89 19 B 1 +ATOM 3008 C CA . PRO B ? 19 ? -2.356 21.264 7.393 1.0 98.86 19 B 1 +ATOM 3009 C C . PRO B ? 19 ? -3.282 20.466 6.465 1.0 98.89 19 B 1 +ATOM 3010 O O . PRO B ? 19 ? -2.821 19.784 5.539 1.0 98.79 19 B 1 +ATOM 3011 C CB . PRO B ? 19 ? -2.199 22.714 6.930 1.0 98.64 19 B 1 +ATOM 3012 C CG . PRO B ? 19 ? -0.724 23.019 7.196 1.0 97.42 19 B 1 +ATOM 3013 C CD . PRO B ? 19 ? -0.047 21.676 6.966 1.0 98.58 19 B 1 +ATOM 3014 N N . ILE B ? 20 ? -4.580 20.554 6.711 1.0 98.91 20 B 1 +ATOM 3015 C CA . ILE B ? 20 ? -5.602 20.000 5.824 1.0 98.92 20 B 1 +ATOM 3016 C C . ILE B ? 20 ? -6.082 21.120 4.902 1.0 98.88 20 B 1 +ATOM 3017 O O . ILE B ? 20 ? -6.692 22.094 5.349 1.0 98.72 20 B 1 +ATOM 3018 C CB . ILE B ? 20 ? -6.743 19.337 6.624 1.0 98.91 20 B 1 +ATOM 3019 C CG1 . ILE B ? 20 ? -6.201 18.148 7.459 1.0 98.71 20 B 1 +ATOM 3020 C CG2 . ILE B ? 20 ? -7.846 18.857 5.662 1.0 98.74 20 B 1 +ATOM 3021 C CD1 . ILE B ? 20 ? -7.220 17.554 8.439 1.0 97.88 20 B 1 +ATOM 3022 N N . GLY B ? 21 ? -5.804 20.982 3.613 1.0 98.75 21 B 1 +ATOM 3023 C CA . GLY B ? 21 ? -6.281 21.896 2.586 1.0 98.72 21 B 1 +ATOM 3024 C C . GLY B ? 21 ? -7.734 21.623 2.214 1.0 98.82 21 B 1 +ATOM 3025 O O . GLY B ? 21 ? -8.168 20.470 2.151 1.0 98.7 21 B 1 +ATOM 3026 N N . SER B ? 22 ? -8.485 22.683 1.923 1.0 98.66 22 B 1 +ATOM 3027 C CA . SER B ? 22 ? -9.796 22.552 1.284 1.0 98.59 22 B 1 +ATOM 3028 C C . SER B ? 22 ? -9.655 22.098 -0.170 1.0 98.49 22 B 1 +ATOM 3029 O O . SER B ? 22 ? -8.636 22.337 -0.816 1.0 98.02 22 B 1 +ATOM 3030 C CB . SER B ? 22 ? -10.558 23.872 1.335 1.0 98.4 22 B 1 +ATOM 3031 O OG . SER B ? 22 ? -10.837 24.247 2.666 1.0 96.69 22 B 1 +ATOM 3032 N N . PHE B ? 23 ? -10.701 21.476 -0.711 1.0 98.37 23 B 1 +ATOM 3033 C CA . PHE B ? 23 ? -10.698 20.970 -2.082 1.0 98.21 23 B 1 +ATOM 3034 C C . PHE B ? 23 ? -10.367 22.070 -3.100 1.0 97.87 23 B 1 +ATOM 3035 O O . PHE B ? 23 ? -11.026 23.108 -3.140 1.0 97.13 23 B 1 +ATOM 3036 C CB . PHE B ? 23 ? -12.050 20.328 -2.390 1.0 98.06 23 B 1 +ATOM 3037 C CG . PHE B ? 23 ? -12.122 19.658 -3.751 1.0 98.34 23 B 1 +ATOM 3038 C CD1 . PHE B ? 23 ? -13.091 20.059 -4.692 1.0 97.83 23 B 1 +ATOM 3039 C CD2 . PHE B ? 23 ? -11.232 18.621 -4.075 1.0 97.7 23 B 1 +ATOM 3040 C CE1 . PHE B ? 23 ? -13.180 19.412 -5.939 1.0 97.09 23 B 1 +ATOM 3041 C CE2 . PHE B ? 23 ? -11.314 17.977 -5.326 1.0 97.07 23 B 1 +ATOM 3042 C CZ . PHE B ? 23 ? -12.293 18.371 -6.253 1.0 97.71 23 B 1 +ATOM 3043 N N . ARG B ? 24 ? -9.354 21.817 -3.926 1.0 97.77 24 B 1 +ATOM 3044 C CA . ARG B ? 24 ? -8.855 22.732 -4.967 1.0 97.18 24 B 1 +ATOM 3045 C C . ARG B ? 24 ? -8.487 24.125 -4.433 1.0 96.55 24 B 1 +ATOM 3046 O O . ARG B ? 24 ? -8.689 25.127 -5.113 1.0 94.42 24 B 1 +ATOM 3047 C CB . ARG B ? 24 ? -9.824 22.794 -6.160 1.0 96.57 24 B 1 +ATOM 3048 C CG . ARG B ? 24 ? -10.117 21.410 -6.773 1.0 93.84 24 B 1 +ATOM 3049 C CD . ARG B ? 24 ? -10.974 21.539 -8.032 1.0 88.58 24 B 1 +ATOM 3050 N NE . ARG B ? 24 ? -10.208 22.137 -9.137 1.0 82.76 24 B 1 +ATOM 3051 C CZ . ARG B ? 24 ? -10.691 22.630 -10.273 1.0 76.6 24 B 1 +ATOM 3052 N NH1 . ARG B ? 24 ? -11.967 22.630 -10.536 1.0 71.68 24 B 1 +ATOM 3053 N NH2 . ARG B ? 24 ? -9.878 23.120 -11.167 1.0 71.03 24 B 1 +ATOM 3054 N N . SER B ? 25 ? -7.927 24.187 -3.229 1.0 97.32 25 B 1 +ATOM 3055 C CA . SER B ? 25 ? -7.499 25.415 -2.559 1.0 96.94 25 B 1 +ATOM 3056 C C . SER B ? 25 ? -5.973 25.459 -2.400 1.0 96.65 25 B 1 +ATOM 3057 O O . SER B ? 25 ? -5.260 25.347 -3.405 1.0 95.32 25 B 1 +ATOM 3058 C CB . SER B ? 25 ? -8.280 25.558 -1.251 1.0 96.62 25 B 1 +ATOM 3059 O OG . SER B ? 25 ? -8.051 26.816 -0.672 1.0 93.75 25 B 1 +ATOM 3060 N N . ALA B ? 26 ? -5.458 25.613 -1.195 1.0 96.77 26 B 1 +ATOM 3061 C CA . ALA B ? 26 ? -4.028 25.778 -0.921 1.0 96.59 26 B 1 +ATOM 3062 C C . ALA B ? 26 ? -3.149 24.681 -1.543 1.0 96.99 26 B 1 +ATOM 3063 O O . ALA B ? 26 ? -2.082 24.968 -2.085 1.0 96.13 26 B 1 +ATOM 3064 C CB . ALA B ? 26 ? -3.833 25.824 0.594 1.0 95.62 26 B 1 +ATOM 3065 N N . PHE B ? 27 ? -3.614 23.425 -1.522 1.0 97.72 27 B 1 +ATOM 3066 C CA . PHE B ? 27 ? -2.877 22.271 -2.039 1.0 97.88 27 B 1 +ATOM 3067 C C . PHE B ? 27 ? -3.365 21.776 -3.409 1.0 97.51 27 B 1 +ATOM 3068 O O . PHE B ? 27 ? -3.017 20.674 -3.822 1.0 96.69 27 B 1 +ATOM 3069 C CB . PHE B ? 27 ? -2.844 21.162 -0.979 1.0 98.04 27 B 1 +ATOM 3070 C CG . PHE B ? 27 ? -2.248 21.535 0.370 1.0 98.35 27 B 1 +ATOM 3071 C CD1 . PHE B ? 27 ? -1.217 22.489 0.480 1.0 97.88 27 B 1 +ATOM 3072 C CD2 . PHE B ? 27 ? -2.712 20.894 1.533 1.0 97.85 27 B 1 +ATOM 3073 C CE1 . PHE B ? 27 ? -0.673 22.815 1.735 1.0 97.66 27 B 1 +ATOM 3074 C CE2 . PHE B ? 27 ? -2.168 21.208 2.789 1.0 97.57 27 B 1 +ATOM 3075 C CZ . PHE B ? 27 ? -1.151 22.175 2.891 1.0 98.07 27 B 1 +ATOM 3076 N N . ASN B ? 28 ? -4.117 22.584 -4.151 1.0 97.08 28 B 1 +ATOM 3077 C CA . ASN B ? 28 ? -4.717 22.214 -5.442 1.0 95.8 28 B 1 +ATOM 3078 C C . ASN B ? 28 ? -3.740 21.565 -6.445 1.0 95.04 28 B 1 +ATOM 3079 O O . ASN B ? 28 ? -4.120 20.673 -7.199 1.0 90.87 28 B 1 +ATOM 3080 C CB . ASN B ? 28 ? -5.312 23.489 -6.052 1.0 93.54 28 B 1 +ATOM 3081 C CG . ASN B ? 28 ? -6.030 23.240 -7.366 1.0 89.51 28 B 1 +ATOM 3082 O OD1 . ASN B ? 28 ? -6.785 22.307 -7.533 1.0 81.51 28 B 1 +ATOM 3083 N ND2 . ASN B ? 28 ? -5.839 24.108 -8.334 1.0 79.83 28 B 1 +ATOM 3084 N N . ASN B ? 29 ? -2.487 22.023 -6.453 1.0 95.29 29 B 1 +ATOM 3085 C CA . ASN B ? 29 ? -1.446 21.543 -7.363 1.0 94.27 29 B 1 +ATOM 3086 C C . ASN B ? 29 ? -0.306 20.818 -6.635 1.0 95.52 29 B 1 +ATOM 3087 O O . ASN B ? 29 ? 0.767 20.630 -7.204 1.0 93.57 29 B 1 +ATOM 3088 C CB . ASN B ? 29 ? -0.940 22.729 -8.199 1.0 90.51 29 B 1 +ATOM 3089 C CG . ASN B ? 29 ? -2.009 23.323 -9.101 1.0 80.58 29 B 1 +ATOM 3090 O OD1 . ASN B ? 29 ? -2.871 22.656 -9.635 1.0 68.46 29 B 1 +ATOM 3091 N ND2 . ASN B ? 29 ? -1.967 24.618 -9.314 1.0 70.32 29 B 1 +ATOM 3092 N N . VAL B ? 30 ? -0.507 20.429 -5.381 1.0 96.89 30 B 1 +ATOM 3093 C CA . VAL B ? 30 ? 0.502 19.718 -4.585 1.0 97.77 30 B 1 +ATOM 3094 C C . VAL B ? 30 ? 0.254 18.214 -4.697 1.0 98.2 30 B 1 +ATOM 3095 O O . VAL B ? 30 ? -0.737 17.724 -4.154 1.0 98.17 30 B 1 +ATOM 3096 C CB . VAL B ? 30 ? 0.509 20.180 -3.119 1.0 97.82 30 B 1 +ATOM 3097 C CG1 . VAL B ? 30 ? 1.662 19.517 -2.355 1.0 97.35 30 B 1 +ATOM 3098 C CG2 . VAL B ? 30 ? 0.690 21.699 -3.011 1.0 97.24 30 B 1 +ATOM 3099 N N . PRO B ? 31 ? 1.137 17.448 -5.366 1.0 98.24 31 B 1 +ATOM 3100 C CA . PRO B ? 31 ? 0.980 16.001 -5.464 1.0 98.42 31 B 1 +ATOM 3101 C C . PRO B ? 31 ? 0.896 15.343 -4.084 1.0 98.73 31 B 1 +ATOM 3102 O O . PRO B ? 31 ? 1.609 15.739 -3.155 1.0 98.71 31 B 1 +ATOM 3103 C CB . PRO B ? 31 ? 2.198 15.505 -6.247 1.0 97.81 31 B 1 +ATOM 3104 C CG . PRO B ? 31 ? 2.634 16.730 -7.053 1.0 96.2 31 B 1 +ATOM 3105 C CD . PRO B ? 31 ? 2.300 17.887 -6.117 1.0 97.86 31 B 1 +ATOM 3106 N N . VAL B ? 32 ? 0.102 14.273 -3.964 1.0 98.73 32 B 1 +ATOM 3107 C CA . VAL B ? 32 ? -0.031 13.511 -2.711 1.0 98.87 32 B 1 +ATOM 3108 C C . VAL B ? 32 ? 1.324 13.041 -2.163 1.0 98.91 32 B 1 +ATOM 3109 O O . VAL B ? 32 ? 1.552 13.052 -0.958 1.0 98.87 32 B 1 +ATOM 3110 C CB . VAL B ? 32 ? -0.999 12.329 -2.906 1.0 98.75 32 B 1 +ATOM 3111 C CG1 . VAL B ? 32 ? -0.458 11.225 -3.831 1.0 97.97 32 B 1 +ATOM 3112 C CG2 . VAL B ? 32 ? -1.389 11.709 -1.561 1.0 97.6 32 B 1 +ATOM 3113 N N . THR B ? 33 ? 2.265 12.724 -3.055 1.0 98.81 33 B 1 +ATOM 3114 C CA . THR B ? 33 ? 3.629 12.319 -2.694 1.0 98.83 33 B 1 +ATOM 3115 C C . THR B ? 33 ? 4.437 13.444 -2.046 1.0 98.86 33 B 1 +ATOM 3116 O O . THR B ? 33 ? 5.313 13.169 -1.234 1.0 98.74 33 B 1 +ATOM 3117 C CB . THR B ? 33 ? 4.382 11.815 -3.929 1.0 98.69 33 B 1 +ATOM 3118 O OG1 . THR B ? 33 ? 4.344 12.780 -4.958 1.0 97.26 33 B 1 +ATOM 3119 C CG2 . THR B ? 33 ? 3.759 10.529 -4.479 1.0 96.73 33 B 1 +ATOM 3120 N N . VAL B ? 34 ? 4.147 14.706 -2.351 1.0 98.71 34 B 1 +ATOM 3121 C CA . VAL B ? 34 ? 4.764 15.869 -1.694 1.0 98.61 34 B 1 +ATOM 3122 C C . VAL B ? 34 ? 4.172 16.064 -0.303 1.0 98.74 34 B 1 +ATOM 3123 O O . VAL B ? 34 ? 4.930 16.210 0.650 1.0 98.69 34 B 1 +ATOM 3124 C CB . VAL B ? 34 ? 4.628 17.145 -2.549 1.0 98.24 34 B 1 +ATOM 3125 C CG1 . VAL B ? 34 ? 5.156 18.386 -1.822 1.0 97.33 34 B 1 +ATOM 3126 C CG2 . VAL B ? 34 ? 5.410 17.000 -3.861 1.0 97.47 34 B 1 +ATOM 3127 N N . LEU B ? 35 ? 2.848 15.978 -0.160 1.0 98.74 35 B 1 +ATOM 3128 C CA . LEU B ? 35 ? 2.174 16.033 1.142 1.0 98.85 35 B 1 +ATOM 3129 C C . LEU B ? 35 ? 2.718 14.946 2.086 1.0 98.91 35 B 1 +ATOM 3130 O O . LEU B ? 35 ? 3.163 15.242 3.194 1.0 98.89 35 B 1 +ATOM 3131 C CB . LEU B ? 35 ? 0.650 15.879 0.948 1.0 98.82 35 B 1 +ATOM 3132 C CG . LEU B ? 35 ? -0.031 16.979 0.108 1.0 98.61 35 B 1 +ATOM 3133 C CD1 . LEU B ? 35 ? -1.489 16.605 -0.149 1.0 98.35 35 B 1 +ATOM 3134 C CD2 . LEU B ? 35 ? 0.007 18.334 0.810 1.0 98.17 35 B 1 +ATOM 3135 N N . GLY B ? 36 ? 2.761 13.703 1.608 1.0 98.89 36 B 1 +ATOM 3136 C CA . GLY B ? 36 ? 3.292 12.577 2.376 1.0 98.93 36 B 1 +ATOM 3137 C C . GLY B ? 36 ? 4.771 12.736 2.739 1.0 98.95 36 B 1 +ATOM 3138 O O . GLY B ? 36 ? 5.158 12.486 3.879 1.0 98.93 36 B 1 +ATOM 3139 N N . ARG B ? 37 ? 5.597 13.191 1.798 1.0 98.9 37 B 1 +ATOM 3140 C CA . ARG B ? 37 ? 7.030 13.457 2.010 1.0 98.86 37 B 1 +ATOM 3141 C C . ARG B ? 37 ? 7.266 14.463 3.136 1.0 98.89 37 B 1 +ATOM 3142 O O . ARG B ? 37 ? 8.097 14.220 4.009 1.0 98.78 37 B 1 +ATOM 3143 C CB . ARG B ? 37 ? 7.640 13.961 0.696 1.0 98.47 37 B 1 +ATOM 3144 C CG . ARG B ? 37 ? 9.139 14.282 0.803 1.0 97.18 37 B 1 +ATOM 3145 C CD . ARG B ? 37 ? 9.633 14.977 -0.467 1.0 94.99 37 B 1 +ATOM 3146 N NE . ARG B ? 37 ? 9.206 16.380 -0.505 1.0 91.22 37 B 1 +ATOM 3147 C CZ . ARG B ? 37 ? 9.109 17.172 -1.558 1.0 91.51 37 B 1 +ATOM 3148 N NH1 . ARG B ? 37 ? 9.396 16.763 -2.765 1.0 83.78 37 B 1 +ATOM 3149 N NH2 . ARG B ? 37 ? 8.726 18.396 -1.400 1.0 86.95 37 B 1 +ATOM 3150 N N . GLU B ? 38 ? 6.553 15.583 3.108 1.0 98.81 38 B 1 +ATOM 3151 C CA . GLU B ? 38 ? 6.729 16.632 4.113 1.0 98.76 38 B 1 +ATOM 3152 C C . GLU B ? 38 ? 6.198 16.192 5.487 1.0 98.83 38 B 1 +ATOM 3153 O O . GLU B ? 38 ? 6.890 16.375 6.489 1.0 98.73 38 B 1 +ATOM 3154 C CB . GLU B ? 38 ? 6.100 17.948 3.634 1.0 98.56 38 B 1 +ATOM 3155 C CG . GLU B ? 38 ? 6.784 18.560 2.391 1.0 97.66 38 B 1 +ATOM 3156 C CD . GLU B ? 38 ? 8.319 18.630 2.495 1.0 97.04 38 B 1 +ATOM 3157 O OE1 . GLU B ? 38 ? 9.006 18.199 1.535 1.0 93.85 38 B 1 +ATOM 3158 O OE2 . GLU B ? 38 ? 8.841 19.056 3.543 1.0 94.02 38 B 1 +ATOM 3159 N N . ALA B ? 39 ? 5.050 15.500 5.536 1.0 98.86 39 B 1 +ATOM 3160 C CA . ALA B ? 39 ? 4.553 14.917 6.784 1.0 98.92 39 B 1 +ATOM 3161 C C . ALA B ? 39 ? 5.546 13.907 7.387 1.0 98.94 39 B 1 +ATOM 3162 O O . ALA B ? 39 ? 5.796 13.930 8.592 1.0 98.91 39 B 1 +ATOM 3163 C CB . ALA B ? 39 ? 3.191 14.269 6.525 1.0 98.91 39 B 1 +ATOM 3164 N N . LEU B ? 40 ? 6.173 13.061 6.557 1.0 98.94 40 B 1 +ATOM 3165 C CA . LEU B ? 40 ? 7.174 12.097 7.017 1.0 98.95 40 B 1 +ATOM 3166 C C . LEU B ? 40 ? 8.443 12.789 7.530 1.0 98.94 40 B 1 +ATOM 3167 O O . LEU B ? 40 ? 8.930 12.442 8.605 1.0 98.91 40 B 1 +ATOM 3168 C CB . LEU B ? 40 ? 7.471 11.082 5.899 1.0 98.95 40 B 1 +ATOM 3169 C CG . LEU B ? 40 ? 8.505 10.009 6.302 1.0 98.82 40 B 1 +ATOM 3170 C CD1 . LEU B ? 40 ? 8.120 9.248 7.571 1.0 98.51 40 B 1 +ATOM 3171 C CD2 . LEU B ? 40 ? 8.655 8.987 5.177 1.0 98.52 40 B 1 +ATOM 3172 N N . LYS B ? 41 ? 8.956 13.798 6.826 1.0 98.91 41 B 1 +ATOM 3173 C CA . LYS B ? 41 ? 10.074 14.617 7.323 1.0 98.86 41 B 1 +ATOM 3174 C C . LYS B ? 41 ? 9.740 15.256 8.673 1.0 98.86 41 B 1 +ATOM 3175 O O . LYS B ? 41 ? 10.570 15.237 9.578 1.0 98.72 41 B 1 +ATOM 3176 C CB . LYS B ? 41 ? 10.410 15.724 6.321 1.0 98.73 41 B 1 +ATOM 3177 C CG . LYS B ? 41 ? 11.162 15.232 5.073 1.0 97.57 41 B 1 +ATOM 3178 C CD . LYS B ? 41 ? 11.324 16.443 4.153 1.0 95.83 41 B 1 +ATOM 3179 C CE . LYS B ? 41 ? 12.074 16.124 2.868 1.0 89.81 41 B 1 +ATOM 3180 N NZ . LYS B ? 41 ? 11.993 17.306 1.979 1.0 84.3 41 B 1 +ATOM 3181 N N . GLY B ? 42 ? 8.524 15.778 8.809 1.0 98.83 42 B 1 +ATOM 3182 C CA . GLY B ? 42 ? 8.035 16.357 10.055 1.0 98.81 42 B 1 +ATOM 3183 C C . GLY B ? 42 ? 7.991 15.345 11.200 1.0 98.86 42 B 1 +ATOM 3184 O O . GLY B ? 42 ? 8.507 15.626 12.281 1.0 98.73 42 B 1 +ATOM 3185 N N . ALA B ? 43 ? 7.460 14.145 10.955 1.0 98.85 43 B 1 +ATOM 3186 C CA . ALA B ? 43 ? 7.395 13.081 11.959 1.0 98.89 43 B 1 +ATOM 3187 C C . ALA B ? 43 ? 8.792 12.594 12.386 1.0 98.89 43 B 1 +ATOM 3188 O O . ALA B ? 43 ? 9.053 12.425 13.577 1.0 98.8 43 B 1 +ATOM 3189 C CB . ALA B ? 43 ? 6.537 11.937 11.405 1.0 98.9 43 B 1 +ATOM 3190 N N . LEU B ? 44 ? 9.718 12.430 11.435 1.0 98.9 44 B 1 +ATOM 3191 C CA . LEU B ? 44 ? 11.112 12.062 11.714 1.0 98.87 44 B 1 +ATOM 3192 C C . LEU B ? 44 ? 11.830 13.146 12.530 1.0 98.77 44 B 1 +ATOM 3193 O O . LEU B ? 44 ? 12.534 12.831 13.489 1.0 98.55 44 B 1 +ATOM 3194 C CB . LEU B ? 44 ? 11.845 11.805 10.385 1.0 98.89 44 B 1 +ATOM 3195 C CG . LEU B ? 44 ? 11.422 10.510 9.665 1.0 98.79 44 B 1 +ATOM 3196 C CD1 . LEU B ? 44 ? 12.005 10.491 8.253 1.0 98.59 44 B 1 +ATOM 3197 C CD2 . LEU B ? 44 ? 11.908 9.260 10.398 1.0 98.57 44 B 1 +ATOM 3198 N N . LYS B ? 45 ? 11.604 14.419 12.204 1.0 98.75 45 B 1 +ATOM 3199 C CA . LYS B ? 45 ? 12.144 15.554 12.961 1.0 98.6 45 B 1 +ATOM 3200 C C . LYS B ? 45 ? 11.559 15.621 14.374 1.0 98.57 45 B 1 +ATOM 3201 O O . LYS B ? 45 ? 12.302 15.850 15.324 1.0 98.12 45 B 1 +ATOM 3202 C CB . LYS B ? 45 ? 11.892 16.842 12.160 1.0 98.24 45 B 1 +ATOM 3203 C CG . LYS B ? 45 ? 12.641 18.054 12.742 1.0 89.49 45 B 1 +ATOM 3204 C CD . LYS B ? 45 ? 12.371 19.298 11.885 1.0 84.13 45 B 1 +ATOM 3205 C CE . LYS B ? 45 ? 13.137 20.512 12.427 1.0 71.78 45 B 1 +ATOM 3206 N NZ . LYS B ? 45 ? 12.831 21.741 11.648 1.0 62.79 45 B 1 +ATOM 3207 N N . ASN B ? 46 ? 10.251 15.378 14.519 1.0 98.46 46 B 1 +ATOM 3208 C CA . ASN B ? 46 ? 9.577 15.309 15.823 1.0 98.34 46 B 1 +ATOM 3209 C C . ASN B ? 46 ? 10.126 14.173 16.698 1.0 98.37 46 B 1 +ATOM 3210 O O . ASN B ? 46 ? 10.304 14.354 17.900 1.0 97.97 46 B 1 +ATOM 3211 C CB . ASN B ? 46 ? 8.064 15.151 15.583 1.0 98.06 46 B 1 +ATOM 3212 C CG . ASN B ? 46 ? 7.271 15.114 16.880 1.0 97.37 46 B 1 +ATOM 3213 O OD1 . ASN B ? 46 ? 6.806 14.082 17.335 1.0 90.82 46 B 1 +ATOM 3214 N ND2 . ASN B ? 46 ? 7.102 16.248 17.518 1.0 89.6 46 B 1 +ATOM 3215 N N . ALA B ? 47 ? 10.460 13.037 16.084 1.0 98.56 47 B 1 +ATOM 3216 C CA . ALA B ? 47 ? 11.052 11.885 16.756 1.0 98.57 47 B 1 +ATOM 3217 C C . ALA B ? 47 ? 12.554 12.032 17.060 1.0 98.48 47 B 1 +ATOM 3218 O O . ALA B ? 47 ? 13.100 11.213 17.798 1.0 97.72 47 B 1 +ATOM 3219 C CB . ALA B ? 47 ? 10.808 10.657 15.873 1.0 98.49 47 B 1 +ATOM 3220 N N . ASN B ? 48 ? 13.244 13.024 16.484 1.0 98.33 48 B 1 +ATOM 3221 C CA . ASN B ? 48 ? 14.712 13.081 16.448 1.0 98.11 48 B 1 +ATOM 3222 C C . ASN B ? 48 ? 15.360 11.832 15.813 1.0 98.36 48 B 1 +ATOM 3223 O O . ASN B ? 48 ? 16.462 11.427 16.184 1.0 97.37 48 B 1 +ATOM 3224 C CB . ASN B ? 48 ? 15.265 13.460 17.836 1.0 97.05 48 B 1 +ATOM 3225 C CG . ASN B ? 48 ? 15.742 14.895 17.942 1.0 87.22 48 B 1 +ATOM 3226 O OD1 . ASN B ? 48 ? 16.036 15.580 16.983 1.0 78.73 48 B 1 +ATOM 3227 N ND2 . ASN B ? 48 ? 15.880 15.386 19.156 1.0 74.79 48 B 1 +ATOM 3228 N N . VAL B ? 49 ? 14.686 11.218 14.844 1.0 98.52 49 B 1 +ATOM 3229 C CA . VAL B ? 49 ? 15.163 10.037 14.108 1.0 98.7 49 B 1 +ATOM 3230 C C . VAL B ? 49 ? 15.748 10.464 12.766 1.0 98.76 49 B 1 +ATOM 3231 O O . VAL B ? 49 ? 15.104 11.147 11.972 1.0 98.62 49 B 1 +ATOM 3232 C CB . VAL B ? 49 ? 14.038 8.999 13.949 1.0 98.61 49 B 1 +ATOM 3233 C CG1 . VAL B ? 49 ? 14.411 7.840 13.017 1.0 97.99 49 B 1 +ATOM 3234 C CG2 . VAL B ? 49 ? 13.700 8.381 15.313 1.0 97.82 49 B 1 +ATOM 3235 N N . LYS B ? 50 ? 16.982 10.027 12.482 1.0 98.61 50 B 1 +ATOM 3236 C CA . LYS B ? 50 ? 17.563 10.209 11.147 1.0 98.58 50 B 1 +ATOM 3237 C C . LYS B ? 50 ? 16.797 9.355 10.131 1.0 98.76 50 B 1 +ATOM 3238 O O . LYS B ? 50 ? 16.574 8.175 10.405 1.0 98.59 50 B 1 +ATOM 3239 C CB . LYS B ? 50 ? 19.050 9.841 11.132 1.0 97.93 50 B 1 +ATOM 3240 C CG . LYS B ? 50 ? 19.918 10.903 11.821 1.0 85.28 50 B 1 +ATOM 3241 C CD . LYS B ? 50 ? 21.401 10.545 11.670 1.0 79.07 50 B 1 +ATOM 3242 C CE . LYS B ? 50 ? 22.278 11.624 12.309 1.0 67.98 50 B 1 +ATOM 3243 N NZ . LYS B ? 50 ? 23.723 11.312 12.146 1.0 58.1 50 B 1 +ATOM 3244 N N . PRO B ? 51 ? 16.489 9.886 8.943 1.0 98.72 51 B 1 +ATOM 3245 C CA . PRO B ? 51 ? 15.777 9.126 7.905 1.0 98.74 51 B 1 +ATOM 3246 C C . PRO B ? 51 ? 16.429 7.778 7.553 1.0 98.77 51 B 1 +ATOM 3247 O O . PRO B ? 51 ? 15.737 6.801 7.304 1.0 98.62 51 B 1 +ATOM 3248 C CB . PRO B ? 51 ? 15.735 10.059 6.692 1.0 98.58 51 B 1 +ATOM 3249 C CG . PRO B ? 51 ? 15.771 11.456 7.305 1.0 97.46 51 B 1 +ATOM 3250 C CD . PRO B ? 51 ? 16.671 11.269 8.526 1.0 98.62 51 B 1 +ATOM 3251 N N . SER B ? 52 ? 17.761 7.703 7.620 1.0 98.7 52 B 1 +ATOM 3252 C CA . SER B ? 52 ? 18.529 6.480 7.341 1.0 98.54 52 B 1 +ATOM 3253 C C . SER B ? 52 ? 18.328 5.335 8.348 1.0 98.6 52 B 1 +ATOM 3254 O O . SER B ? 52 ? 18.782 4.227 8.089 1.0 97.96 52 B 1 +ATOM 3255 C CB . SER B ? 52 ? 20.018 6.825 7.273 1.0 97.95 52 B 1 +ATOM 3256 O OG . SER B ? 52 ? 20.458 7.415 8.487 1.0 93.47 52 B 1 +ATOM 3257 N N . LEU B ? 53 ? 17.682 5.575 9.492 1.0 98.71 53 B 1 +ATOM 3258 C CA . LEU B ? 53 ? 17.343 4.523 10.460 1.0 98.66 53 B 1 +ATOM 3259 C C . LEU B ? 53 ? 16.051 3.777 10.103 1.0 98.75 53 B 1 +ATOM 3260 O O . LEU B ? 53 ? 15.811 2.693 10.630 1.0 98.41 53 B 1 +ATOM 3261 C CB . LEU B ? 53 ? 17.230 5.125 11.873 1.0 98.23 53 B 1 +ATOM 3262 C CG . LEU B ? 53 ? 18.550 5.644 12.469 1.0 93.33 53 B 1 +ATOM 3263 C CD1 . LEU B ? 53 ? 18.278 6.263 13.841 1.0 89.04 53 B 1 +ATOM 3264 C CD2 . LEU B ? 53 ? 19.586 4.529 12.650 1.0 89.21 53 B 1 +ATOM 3265 N N . VAL B ? 54 ? 15.226 4.345 9.237 1.0 98.81 54 B 1 +ATOM 3266 C CA . VAL B ? 54 ? 13.962 3.731 8.814 1.0 98.87 54 B 1 +ATOM 3267 C C . VAL B ? 54 ? 14.258 2.491 7.976 1.0 98.86 54 B 1 +ATOM 3268 O O . VAL B ? 54 ? 15.014 2.553 7.009 1.0 98.75 54 B 1 +ATOM 3269 C CB . VAL B ? 54 ? 13.083 4.731 8.042 1.0 98.83 54 B 1 +ATOM 3270 C CG1 . VAL B ? 54 ? 11.751 4.101 7.627 1.0 98.52 54 B 1 +ATOM 3271 C CG2 . VAL B ? 54 ? 12.771 5.969 8.895 1.0 98.45 54 B 1 +ATOM 3272 N N . GLN B ? 55 ? 13.635 1.373 8.330 1.0 98.86 55 B 1 +ATOM 3273 C CA . GLN B ? 55 ? 13.832 0.073 7.674 1.0 98.82 55 B 1 +ATOM 3274 C C . GLN B ? 55 ? 12.636 -0.340 6.809 1.0 98.82 55 B 1 +ATOM 3275 O O . GLN B ? 55 ? 12.810 -0.965 5.764 1.0 98.56 55 B 1 +ATOM 3276 C CB . GLN B ? 55 ? 14.095 -0.978 8.757 1.0 98.64 55 B 1 +ATOM 3277 C CG . GLN B ? 55 ? 15.418 -0.754 9.502 1.0 98.25 55 B 1 +ATOM 3278 C CD . GLN B ? 55 ? 15.536 -1.644 10.738 1.0 97.89 55 B 1 +ATOM 3279 O OE1 . GLN B ? 55 ? 14.579 -1.871 11.462 1.0 93.54 55 B 1 +ATOM 3280 N NE2 . GLN B ? 55 ? 16.701 -2.160 11.035 1.0 92.71 55 B 1 +ATOM 3281 N N . GLU B ? 56 ? 11.425 0.014 7.247 1.0 98.83 56 B 1 +ATOM 3282 C CA . GLU B ? 56 ? 10.185 -0.303 6.530 1.0 98.86 56 B 1 +ATOM 3283 C C . GLU B ? 56 ? 9.142 0.807 6.725 1.0 98.91 56 B 1 +ATOM 3284 O O . GLU B ? 56 ? 9.152 1.533 7.724 1.0 98.87 56 B 1 +ATOM 3285 C CB . GLU B ? 56 ? 9.683 -1.699 6.956 1.0 98.74 56 B 1 +ATOM 3286 C CG . GLU B ? 56 ? 8.534 -2.221 6.085 1.0 98.36 56 B 1 +ATOM 3287 C CD . GLU B ? 56 ? 8.337 -3.748 6.111 1.0 98.56 56 B 1 +ATOM 3288 O OE1 . GLU B ? 56 ? 7.444 -4.226 5.366 1.0 97.21 56 B 1 +ATOM 3289 O OE2 . GLU B ? 56 ? 9.085 -4.464 6.811 1.0 97.46 56 B 1 +ATOM 3290 N N . ALA B ? 57 ? 8.246 0.961 5.755 1.0 98.93 57 B 1 +ATOM 3291 C CA . ALA B ? 57 ? 7.168 1.938 5.776 1.0 98.94 57 B 1 +ATOM 3292 C C . ALA B ? 57 ? 5.852 1.351 5.262 1.0 98.94 57 B 1 +ATOM 3293 O O . ALA B ? 57 ? 5.822 0.659 4.241 1.0 98.86 57 B 1 +ATOM 3294 C CB . ALA B ? 57 ? 7.581 3.158 4.946 1.0 98.89 57 B 1 +ATOM 3295 N N . PHE B ? 58 ? 4.755 1.695 5.925 1.0 98.97 58 B 1 +ATOM 3296 C CA . PHE B ? 58 ? 3.390 1.464 5.454 1.0 98.97 58 B 1 +ATOM 3297 C C . PHE B ? 58 ? 2.658 2.806 5.379 1.0 98.96 58 B 1 +ATOM 3298 O O . PHE B ? 58 ? 2.576 3.523 6.376 1.0 98.89 58 B 1 +ATOM 3299 C CB . PHE B ? 58 ? 2.658 0.493 6.382 1.0 98.93 58 B 1 +ATOM 3300 C CG . PHE B ? 58 ? 3.217 -0.915 6.382 1.0 98.9 58 B 1 +ATOM 3301 C CD1 . PHE B ? 58 ? 2.743 -1.863 5.457 1.0 98.48 58 B 1 +ATOM 3302 C CD2 . PHE B ? 58 ? 4.216 -1.283 7.305 1.0 98.49 58 B 1 +ATOM 3303 C CE1 . PHE B ? 58 ? 3.257 -3.168 5.450 1.0 98.28 58 B 1 +ATOM 3304 C CE2 . PHE B ? 58 ? 4.740 -2.588 7.302 1.0 98.2 58 B 1 +ATOM 3305 C CZ . PHE B ? 58 ? 4.260 -3.531 6.373 1.0 98.41 58 B 1 +ATOM 3306 N N . ILE B ? 59 ? 2.108 3.164 4.216 1.0 98.95 59 B 1 +ATOM 3307 C CA . ILE B ? 59 ? 1.418 4.449 4.014 1.0 98.96 59 B 1 +ATOM 3308 C C . ILE B ? 59 ? 0.047 4.211 3.379 1.0 98.94 59 B 1 +ATOM 3309 O O . ILE B ? 59 ? -0.058 3.600 2.319 1.0 98.87 59 B 1 +ATOM 3310 C CB . ILE B ? 59 ? 2.284 5.437 3.196 1.0 98.95 59 B 1 +ATOM 3311 C CG1 . ILE B ? 59 ? 3.655 5.662 3.885 1.0 98.77 59 B 1 +ATOM 3312 C CG2 . ILE B ? 59 ? 1.531 6.772 3.022 1.0 98.84 59 B 1 +ATOM 3313 C CD1 . ILE B ? 59 ? 4.597 6.626 3.151 1.0 98.3 59 B 1 +ATOM 3314 N N . GLY B ? 60 ? -1.010 4.700 4.022 1.0 98.95 60 B 1 +ATOM 3315 C CA . GLY B ? 60 ? -2.372 4.652 3.511 1.0 98.94 60 B 1 +ATOM 3316 C C . GLY B ? 60 ? -2.619 5.687 2.416 1.0 98.95 60 B 1 +ATOM 3317 O O . GLY B ? 60 ? -2.310 6.857 2.592 1.0 98.88 60 B 1 +ATOM 3318 N N . VAL B ? 61 ? -3.217 5.255 1.304 1.0 98.93 61 B 1 +ATOM 3319 C CA . VAL B ? 61 ? -3.727 6.136 0.245 1.0 98.92 61 B 1 +ATOM 3320 C C . VAL B ? 61 ? -4.869 5.415 -0.469 1.0 98.9 61 B 1 +ATOM 3321 O O . VAL B ? 61 ? -4.776 4.208 -0.710 1.0 98.67 61 B 1 +ATOM 3322 C CB . VAL B ? 61 ? -2.601 6.585 -0.718 1.0 98.8 61 B 1 +ATOM 3323 C CG1 . VAL B ? 61 ? -1.894 5.429 -1.439 1.0 97.92 61 B 1 +ATOM 3324 C CG2 . VAL B ? 61 ? -3.101 7.598 -1.761 1.0 97.1 61 B 1 +ATOM 3325 N N . VAL B ? 62 ? -5.965 6.115 -0.753 1.0 98.86 62 B 1 +ATOM 3326 C CA . VAL B ? 62 ? -7.191 5.490 -1.283 1.0 98.81 62 B 1 +ATOM 3327 C C . VAL B ? 62 ? -7.283 5.610 -2.800 1.0 98.73 62 B 1 +ATOM 3328 O O . VAL B ? 62 ? -7.564 4.619 -3.476 1.0 98.36 62 B 1 +ATOM 3329 C CB . VAL B ? 62 ? -8.451 6.061 -0.606 1.0 98.74 62 B 1 +ATOM 3330 C CG1 . VAL B ? 62 ? -9.708 5.303 -1.044 1.0 98.29 62 B 1 +ATOM 3331 C CG2 . VAL B ? 62 ? -8.357 5.972 0.923 1.0 98.39 62 B 1 +ATOM 3332 N N . VAL B ? 63 ? -7.035 6.802 -3.332 1.0 98.74 63 B 1 +ATOM 3333 C CA . VAL B ? 63 ? -7.143 7.101 -4.767 1.0 98.69 63 B 1 +ATOM 3334 C C . VAL B ? 63 ? -5.816 7.663 -5.292 1.0 98.58 63 B 1 +ATOM 3335 O O . VAL B ? 63 ? -5.706 8.856 -5.575 1.0 98.19 63 B 1 +ATOM 3336 C CB . VAL B ? 63 ? -8.346 8.021 -5.078 1.0 98.56 63 B 1 +ATOM 3337 C CG1 . VAL B ? 63 ? -8.657 7.964 -6.576 1.0 97.59 63 B 1 +ATOM 3338 C CG2 . VAL B ? 63 ? -9.620 7.610 -4.326 1.0 97.74 63 B 1 +ATOM 3339 N N . PRO B ? 64 ? -4.770 6.829 -5.421 1.0 98.6 64 B 1 +ATOM 3340 C CA . PRO B ? 64 ? -3.447 7.281 -5.859 1.0 98.33 64 B 1 +ATOM 3341 C C . PRO B ? 64 ? -3.335 7.502 -7.374 1.0 98.36 64 B 1 +ATOM 3342 O O . PRO B ? 64 ? -2.228 7.650 -7.889 1.0 97.51 64 B 1 +ATOM 3343 C CB . PRO B ? 64 ? -2.493 6.194 -5.358 1.0 97.45 64 B 1 +ATOM 3344 C CG . PRO B ? 64 ? -3.331 4.923 -5.512 1.0 96.85 64 B 1 +ATOM 3345 C CD . PRO B ? 64 ? -4.733 5.402 -5.121 1.0 97.87 64 B 1 +ATOM 3346 N N . SER B ? 65 ? -4.445 7.516 -8.097 1.0 98.42 65 B 1 +ATOM 3347 C CA . SER B ? 65 ? -4.479 7.680 -9.553 1.0 98.48 65 B 1 +ATOM 3348 C C . SER B ? 65 ? -3.710 8.928 -9.994 1.0 98.47 65 B 1 +ATOM 3349 O O . SER B ? 65 ? -3.946 10.020 -9.482 1.0 98.28 65 B 1 +ATOM 3350 C CB . SER B ? 65 ? -5.927 7.775 -10.048 1.0 98.3 65 B 1 +ATOM 3351 O OG . SER B ? 65 ? -6.700 6.704 -9.536 1.0 95.38 65 B 1 +ATOM 3352 N N . ASN B ? 66 ? -2.791 8.763 -10.941 1.0 97.95 66 B 1 +ATOM 3353 C CA . ASN B ? 66 ? -1.875 9.795 -11.438 1.0 97.98 66 B 1 +ATOM 3354 C C . ASN B ? 66 ? -0.817 10.277 -10.416 1.0 98.09 66 B 1 +ATOM 3355 O O . ASN B ? 66 ? -0.103 11.247 -10.679 1.0 97.7 66 B 1 +ATOM 3356 C CB . ASN B ? 66 ? -2.694 10.928 -12.091 1.0 97.64 66 B 1 +ATOM 3357 C CG . ASN B ? 66 ? -1.879 11.854 -12.967 1.0 97.26 66 B 1 +ATOM 3358 O OD1 . ASN B ? 66 ? -0.963 11.458 -13.670 1.0 92.99 66 B 1 +ATOM 3359 N ND2 . ASN B ? 66 ? -2.222 13.123 -12.993 1.0 92.54 66 B 1 +ATOM 3360 N N . ALA B ? 67 ? -0.651 9.597 -9.281 1.0 98.57 67 B 1 +ATOM 3361 C CA . ALA B ? 67 ? 0.435 9.887 -8.341 1.0 98.56 67 B 1 +ATOM 3362 C C . ALA B ? 67 ? 1.810 9.362 -8.809 1.0 98.55 67 B 1 +ATOM 3363 O O . ALA B ? 67 ? 2.838 9.739 -8.244 1.0 97.94 67 B 1 +ATOM 3364 C CB . ALA B ? 67 ? 0.057 9.336 -6.964 1.0 98.4 67 B 1 +ATOM 3365 N N . GLY B ? 68 ? 1.840 8.532 -9.844 1.0 98.32 68 B 1 +ATOM 3366 C CA . GLY B ? 68 ? 3.041 7.864 -10.337 1.0 98.42 68 B 1 +ATOM 3367 C C . GLY B ? 68 ? 3.328 6.541 -9.626 1.0 98.52 68 B 1 +ATOM 3368 O O . GLY B ? 68 ? 2.700 6.189 -8.628 1.0 98.01 68 B 1 +ATOM 3369 N N . GLN B ? 69 ? 4.310 5.791 -10.143 1.0 98.33 69 B 1 +ATOM 3370 C CA . GLN B ? 69 ? 4.647 4.458 -9.644 1.0 98.24 69 B 1 +ATOM 3371 C C . GLN B ? 69 ? 5.012 4.464 -8.156 1.0 98.31 69 B 1 +ATOM 3372 O O . GLN B ? 69 ? 5.917 5.176 -7.717 1.0 97.88 69 B 1 +ATOM 3373 C CB . GLN B ? 69 ? 5.786 3.869 -10.486 1.0 97.68 69 B 1 +ATOM 3374 C CG . GLN B ? 69 ? 6.081 2.410 -10.112 1.0 95.99 69 B 1 +ATOM 3375 C CD . GLN B ? 69 ? 7.312 1.878 -10.828 1.0 95.62 69 B 1 +ATOM 3376 O OE1 . GLN B ? 69 ? 8.433 2.184 -10.465 1.0 88.57 69 B 1 +ATOM 3377 N NE2 . GLN B ? 69 ? 7.150 1.070 -11.849 1.0 87.37 69 B 1 +ATOM 3378 N N . GLY B ? 70 ? 4.345 3.611 -7.387 1.0 98.05 70 B 1 +ATOM 3379 C CA . GLY B ? 70 ? 4.649 3.409 -5.976 1.0 98.16 70 B 1 +ATOM 3380 C C . GLY B ? 70 ? 4.664 4.704 -5.157 1.0 98.48 70 B 1 +ATOM 3381 O O . GLY B ? 70 ? 5.721 5.079 -4.646 1.0 97.92 70 B 1 +ATOM 3382 N N . PRO B ? 71 ? 3.533 5.401 -4.993 1.0 98.57 71 B 1 +ATOM 3383 C CA . PRO B ? 71 ? 3.497 6.714 -4.337 1.0 98.55 71 B 1 +ATOM 3384 C C . PRO B ? 71 ? 4.078 6.702 -2.920 1.0 98.71 71 B 1 +ATOM 3385 O O . PRO B ? 71 ? 4.783 7.633 -2.534 1.0 98.51 71 B 1 +ATOM 3386 C CB . PRO B ? 71 ? 2.021 7.132 -4.360 1.0 97.97 71 B 1 +ATOM 3387 C CG . PRO B ? 71 ? 1.263 5.814 -4.523 1.0 96.19 71 B 1 +ATOM 3388 C CD . PRO B ? 71 ? 2.198 4.988 -5.389 1.0 98.08 71 B 1 +ATOM 3389 N N . ALA B ? 72 ? 3.873 5.631 -2.161 1.0 98.66 72 B 1 +ATOM 3390 C CA . ALA B ? 72 ? 4.478 5.474 -0.840 1.0 98.78 72 B 1 +ATOM 3391 C C . ALA B ? 72 ? 6.015 5.406 -0.905 1.0 98.84 72 B 1 +ATOM 3392 O O . ALA B ? 72 ? 6.699 5.998 -0.073 1.0 98.78 72 B 1 +ATOM 3393 C CB . ALA B ? 72 ? 3.889 4.222 -0.185 1.0 98.73 72 B 1 +ATOM 3394 N N . ARG B ? 73 ? 6.574 4.744 -1.919 1.0 98.35 73 B 1 +ATOM 3395 C CA . ARG B ? 73 ? 8.033 4.682 -2.141 1.0 98.39 73 B 1 +ATOM 3396 C C . ARG B ? 73 ? 8.604 6.066 -2.449 1.0 98.54 73 B 1 +ATOM 3397 O O . ARG B ? 73 ? 9.642 6.417 -1.898 1.0 98.45 73 B 1 +ATOM 3398 C CB . ARG B ? 73 ? 8.324 3.657 -3.252 1.0 98.15 73 B 1 +ATOM 3399 C CG . ARG B ? 73 ? 9.819 3.467 -3.574 1.0 97.01 73 B 1 +ATOM 3400 C CD . ARG B ? 73 ? 10.620 2.812 -2.434 1.0 95.9 73 B 1 +ATOM 3401 N NE . ARG B ? 73 ? 11.978 2.480 -2.901 1.0 96.92 73 B 1 +ATOM 3402 C CZ . ARG B ? 73 ? 12.997 2.047 -2.182 1.0 97.44 73 B 1 +ATOM 3403 N NH1 . ARG B ? 73 ? 12.919 1.832 -0.904 1.0 94.05 73 B 1 +ATOM 3404 N NH2 . ARG B ? 73 ? 14.138 1.818 -2.750 1.0 94.96 73 B 1 +ATOM 3405 N N . GLN B ? 74 ? 7.914 6.866 -3.258 1.0 98.5 74 B 1 +ATOM 3406 C CA . GLN B ? 74 ? 8.298 8.253 -3.549 1.0 98.39 74 B 1 +ATOM 3407 C C . GLN B ? 74 ? 8.360 9.106 -2.273 1.0 98.63 74 B 1 +ATOM 3408 O O . GLN B ? 74 ? 9.314 9.856 -2.078 1.0 98.6 74 B 1 +ATOM 3409 C CB . GLN B ? 74 ? 7.304 8.898 -4.527 1.0 98.32 74 B 1 +ATOM 3410 C CG . GLN B ? 74 ? 7.188 8.195 -5.885 1.0 97.85 74 B 1 +ATOM 3411 C CD . GLN B ? 74 ? 6.217 8.938 -6.800 1.0 98.18 74 B 1 +ATOM 3412 O OE1 . GLN B ? 74 ? 6.253 10.154 -6.915 1.0 93.38 74 B 1 +ATOM 3413 N NE2 . GLN B ? 74 ? 5.308 8.252 -7.456 1.0 93.75 74 B 1 +ATOM 3414 N N . VAL B ? 75 ? 7.375 8.966 -1.388 1.0 98.79 75 B 1 +ATOM 3415 C CA . VAL B ? 75 ? 7.327 9.662 -0.092 1.0 98.83 75 B 1 +ATOM 3416 C C . VAL B ? 75 ? 8.544 9.322 0.762 1.0 98.83 75 B 1 +ATOM 3417 O O . VAL B ? 75 ? 9.224 10.220 1.257 1.0 98.76 75 B 1 +ATOM 3418 C CB . VAL B ? 75 ? 6.023 9.300 0.649 1.0 98.78 75 B 1 +ATOM 3419 C CG1 . VAL B ? 75 ? 6.033 9.704 2.128 1.0 98.37 75 B 1 +ATOM 3420 C CG2 . VAL B ? 75 ? 4.827 9.984 -0.025 1.0 98.19 75 B 1 +ATOM 3421 N N . VAL B ? 76 ? 8.834 8.034 0.915 1.0 98.84 76 B 1 +ATOM 3422 C CA . VAL B ? 76 ? 9.891 7.528 1.798 1.0 98.8 76 B 1 +ATOM 3423 C C . VAL B ? 76 ? 11.283 7.921 1.296 1.0 98.75 76 B 1 +ATOM 3424 O O . VAL B ? 76 ? 12.087 8.441 2.067 1.0 98.61 76 B 1 +ATOM 3425 C CB . VAL B ? 76 ? 9.724 6.005 1.966 1.0 98.7 76 B 1 +ATOM 3426 C CG1 . VAL B ? 76 ? 10.901 5.345 2.681 1.0 97.97 76 B 1 +ATOM 3427 C CG2 . VAL B ? 76 ? 8.459 5.722 2.791 1.0 98.07 76 B 1 +ATOM 3428 N N . LEU B ? 77 ? 11.559 7.748 0.003 1.0 98.74 77 B 1 +ATOM 3429 C CA . LEU B ? 77 ? 12.828 8.191 -0.585 1.0 98.65 77 B 1 +ATOM 3430 C C . LEU B ? 77 ? 12.951 9.722 -0.593 1.0 98.56 77 B 1 +ATOM 3431 O O . LEU B ? 77 ? 14.002 10.260 -0.255 1.0 98.26 77 B 1 +ATOM 3432 C CB . LEU B ? 77 ? 12.983 7.613 -2.001 1.0 98.59 77 B 1 +ATOM 3433 C CG . LEU B ? 77 ? 13.111 6.078 -2.073 1.0 98.05 77 B 1 +ATOM 3434 C CD1 . LEU B ? 77 ? 13.372 5.673 -3.523 1.0 96.94 77 B 1 +ATOM 3435 C CD2 . LEU B ? 77 ? 14.245 5.524 -1.211 1.0 96.62 77 B 1 +ATOM 3436 N N . GLY B ? 78 ? 11.867 10.433 -0.902 1.0 98.71 78 B 1 +ATOM 3437 C CA . GLY B ? 78 ? 11.835 11.896 -0.883 1.0 98.65 78 B 1 +ATOM 3438 C C . GLY B ? 78 ? 12.067 12.501 0.509 1.0 98.72 78 B 1 +ATOM 3439 O O . GLY B ? 78 ? 12.626 13.595 0.620 1.0 98.41 78 B 1 +ATOM 3440 N N . ALA B ? 79 ? 11.701 11.777 1.571 1.0 98.77 79 B 1 +ATOM 3441 C CA . ALA B ? 79 ? 11.992 12.166 2.951 1.0 98.79 79 B 1 +ATOM 3442 C C . ALA B ? 79 ? 13.453 11.898 3.379 1.0 98.77 79 B 1 +ATOM 3443 O O . ALA B ? 79 ? 13.840 12.278 4.485 1.0 98.53 79 B 1 +ATOM 3444 C CB . ALA B ? 79 ? 10.987 11.478 3.878 1.0 98.77 79 B 1 +ATOM 3445 N N . GLY B ? 80 ? 14.264 11.279 2.519 1.0 98.68 80 B 1 +ATOM 3446 C CA . GLY B ? 80 ? 15.680 10.994 2.765 1.0 98.66 80 B 1 +ATOM 3447 C C . GLY B ? 80 ? 15.955 9.636 3.417 1.0 98.77 80 B 1 +ATOM 3448 O O . GLY B ? 80 ? 17.064 9.420 3.904 1.0 98.31 80 B 1 +ATOM 3449 N N . CYS B ? 81 ? 14.973 8.730 3.442 1.0 98.75 81 B 1 +ATOM 3450 C CA . CYS B ? 81 ? 15.195 7.352 3.882 1.0 98.76 81 B 1 +ATOM 3451 C C . CYS B ? 81 ? 16.126 6.609 2.909 1.0 98.71 81 B 1 +ATOM 3452 O O . CYS B ? 81 ? 16.227 6.953 1.731 1.0 98.36 81 B 1 +ATOM 3453 C CB . CYS B ? 81 ? 13.858 6.617 4.035 1.0 98.76 81 B 1 +ATOM 3454 S SG . CYS B ? 81 ? 12.795 7.454 5.256 1.0 98.63 81 B 1 +ATOM 3455 N N . ASP B ? 82 ? 16.791 5.565 3.410 1.0 98.62 82 B 1 +ATOM 3456 C CA . ASP B ? 82 ? 17.722 4.783 2.602 1.0 98.57 82 B 1 +ATOM 3457 C C . ASP B ? 82 ? 17.004 4.000 1.487 1.0 98.6 82 B 1 +ATOM 3458 O O . ASP B ? 82 ? 15.859 3.567 1.635 1.0 98.31 82 B 1 +ATOM 3459 C CB . ASP B ? 82 ? 18.534 3.844 3.504 1.0 98.33 82 B 1 +ATOM 3460 C CG . ASP B ? 82 ? 19.673 3.224 2.696 1.0 97.21 82 B 1 +ATOM 3461 O OD1 . ASP B ? 82 ? 19.516 2.063 2.270 1.0 94.58 82 B 1 +ATOM 3462 O OD2 . ASP B ? 82 ? 20.646 3.960 2.419 1.0 94.23 82 B 1 +ATOM 3463 N N . VAL B ? 83 ? 17.691 3.780 0.373 1.0 98.6 83 B 1 +ATOM 3464 C CA . VAL B ? 83 ? 17.139 3.010 -0.757 1.0 98.54 83 B 1 +ATOM 3465 C C . VAL B ? 83 ? 16.807 1.557 -0.392 1.0 98.61 83 B 1 +ATOM 3466 O O . VAL B ? 83 ? 15.972 0.943 -1.050 1.0 98.06 83 B 1 +ATOM 3467 C CB . VAL B ? 83 ? 18.069 3.045 -1.981 1.0 98.0 83 B 1 +ATOM 3468 C CG1 . VAL B ? 83 ? 18.187 4.465 -2.541 1.0 95.58 83 B 1 +ATOM 3469 C CG2 . VAL B ? 83 ? 19.475 2.495 -1.683 1.0 95.26 83 B 1 +ATOM 3470 N N . SER B ? 84 ? 17.407 1.025 0.682 1.0 98.46 84 B 1 +ATOM 3471 C CA . SER B ? 84 ? 17.104 -0.304 1.224 1.0 98.47 84 B 1 +ATOM 3472 C C . SER B ? 84 ? 15.764 -0.388 1.973 1.0 98.57 84 B 1 +ATOM 3473 O O . SER B ? 84 ? 15.295 -1.490 2.248 1.0 98.23 84 B 1 +ATOM 3474 C CB . SER B ? 84 ? 18.239 -0.769 2.139 1.0 98.28 84 B 1 +ATOM 3475 O OG . SER B ? 84 ? 18.327 0.028 3.301 1.0 96.67 84 B 1 +ATOM 3476 N N . THR B ? 85 ? 15.131 0.747 2.279 1.0 98.61 85 B 1 +ATOM 3477 C CA . THR B ? 85 ? 13.853 0.796 3.004 1.0 98.68 85 B 1 +ATOM 3478 C C . THR B ? 85 ? 12.754 0.089 2.221 1.0 98.67 85 B 1 +ATOM 3479 O O . THR B ? 85 ? 12.491 0.419 1.064 1.0 98.52 85 B 1 +ATOM 3480 C CB . THR B ? 85 ? 13.418 2.243 3.280 1.0 98.64 85 B 1 +ATOM 3481 O OG1 . THR B ? 85 ? 14.475 2.998 3.815 1.0 96.95 85 B 1 +ATOM 3482 C CG2 . THR B ? 85 ? 12.268 2.322 4.283 1.0 97.15 85 B 1 +ATOM 3483 N N . VAL B ? 86 ? 12.070 -0.856 2.866 1.0 98.74 86 B 1 +ATOM 3484 C CA . VAL B ? 86 ? 10.927 -1.574 2.285 1.0 98.76 86 B 1 +ATOM 3485 C C . VAL B ? 86 ? 9.679 -0.707 2.415 1.0 98.82 86 B 1 +ATOM 3486 O O . VAL B ? 86 ? 9.396 -0.191 3.491 1.0 98.61 86 B 1 +ATOM 3487 C CB . VAL B ? 86 ? 10.737 -2.932 2.977 1.0 98.45 86 B 1 +ATOM 3488 C CG1 . VAL B ? 86 ? 9.571 -3.708 2.355 1.0 97.36 86 B 1 +ATOM 3489 C CG2 . VAL B ? 86 ? 12.003 -3.793 2.850 1.0 97.44 86 B 1 +ATOM 3490 N N . VAL B ? 87 ? 8.913 -0.539 1.340 1.0 98.71 87 B 1 +ATOM 3491 C CA . VAL B ? 87 ? 7.750 0.366 1.353 1.0 98.76 87 B 1 +ATOM 3492 C C . VAL B ? 87 ? 6.523 -0.289 0.736 1.0 98.74 87 B 1 +ATOM 3493 O O . VAL B ? 87 ? 6.583 -0.812 -0.370 1.0 98.52 87 B 1 +ATOM 3494 C CB . VAL B ? 87 ? 8.044 1.706 0.657 1.0 98.59 87 B 1 +ATOM 3495 C CG1 . VAL B ? 87 ? 6.907 2.699 0.927 1.0 97.46 87 B 1 +ATOM 3496 C CG2 . VAL B ? 87 ? 9.350 2.351 1.141 1.0 97.47 87 B 1 +ATOM 3497 N N . THR B ? 88 ? 5.396 -0.193 1.436 1.0 98.8 88 B 1 +ATOM 3498 C CA . THR B ? 88 ? 4.098 -0.710 0.987 1.0 98.79 88 B 1 +ATOM 3499 C C . THR B ? 88 ? 3.018 0.358 1.153 1.0 98.83 88 B 1 +ATOM 3500 O O . THR B ? 88 ? 2.855 0.914 2.237 1.0 98.78 88 B 1 +ATOM 3501 C CB . THR B ? 88 ? 3.728 -1.976 1.770 1.0 98.72 88 B 1 +ATOM 3502 O OG1 . THR B ? 88 ? 4.779 -2.920 1.702 1.0 97.5 88 B 1 +ATOM 3503 C CG2 . THR B ? 88 ? 2.492 -2.670 1.214 1.0 97.75 88 B 1 +ATOM 3504 N N . ALA B ? 89 ? 2.264 0.641 0.090 1.0 98.88 89 B 1 +ATOM 3505 C CA . ALA B ? 89 ? 1.032 1.418 0.186 1.0 98.85 89 B 1 +ATOM 3506 C C . ALA B ? 89 ? -0.141 0.498 0.556 1.0 98.82 89 B 1 +ATOM 3507 O O . ALA B ? 89 ? -0.215 -0.636 0.080 1.0 98.62 89 B 1 +ATOM 3508 C CB . ALA B ? 89 ? 0.781 2.168 -1.124 1.0 98.72 89 B 1 +ATOM 3509 N N . VAL B ? 90 ? -1.061 0.982 1.393 1.0 98.76 90 B 1 +ATOM 3510 C CA . VAL B ? 90 ? -2.252 0.234 1.815 1.0 98.68 90 B 1 +ATOM 3511 C C . VAL B ? 90 ? -3.528 1.012 1.504 1.0 98.78 90 B 1 +ATOM 3512 O O . VAL B ? 90 ? -3.579 2.225 1.665 1.0 98.39 90 B 1 +ATOM 3513 C CB . VAL B ? 90 ? -2.200 -0.183 3.301 1.0 97.05 90 B 1 +ATOM 3514 C CG1 . VAL B ? 90 ? -1.013 -1.105 3.591 1.0 92.38 90 B 1 +ATOM 3515 C CG2 . VAL B ? 90 ? -2.121 0.986 4.278 1.0 92.17 90 B 1 +ATOM 3516 N N . ASN B ? 91 ? -4.577 0.299 1.078 1.0 98.68 91 B 1 +ATOM 3517 C CA . ASN B ? 91 ? -5.911 0.845 0.888 1.0 98.7 91 B 1 +ATOM 3518 C C . ASN B ? 91 ? -6.926 0.008 1.673 1.0 98.74 91 B 1 +ATOM 3519 O O . ASN B ? 91 ? -7.252 -1.118 1.308 1.0 98.58 91 B 1 +ATOM 3520 C CB . ASN B ? 91 ? -6.224 0.951 -0.617 1.0 98.47 91 B 1 +ATOM 3521 C CG . ASN B ? 91 ? -7.608 1.526 -0.897 1.0 97.65 91 B 1 +ATOM 3522 O OD1 . ASN B ? 91 ? -8.369 1.888 -0.012 1.0 93.9 91 B 1 +ATOM 3523 N ND2 . ASN B ? 91 ? -7.988 1.615 -2.151 1.0 92.97 91 B 1 +ATOM 3524 N N . LYS B ? 92 ? -7.434 0.581 2.743 1.0 98.62 92 B 1 +ATOM 3525 C CA . LYS B ? 92 ? -8.609 0.131 3.492 1.0 98.73 92 B 1 +ATOM 3526 C C . LYS B ? 92 ? -9.630 1.280 3.548 1.0 98.71 92 B 1 +ATOM 3527 O O . LYS B ? 92 ? -10.175 1.588 4.607 1.0 98.26 92 B 1 +ATOM 3528 C CB . LYS B ? 92 ? -8.186 -0.416 4.865 1.0 98.64 92 B 1 +ATOM 3529 C CG . LYS B ? 92 ? -9.322 -1.191 5.566 1.0 97.99 92 B 1 +ATOM 3530 C CD . LYS B ? 92 ? -8.840 -1.806 6.883 1.0 97.21 92 B 1 +ATOM 3531 C CE . LYS B ? 92 ? -9.963 -2.540 7.616 1.0 95.96 92 B 1 +ATOM 3532 N NZ . LYS B ? 92 ? -10.826 -1.627 8.403 1.0 95.16 92 B 1 +ATOM 3533 N N . MET B ? 93 ? -9.825 1.929 2.405 1.0 98.79 93 B 1 +ATOM 3534 C CA . MET B ? 93 ? -10.689 3.100 2.276 1.0 98.71 93 B 1 +ATOM 3535 C C . MET B ? 93 ? -10.343 4.146 3.347 1.0 98.8 93 B 1 +ATOM 3536 O O . MET B ? 93 ? -9.151 4.390 3.610 1.0 98.42 93 B 1 +ATOM 3537 C CB . MET B ? 93 ? -12.172 2.678 2.218 1.0 98.14 93 B 1 +ATOM 3538 C CG . MET B ? 93 ? -12.507 1.792 0.997 1.0 93.31 93 B 1 +ATOM 3539 S SD . MET B ? 93 ? -11.821 0.121 1.007 1.0 83.61 93 B 1 +ATOM 3540 C CE . MET B ? 93 ? -13.046 -0.735 2.026 1.0 70.99 93 B 1 +ATOM 3541 N N . CYS B ? 94 ? -11.339 4.755 3.991 1.0 98.62 94 B 1 +ATOM 3542 C CA . CYS B ? 94 ? -11.111 5.836 4.954 1.0 98.44 94 B 1 +ATOM 3543 C C . CYS B ? 94 ? -10.304 5.420 6.201 1.0 98.66 94 B 1 +ATOM 3544 O O . CYS B ? 94 ? -9.845 6.282 6.939 1.0 97.96 94 B 1 +ATOM 3545 C CB . CYS B ? 94 ? -12.471 6.418 5.353 1.0 96.94 94 B 1 +ATOM 3546 S SG . CYS B ? 94 ? -13.554 6.672 3.912 1.0 89.75 94 B 1 +ATOM 3547 N N . ALA B ? 95 ? -10.095 4.120 6.446 1.0 98.76 95 B 1 +ATOM 3548 C CA . ALA B ? 95 ? -9.266 3.608 7.540 1.0 98.86 95 B 1 +ATOM 3549 C C . ALA B ? 95 ? -7.811 3.296 7.129 1.0 98.91 95 B 1 +ATOM 3550 O O . ALA B ? 95 ? -7.040 2.791 7.945 1.0 98.82 95 B 1 +ATOM 3551 C CB . ALA B ? 95 ? -9.957 2.391 8.161 1.0 98.73 95 B 1 +ATOM 3552 N N . SER B ? 96 ? -7.411 3.599 5.898 1.0 98.9 96 B 1 +ATOM 3553 C CA . SER B ? 96 ? -6.101 3.245 5.331 1.0 98.91 96 B 1 +ATOM 3554 C C . SER B ? 96 ? -4.916 3.685 6.197 1.0 98.93 96 B 1 +ATOM 3555 O O . SER B ? 96 ? -4.036 2.877 6.489 1.0 98.87 96 B 1 +ATOM 3556 C CB . SER B ? 96 ? -5.964 3.853 3.931 1.0 98.83 96 B 1 +ATOM 3557 O OG . SER B ? 96 ? -6.973 3.343 3.083 1.0 98.29 96 B 1 +ATOM 3558 N N . GLY B ? 97 ? -4.916 4.933 6.661 1.0 98.92 97 B 1 +ATOM 3559 C CA . GLY B ? 97 ? -3.850 5.450 7.525 1.0 98.94 97 B 1 +ATOM 3560 C C . GLY B ? 97 ? -3.732 4.707 8.864 1.0 98.96 97 B 1 +ATOM 3561 O O . GLY B ? 97 ? -2.628 4.491 9.356 1.0 98.9 97 B 1 +ATOM 3562 N N . MET B ? 98 ? -4.851 4.254 9.435 1.0 98.95 98 B 1 +ATOM 3563 C CA . MET B ? 98 ? -4.835 3.454 10.666 1.0 98.95 98 B 1 +ATOM 3564 C C . MET B ? 98 ? -4.384 2.010 10.405 1.0 98.95 98 B 1 +ATOM 3565 O O . MET B ? 98 ? -3.601 1.466 11.181 1.0 98.9 98 B 1 +ATOM 3566 C CB . MET B ? 98 ? -6.211 3.503 11.336 1.0 98.85 98 B 1 +ATOM 3567 C CG . MET B ? 98 ? -6.172 2.868 12.731 1.0 97.58 98 B 1 +ATOM 3568 S SD . MET B ? 98 ? -7.728 2.980 13.648 1.0 97.35 98 B 1 +ATOM 3569 C CE . MET B ? 98 ? -7.755 4.746 14.034 1.0 93.33 98 B 1 +ATOM 3570 N N . LYS B ? 99 ? -4.822 1.393 9.298 1.0 98.92 99 B 1 +ATOM 3571 C CA . LYS B ? 99 ? -4.361 0.047 8.922 1.0 98.92 99 B 1 +ATOM 3572 C C . LYS B ? 99 ? -2.855 0.017 8.636 1.0 98.92 99 B 1 +ATOM 3573 O O . LYS B ? 99 ? -2.204 -0.954 8.996 1.0 98.86 99 B 1 +ATOM 3574 C CB . LYS B ? 99 ? -5.189 -0.502 7.748 1.0 98.87 99 B 1 +ATOM 3575 C CG . LYS B ? 99 ? -4.939 -2.002 7.461 1.0 98.52 99 B 1 +ATOM 3576 C CD . LYS B ? 99 ? -5.378 -2.930 8.608 1.0 97.94 99 B 1 +ATOM 3577 C CE . LYS B ? 99 ? -5.288 -4.417 8.230 1.0 97.31 99 B 1 +ATOM 3578 N NZ . LYS B ? 99 ? -5.880 -5.313 9.262 1.0 96.17 99 B 1 +ATOM 3579 N N . ALA B ? 100 ? -2.294 1.087 8.075 1.0 98.96 100 B 1 +ATOM 3580 C CA . ALA B ? 100 ? -0.848 1.230 7.909 1.0 98.96 100 B 1 +ATOM 3581 C C . ALA B ? 100 ? -0.106 1.158 9.258 1.0 98.95 100 B 1 +ATOM 3582 O O . ALA B ? 100 ? 0.861 0.409 9.390 1.0 98.91 100 B 1 +ATOM 3583 C CB . ALA B ? 100 ? -0.567 2.552 7.180 1.0 98.94 100 B 1 +ATOM 3584 N N . ILE B ? 101 ? -0.610 1.853 10.281 1.0 98.96 101 B 1 +ATOM 3585 C CA . ILE B ? 101 ? -0.059 1.804 11.644 1.0 98.96 101 B 1 +ATOM 3586 C C . ILE B ? 101 ? -0.204 0.395 12.247 1.0 98.92 101 B 1 +ATOM 3587 O O . ILE B ? 101 ? 0.727 -0.098 12.879 1.0 98.84 101 B 1 +ATOM 3588 C CB . ILE B ? 101 ? -0.706 2.890 12.537 1.0 98.96 101 B 1 +ATOM 3589 C CG1 . ILE B ? 101 ? -0.410 4.309 11.988 1.0 98.86 101 B 1 +ATOM 3590 C CG2 . ILE B ? 101 ? -0.198 2.786 13.985 1.0 98.88 101 B 1 +ATOM 3591 C CD1 . ILE B ? 101 ? -1.206 5.431 12.671 1.0 98.69 101 B 1 +ATOM 3592 N N . ALA B ? 102 ? -1.329 -0.288 12.013 1.0 98.91 102 B 1 +ATOM 3593 C CA . ALA B ? 102 ? -1.531 -1.666 12.464 1.0 98.86 102 B 1 +ATOM 3594 C C . ALA B ? 102 ? -0.537 -2.647 11.809 1.0 98.8 102 B 1 +ATOM 3595 O O . ALA B ? 102 ? 0.064 -3.467 12.499 1.0 98.6 102 B 1 +ATOM 3596 C CB . ALA B ? 102 ? -2.985 -2.072 12.190 1.0 98.78 102 B 1 +ATOM 3597 N N . CYS B ? 103 ? -0.299 -2.523 10.498 1.0 98.85 103 B 1 +ATOM 3598 C CA . CYS B ? 103 ? 0.708 -3.315 9.791 1.0 98.8 103 B 1 +ATOM 3599 C C . CYS B ? 103 ? 2.118 -3.074 10.358 1.0 98.72 103 B 1 +ATOM 3600 O O . CYS B ? 103 ? 2.844 -4.031 10.615 1.0 98.53 103 B 1 +ATOM 3601 C CB . CYS B ? 103 ? 0.661 -2.987 8.290 1.0 98.8 103 B 1 +ATOM 3602 S SG . CYS B ? 103 ? -0.873 -3.598 7.529 1.0 98.45 103 B 1 +ATOM 3603 N N . ALA B ? 104 ? 2.476 -1.813 10.617 1.0 98.83 104 B 1 +ATOM 3604 C CA . ALA B ? 104 ? 3.755 -1.461 11.231 1.0 98.82 104 B 1 +ATOM 3605 C C . ALA B ? 104 ? 3.907 -2.059 12.643 1.0 98.72 104 B 1 +ATOM 3606 O O . ALA B ? 104 ? 4.955 -2.613 12.967 1.0 98.53 104 B 1 +ATOM 3607 C CB . ALA B ? 104 ? 3.875 0.065 11.253 1.0 98.83 104 B 1 +ATOM 3608 N N . ALA B ? 105 ? 2.850 -2.014 13.458 1.0 98.72 105 B 1 +ATOM 3609 C CA . ALA B ? 105 ? 2.839 -2.630 14.783 1.0 98.62 105 B 1 +ATOM 3610 C C . ALA B ? 105 ? 3.068 -4.149 14.713 1.0 98.42 105 B 1 +ATOM 3611 O O . ALA B ? 105 ? 3.889 -4.675 15.462 1.0 98.13 105 B 1 +ATOM 3612 C CB . ALA B ? 105 ? 1.516 -2.293 15.479 1.0 98.6 105 B 1 +ATOM 3613 N N . SER B ? 106 ? 2.413 -4.842 13.775 1.0 98.44 106 B 1 +ATOM 3614 C CA . SER B ? 106 ? 2.589 -6.286 13.568 1.0 98.21 106 B 1 +ATOM 3615 C C . SER B ? 106 ? 4.032 -6.656 13.201 1.0 97.95 106 B 1 +ATOM 3616 O O . SER B ? 106 ? 4.582 -7.611 13.744 1.0 97.45 106 B 1 +ATOM 3617 C CB . SER B ? 106 ? 1.642 -6.787 12.472 1.0 98.07 106 B 1 +ATOM 3618 O OG . SER B ? 106 ? 0.285 -6.581 12.822 1.0 96.6 106 B 1 +ATOM 3619 N N . ILE B ? 107 ? 4.670 -5.873 12.326 1.0 98.06 107 B 1 +ATOM 3620 C CA . ILE B ? 107 ? 6.074 -6.069 11.925 1.0 97.63 107 B 1 +ATOM 3621 C C . ILE B ? 107 ? 7.027 -5.901 13.123 1.0 97.84 107 B 1 +ATOM 3622 O O . ILE B ? 107 ? 7.936 -6.708 13.302 1.0 97.0 107 B 1 +ATOM 3623 C CB . ILE B ? 107 ? 6.422 -5.108 10.764 1.0 95.71 107 B 1 +ATOM 3624 C CG1 . ILE B ? 107 ? 5.657 -5.456 9.462 1.0 87.48 107 B 1 +ATOM 3625 C CG2 . ILE B ? 107 ? 7.930 -5.044 10.477 1.0 83.84 107 B 1 +ATOM 3626 C CD1 . ILE B ? 107 ? 5.970 -6.820 8.843 1.0 81.0 107 B 1 +ATOM 3627 N N . LEU B ? 108 ? 6.793 -4.887 13.964 1.0 98.16 108 B 1 +ATOM 3628 C CA . LEU B ? 108 ? 7.586 -4.645 15.173 1.0 98.2 108 B 1 +ATOM 3629 C C . LEU B ? 108 ? 7.386 -5.740 16.230 1.0 97.79 108 B 1 +ATOM 3630 O O . LEU B ? 108 ? 8.355 -6.189 16.839 1.0 97.33 108 B 1 +ATOM 3631 C CB . LEU B ? 108 ? 7.223 -3.267 15.748 1.0 98.47 108 B 1 +ATOM 3632 C CG . LEU B ? 108 ? 7.683 -2.075 14.889 1.0 98.42 108 B 1 +ATOM 3633 C CD1 . LEU B ? 108 ? 7.055 -0.792 15.434 1.0 98.29 108 B 1 +ATOM 3634 C CD2 . LEU B ? 108 ? 9.201 -1.905 14.904 1.0 98.22 108 B 1 +ATOM 3635 N N . GLN B ? 109 ? 6.152 -6.211 16.429 1.0 97.88 109 B 1 +ATOM 3636 C CA . GLN B ? 109 ? 5.856 -7.308 17.364 1.0 97.59 109 B 1 +ATOM 3637 C C . GLN B ? 109 ? 6.537 -8.620 16.968 1.0 97.2 109 B 1 +ATOM 3638 O O . GLN B ? 109 ? 6.950 -9.380 17.839 1.0 96.44 109 B 1 +ATOM 3639 C CB . GLN B ? 109 ? 4.347 -7.548 17.444 1.0 97.46 109 B 1 +ATOM 3640 C CG . GLN B ? 109 ? 3.618 -6.520 18.309 1.0 96.41 109 B 1 +ATOM 3641 C CD . GLN B ? 109 ? 2.171 -6.963 18.511 1.0 96.59 109 B 1 +ATOM 3642 O OE1 . GLN B ? 109 ? 1.284 -6.653 17.739 1.0 91.86 109 B 1 +ATOM 3643 N NE2 . GLN B ? 109 ? 1.894 -7.742 19.538 1.0 90.77 109 B 1 +ATOM 3644 N N . LEU B ? 110 ? 6.669 -8.881 15.668 1.0 97.51 110 B 1 +ATOM 3645 C CA . LEU B ? 110 ? 7.351 -10.063 15.135 1.0 97.08 110 B 1 +ATOM 3646 C C . LEU B ? 110 ? 8.881 -9.915 15.080 1.0 96.56 110 B 1 +ATOM 3647 O O . LEU B ? 110 ? 9.550 -10.827 14.606 1.0 95.31 110 B 1 +ATOM 3648 C CB . LEU B ? 110 ? 6.761 -10.407 13.759 1.0 97.05 110 B 1 +ATOM 3649 C CG . LEU B ? 110 ? 5.329 -10.968 13.813 1.0 96.76 110 B 1 +ATOM 3650 C CD1 . LEU B ? 110 ? 4.773 -11.056 12.395 1.0 96.05 110 B 1 +ATOM 3651 C CD2 . LEU B ? 110 ? 5.279 -12.367 14.434 1.0 95.89 110 B 1 +ATOM 3652 N N . ASP B ? 111 ? 9.436 -8.786 15.548 1.0 96.51 111 B 1 +ATOM 3653 C CA . ASP B ? 111 ? 10.878 -8.485 15.506 1.0 96.0 111 B 1 +ATOM 3654 C C . ASP B ? 111 ? 11.484 -8.565 14.088 1.0 96.38 111 B 1 +ATOM 3655 O O . ASP B ? 111 ? 12.674 -8.825 13.916 1.0 94.71 111 B 1 +ATOM 3656 C CB . ASP B ? 111 ? 11.639 -9.307 16.577 1.0 94.45 111 B 1 +ATOM 3657 C CG . ASP B ? 111 ? 12.254 -8.499 17.721 1.0 90.92 111 B 1 +ATOM 3658 O OD1 . ASP B ? 111 ? 12.358 -7.257 17.654 1.0 86.05 111 B 1 +ATOM 3659 O OD2 . ASP B ? 111 ? 12.631 -9.118 18.749 1.0 84.66 111 B 1 +ATOM 3660 N N . LEU B ? 112 ? 10.666 -8.352 13.047 1.0 96.81 112 B 1 +ATOM 3661 C CA . LEU B ? 112 ? 11.115 -8.336 11.647 1.0 96.79 112 B 1 +ATOM 3662 C C . LEU B ? 112 ? 11.858 -7.045 11.295 1.0 97.12 112 B 1 +ATOM 3663 O O . LEU B ? 112 ? 12.711 -7.041 10.407 1.0 96.3 112 B 1 +ATOM 3664 C CB . LEU B ? 112 ? 9.903 -8.525 10.717 1.0 96.53 112 B 1 +ATOM 3665 C CG . LEU B ? 112 ? 9.189 -9.886 10.844 1.0 95.86 112 B 1 +ATOM 3666 C CD1 . LEU B ? 112 ? 7.929 -9.884 9.983 1.0 94.45 112 B 1 +ATOM 3667 C CD2 . LEU B ? 112 ? 10.078 -11.043 10.385 1.0 94.15 112 B 1 +ATOM 3668 N N . GLN B ? 113 ? 11.518 -5.963 11.991 1.0 97.27 113 B 1 +ATOM 3669 C CA . GLN B ? 113 ? 12.138 -4.639 11.888 1.0 97.78 113 B 1 +ATOM 3670 C C . GLN B ? 113 ? 12.183 -3.995 13.283 1.0 97.91 113 B 1 +ATOM 3671 O O . GLN B ? 113 ? 11.436 -4.377 14.179 1.0 97.4 113 B 1 +ATOM 3672 C CB . GLN B ? 113 ? 11.338 -3.746 10.930 1.0 97.78 113 B 1 +ATOM 3673 C CG . GLN B ? 113 ? 11.170 -4.267 9.501 1.0 97.33 113 B 1 +ATOM 3674 C CD . GLN B ? 113 ? 12.432 -4.314 8.642 1.0 97.67 113 B 1 +ATOM 3675 O OE1 . GLN B ? 113 ? 13.560 -4.159 9.073 1.0 93.66 113 B 1 +ATOM 3676 N NE2 . GLN B ? 113 ? 12.257 -4.542 7.360 1.0 94.31 113 B 1 +ATOM 3677 N N . GLU B ? 114 ? 13.048 -2.992 13.451 1.0 98.39 114 B 1 +ATOM 3678 C CA . GLU B ? 114 ? 13.208 -2.233 14.699 1.0 98.41 114 B 1 +ATOM 3679 C C . GLU B ? 114 ? 12.737 -0.770 14.571 1.0 98.66 114 B 1 +ATOM 3680 O O . GLU B ? 114 ? 12.297 -0.174 15.546 1.0 98.38 114 B 1 +ATOM 3681 C CB . GLU B ? 114 ? 14.689 -2.322 15.113 1.0 97.52 114 B 1 +ATOM 3682 C CG . GLU B ? 114 ? 14.987 -1.754 16.509 1.0 94.15 114 B 1 +ATOM 3683 C CD . GLU B ? 114 ? 16.502 -1.822 16.805 1.0 92.82 114 B 1 +ATOM 3684 O OE1 . GLU B ? 114 ? 16.934 -2.465 17.782 1.0 85.55 114 B 1 +ATOM 3685 O OE2 . GLU B ? 114 ? 17.304 -1.228 16.041 1.0 87.24 114 B 1 +ATOM 3686 N N . MET B ? 115 ? 12.821 -0.193 13.367 1.0 98.71 115 B 1 +ATOM 3687 C CA . MET B ? 115 ? 12.406 1.188 13.090 1.0 98.8 115 B 1 +ATOM 3688 C C . MET B ? 115 ? 11.498 1.236 11.865 1.0 98.88 115 B 1 +ATOM 3689 O O . MET B ? 115 ? 11.948 1.005 10.740 1.0 98.76 115 B 1 +ATOM 3690 C CB . MET B ? 115 ? 13.654 2.064 12.894 1.0 98.55 115 B 1 +ATOM 3691 C CG . MET B ? 115 ? 13.329 3.560 12.883 1.0 94.06 115 B 1 +ATOM 3692 S SD . MET B ? 115 ? 12.754 4.265 14.463 1.0 94.83 115 B 1 +ATOM 3693 C CE . MET B ? 115 ? 14.203 3.966 15.502 1.0 88.26 115 B 1 +ATOM 3694 N N . VAL B ? 116 ? 10.233 1.563 12.078 1.0 98.92 116 B 1 +ATOM 3695 C CA . VAL B ? 116 ? 9.196 1.576 11.039 1.0 98.93 116 B 1 +ATOM 3696 C C . VAL B ? 116 ? 8.477 2.922 11.045 1.0 98.96 116 B 1 +ATOM 3697 O O . VAL B ? 116 ? 8.205 3.493 12.097 1.0 98.89 116 B 1 +ATOM 3698 C CB . VAL B ? 116 ? 8.212 0.400 11.222 1.0 98.62 116 B 1 +ATOM 3699 C CG1 . VAL B ? 116 ? 7.217 0.315 10.064 1.0 93.66 116 B 1 +ATOM 3700 C CG2 . VAL B ? 116 ? 8.943 -0.953 11.287 1.0 91.68 116 B 1 +ATOM 3701 N N . VAL B ? 117 ? 8.146 3.432 9.873 1.0 98.95 117 B 1 +ATOM 3702 C CA . VAL B ? 117 ? 7.249 4.585 9.733 1.0 98.95 117 B 1 +ATOM 3703 C C . VAL B ? 117 ? 5.911 4.138 9.162 1.0 98.96 117 B 1 +ATOM 3704 O O . VAL B ? 117 ? 5.833 3.200 8.369 1.0 98.89 117 B 1 +ATOM 3705 C CB . VAL B ? 117 ? 7.866 5.746 8.930 1.0 98.83 117 B 1 +ATOM 3706 C CG1 . VAL B ? 117 ? 9.120 6.277 9.625 1.0 97.91 117 B 1 +ATOM 3707 C CG2 . VAL B ? 117 ? 8.221 5.364 7.491 1.0 97.59 117 B 1 +ATOM 3708 N N . ALA B ? 118 ? 4.843 4.809 9.562 1.0 98.96 118 B 1 +ATOM 3709 C CA . ALA B ? 118 ? 3.507 4.531 9.064 1.0 98.96 118 B 1 +ATOM 3710 C C . ALA B ? 118 ? 2.679 5.811 8.997 1.0 98.97 118 B 1 +ATOM 3711 O O . ALA B ? 118 ? 3.028 6.829 9.587 1.0 98.89 118 B 1 +ATOM 3712 C CB . ALA B ? 118 ? 2.853 3.472 9.954 1.0 98.87 118 B 1 +ATOM 3713 N N . GLY B ? 119 ? 1.565 5.759 8.288 1.0 98.94 119 B 1 +ATOM 3714 C CA . GLY B ? 119 ? 0.663 6.896 8.207 1.0 98.92 119 B 1 +ATOM 3715 C C . GLY B ? 119 ? -0.283 6.808 7.028 1.0 98.95 119 B 1 +ATOM 3716 O O . GLY B ? 119 ? -0.569 5.729 6.512 1.0 98.83 119 B 1 +ATOM 3717 N N . GLY B ? 120 ? -0.775 7.964 6.616 1.0 98.97 120 B 1 +ATOM 3718 C CA . GLY B ? 120 ? -1.690 8.053 5.494 1.0 98.97 120 B 1 +ATOM 3719 C C . GLY B ? 120 ? -1.647 9.411 4.817 1.0 98.98 120 B 1 +ATOM 3720 O O . GLY B ? 120 ? -1.252 10.415 5.412 1.0 98.92 120 B 1 +ATOM 3721 N N . MET B ? 121 ? -2.051 9.418 3.557 1.0 98.97 121 B 1 +ATOM 3722 C CA . MET B ? 121 ? -2.059 10.607 2.721 1.0 98.96 121 B 1 +ATOM 3723 C C . MET B ? 121 ? -3.198 10.540 1.708 1.0 98.96 121 B 1 +ATOM 3724 O O . MET B ? 121 ? -3.588 9.462 1.268 1.0 98.88 121 B 1 +ATOM 3725 C CB . MET B ? 121 ? -0.693 10.773 2.037 1.0 98.84 121 B 1 +ATOM 3726 C CG . MET B ? 121 ? -0.331 9.630 1.075 1.0 98.81 121 B 1 +ATOM 3727 S SD . MET B ? 121 ? 1.369 9.749 0.453 1.0 98.79 121 B 1 +ATOM 3728 C CE . MET B ? 121 ? 1.370 8.389 -0.722 1.0 97.75 121 B 1 +ATOM 3729 N N . GLU B ? 122 ? -3.699 11.700 1.322 1.0 98.97 122 B 1 +ATOM 3730 C CA . GLU B ? 122 ? -4.640 11.825 0.207 1.0 98.96 122 B 1 +ATOM 3731 C C . GLU B ? 122 ? -4.525 13.214 -0.409 1.0 98.95 122 B 1 +ATOM 3732 O O . GLU B ? 122 ? -4.377 14.205 0.305 1.0 98.87 122 B 1 +ATOM 3733 C CB . GLU B ? 122 ? -6.074 11.577 0.677 1.0 98.91 122 B 1 +ATOM 3734 C CG . GLU B ? 122 ? -6.969 10.955 -0.412 1.0 98.49 122 B 1 +ATOM 3735 C CD . GLU B ? 122 ? -6.630 9.476 -0.650 1.0 98.87 122 B 1 +ATOM 3736 O OE1 . GLU B ? 122 ? -6.276 9.108 -1.782 1.0 97.83 122 B 1 +ATOM 3737 O OE2 . GLU B ? 122 ? -6.701 8.683 0.325 1.0 98.04 122 B 1 +ATOM 3738 N N . SER B ? 123 ? -4.611 13.298 -1.714 1.0 98.89 123 B 1 +ATOM 3739 C CA . SER B ? 123 ? -4.878 14.541 -2.429 1.0 98.87 123 B 1 +ATOM 3740 C C . SER B ? 123 ? -6.118 14.344 -3.282 1.0 98.86 123 B 1 +ATOM 3741 O O . SER B ? 123 ? -6.031 13.891 -4.421 1.0 98.65 123 B 1 +ATOM 3742 C CB . SER B ? 123 ? -3.686 14.981 -3.272 1.0 98.73 123 B 1 +ATOM 3743 O OG . SER B ? 123 ? -4.048 16.145 -3.992 1.0 97.9 123 B 1 +ATOM 3744 N N . MET B ? 124 ? -7.280 14.682 -2.743 1.0 98.74 124 B 1 +ATOM 3745 C CA . MET B ? 124 ? -8.535 14.594 -3.492 1.0 98.7 124 B 1 +ATOM 3746 C C . MET B ? 124 ? -8.545 15.609 -4.646 1.0 98.6 124 B 1 +ATOM 3747 O O . MET B ? 124 ? -9.075 15.310 -5.710 1.0 98.38 124 B 1 +ATOM 3748 C CB . MET B ? 124 ? -9.736 14.754 -2.553 1.0 98.72 124 B 1 +ATOM 3749 C CG . MET B ? 124 ? -9.696 13.741 -1.396 1.0 98.27 124 B 1 +ATOM 3750 S SD . MET B ? 124 ? -11.157 13.691 -0.322 1.0 98.01 124 B 1 +ATOM 3751 C CE . MET B ? 124 ? -12.261 12.696 -1.348 1.0 94.75 124 B 1 +ATOM 3752 N N . SER B ? 125 ? -7.883 16.749 -4.488 1.0 98.63 125 B 1 +ATOM 3753 C CA . SER B ? 125 ? -7.701 17.754 -5.549 1.0 98.42 125 B 1 +ATOM 3754 C C . SER B ? 125 ? -6.933 17.228 -6.767 1.0 98.26 125 B 1 +ATOM 3755 O O . SER B ? 125 ? -7.234 17.618 -7.894 1.0 97.81 125 B 1 +ATOM 3756 C CB . SER B ? 125 ? -6.942 18.964 -4.999 1.0 98.15 125 B 1 +ATOM 3757 O OG . SER B ? 125 ? -7.682 19.592 -3.972 1.0 97.27 125 B 1 +ATOM 3758 N N . CYS B ? 126 ? -5.966 16.341 -6.556 1.0 98.49 126 B 1 +ATOM 3759 C CA . CYS B ? 126 ? -5.142 15.769 -7.622 1.0 98.37 126 B 1 +ATOM 3760 C C . CYS B ? 126 ? -5.721 14.487 -8.241 1.0 98.4 126 B 1 +ATOM 3761 O O . CYS B ? 126 ? -5.139 13.971 -9.196 1.0 98.03 126 B 1 +ATOM 3762 C CB . CYS B ? 126 ? -3.716 15.552 -7.106 1.0 98.11 126 B 1 +ATOM 3763 S SG . CYS B ? 126 ? -2.867 17.145 -6.843 1.0 97.23 126 B 1 +ATOM 3764 N N . VAL B ? 127 ? -6.849 13.961 -7.751 1.0 98.15 127 B 1 +ATOM 3765 C CA . VAL B ? 127 ? -7.507 12.799 -8.368 1.0 98.16 127 B 1 +ATOM 3766 C C . VAL B ? 127 ? -8.033 13.194 -9.750 1.0 97.95 127 B 1 +ATOM 3767 O O . VAL B ? 127 ? -8.806 14.149 -9.854 1.0 97.94 127 B 1 +ATOM 3768 C CB . VAL B ? 127 ? -8.641 12.238 -7.488 1.0 98.25 127 B 1 +ATOM 3769 C CG1 . VAL B ? 127 ? -9.387 11.095 -8.189 1.0 97.52 127 B 1 +ATOM 3770 C CG2 . VAL B ? 127 ? -8.091 11.684 -6.170 1.0 96.87 127 B 1 +ATOM 3771 N N . PRO B ? 128 ? -7.653 12.474 -10.816 1.0 98.09 128 B 1 +ATOM 3772 C CA . PRO B ? 128 ? -8.053 12.812 -12.175 1.0 97.99 128 B 1 +ATOM 3773 C C . PRO B ? 128 ? -9.478 12.345 -12.508 1.0 98.05 128 B 1 +ATOM 3774 O O . PRO B ? 128 ? -10.113 11.584 -11.774 1.0 98.15 128 B 1 +ATOM 3775 C CB . PRO B ? 128 ? -6.998 12.142 -13.055 1.0 97.78 128 B 1 +ATOM 3776 C CG . PRO B ? 128 ? -6.682 10.862 -12.283 1.0 97.47 128 B 1 +ATOM 3777 C CD . PRO B ? 128 ? -6.749 11.325 -10.832 1.0 98.13 128 B 1 +ATOM 3778 N N . PHE B ? 129 ? -9.960 12.771 -13.668 1.0 97.7 129 B 1 +ATOM 3779 C CA . PHE B ? 129 ? -11.042 12.091 -14.371 1.0 97.55 129 B 1 +ATOM 3780 C C . PHE B ? 129 ? -10.486 10.912 -15.173 1.0 97.76 129 B 1 +ATOM 3781 O O . PHE B ? 129 ? -9.325 10.925 -15.586 1.0 97.58 129 B 1 +ATOM 3782 C CB . PHE B ? 129 ? -11.787 13.072 -15.275 1.0 97.06 129 B 1 +ATOM 3783 C CG . PHE B ? 129 ? -12.403 14.239 -14.543 1.0 96.79 129 B 1 +ATOM 3784 C CD1 . PHE B ? 129 ? -13.613 14.074 -13.844 1.0 92.81 129 B 1 +ATOM 3785 C CD2 . PHE B ? 129 ? -11.766 15.494 -14.538 1.0 92.41 129 B 1 +ATOM 3786 C CE1 . PHE B ? 129 ? -14.183 15.156 -13.148 1.0 90.48 129 B 1 +ATOM 3787 C CE2 . PHE B ? 129 ? -12.331 16.577 -13.841 1.0 90.44 129 B 1 +ATOM 3788 C CZ . PHE B ? 129 ? -13.542 16.408 -13.148 1.0 93.1 129 B 1 +ATOM 3789 N N . TYR B ? 130 ? -11.330 9.917 -15.429 1.0 97.94 130 B 1 +ATOM 3790 C CA . TYR B ? 130 ? -10.959 8.704 -16.152 1.0 97.82 130 B 1 +ATOM 3791 C C . TYR B ? 130 ? -11.669 8.597 -17.496 1.0 97.45 130 B 1 +ATOM 3792 O O . TYR B ? 130 ? -12.878 8.805 -17.593 1.0 96.97 130 B 1 +ATOM 3793 C CB . TYR B ? 130 ? -11.257 7.463 -15.301 1.0 97.81 130 B 1 +ATOM 3794 C CG . TYR B ? 130 ? -10.686 7.433 -13.894 1.0 98.27 130 B 1 +ATOM 3795 C CD1 . TYR B ? 130 ? -9.458 8.040 -13.576 1.0 97.04 130 B 1 +ATOM 3796 C CD2 . TYR B ? 130 ? -11.396 6.755 -12.885 1.0 96.58 130 B 1 +ATOM 3797 C CE1 . TYR B ? 130 ? -8.941 7.980 -12.269 1.0 96.78 130 B 1 +ATOM 3798 C CE2 . TYR B ? 130 ? -10.888 6.680 -11.576 1.0 96.51 130 B 1 +ATOM 3799 C CZ . TYR B ? 130 ? -9.659 7.299 -11.271 1.0 98.14 130 B 1 +ATOM 3800 O OH . TYR B ? 130 ? -9.156 7.228 -10.004 1.0 97.88 130 B 1 +ATOM 3801 N N . LEU B ? 131 ? -10.915 8.183 -18.512 1.0 97.18 131 B 1 +ATOM 3802 C CA . LEU B ? 131 ? -11.440 7.714 -19.787 1.0 96.81 131 B 1 +ATOM 3803 C C . LEU B ? 131 ? -11.095 6.225 -19.940 1.0 96.75 131 B 1 +ATOM 3804 O O . LEU B ? 131 ? -9.919 5.896 -20.135 1.0 96.67 131 B 1 +ATOM 3805 C CB . LEU B ? 131 ? -10.871 8.567 -20.931 1.0 96.31 131 B 1 +ATOM 3806 C CG . LEU B ? 131 ? -11.413 8.160 -22.318 1.0 94.93 131 B 1 +ATOM 3807 C CD1 . LEU B ? 131 ? -12.912 8.434 -22.452 1.0 92.04 131 B 1 +ATOM 3808 C CD2 . LEU B ? 131 ? -10.693 8.941 -23.408 1.0 91.12 131 B 1 +ATOM 3809 N N . PRO B ? 132 ? -12.079 5.313 -19.874 1.0 96.7 132 B 1 +ATOM 3810 C CA . PRO B ? 132 ? -11.842 3.894 -20.122 1.0 95.71 132 B 1 +ATOM 3811 C C . PRO B ? 132 ? -11.264 3.634 -21.515 1.0 95.65 132 B 1 +ATOM 3812 O O . PRO B ? 132 ? -11.540 4.359 -22.471 1.0 94.72 132 B 1 +ATOM 3813 C CB . PRO B ? 132 ? -13.197 3.204 -19.941 1.0 94.42 132 B 1 +ATOM 3814 C CG . PRO B ? 132 ? -13.949 4.151 -19.012 1.0 94.11 132 B 1 +ATOM 3815 C CD . PRO B ? 132 ? -13.452 5.525 -19.450 1.0 96.27 132 B 1 +ATOM 3816 N N . ARG B ? 133 ? -10.505 2.554 -21.656 1.0 96.19 133 B 1 +ATOM 3817 C CA . ARG B ? 133 ? -10.030 2.088 -22.966 1.0 95.29 133 B 1 +ATOM 3818 C C . ARG B ? 133 ? -11.192 1.529 -23.784 1.0 94.67 133 B 1 +ATOM 3819 O O . ARG B ? 133 ? -12.076 0.872 -23.256 1.0 91.93 133 B 1 +ATOM 3820 C CB . ARG B ? 133 ? -8.932 1.029 -22.805 1.0 93.72 133 B 1 +ATOM 3821 C CG . ARG B ? 133 ? -7.690 1.595 -22.112 1.0 90.72 133 B 1 +ATOM 3822 C CD . ARG B ? 133 ? -6.589 0.540 -22.021 1.0 89.16 133 B 1 +ATOM 3823 N NE . ARG B ? 133 ? -5.519 1.037 -21.165 1.0 93.91 133 B 1 +ATOM 3824 C CZ . ARG B ? 133 ? -4.461 1.763 -21.504 1.0 95.74 133 B 1 +ATOM 3825 N NH1 . ARG B ? 133 ? -4.096 1.999 -22.730 1.0 90.29 133 B 1 +ATOM 3826 N NH2 . ARG B ? 133 ? -3.756 2.289 -20.567 1.0 92.65 133 B 1 +ATOM 3827 N N . GLY B ? 134 ? -11.121 1.725 -25.087 1.0 93.84 134 B 1 +ATOM 3828 C CA . GLY B ? 134 ? -12.123 1.219 -26.023 1.0 92.84 134 B 1 +ATOM 3829 C C . GLY B ? 134 ? -12.458 2.239 -27.102 1.0 93.83 134 B 1 +ATOM 3830 O O . GLY B ? 134 ? -11.907 3.342 -27.129 1.0 91.05 134 B 1 +ATOM 3831 N N . GLU B ? 135 ? -13.365 1.855 -27.989 1.0 90.78 135 B 1 +ATOM 3832 C CA . GLU B ? 135 ? -13.937 2.799 -28.943 1.0 89.71 135 B 1 +ATOM 3833 C C . GLU B ? 135 ? -14.843 3.801 -28.234 1.0 90.36 135 B 1 +ATOM 3834 O O . GLU B ? 135 ? -15.655 3.447 -27.377 1.0 87.64 135 B 1 +ATOM 3835 C CB . GLU B ? 135 ? -14.712 2.078 -30.053 1.0 87.27 135 B 1 +ATOM 3836 C CG . GLU B ? 135 ? -13.782 1.526 -31.137 1.0 77.54 135 B 1 +ATOM 3837 C CD . GLU B ? 135 ? -14.544 0.979 -32.351 1.0 70.47 135 B 1 +ATOM 3838 O OE1 . GLU B ? 135 ? -13.950 0.984 -33.454 1.0 64.44 135 B 1 +ATOM 3839 O OE2 . GLU B ? 135 ? -15.709 0.559 -32.172 1.0 65.73 135 B 1 +ATOM 3840 N N . ILE B ? 136 ? -14.712 5.068 -28.629 1.0 88.84 136 B 1 +ATOM 3841 C CA . ILE B ? 136 ? -15.631 6.125 -28.212 1.0 89.13 136 B 1 +ATOM 3842 C C . ILE B ? 136 ? -16.764 6.173 -29.241 1.0 89.48 136 B 1 +ATOM 3843 O O . ILE B ? 136 ? -16.495 6.392 -30.427 1.0 87.42 136 B 1 +ATOM 3844 C CB . ILE B ? 136 ? -14.897 7.474 -28.061 1.0 88.66 136 B 1 +ATOM 3845 C CG1 . ILE B ? 136 ? -13.785 7.351 -26.992 1.0 87.13 136 B 1 +ATOM 3846 C CG2 . ILE B ? 136 ? -15.901 8.580 -27.687 1.0 87.31 136 B 1 +ATOM 3847 C CD1 . ILE B ? 136 ? -12.924 8.610 -26.835 1.0 82.89 136 B 1 +ATOM 3848 N N . PRO B ? 137 ? -18.020 5.974 -28.827 1.0 88.94 137 B 1 +ATOM 3849 C CA . PRO B ? 137 ? -19.144 5.989 -29.751 1.0 88.1 137 B 1 +ATOM 3850 C C . PRO B ? 137 ? -19.386 7.389 -30.322 1.0 88.96 137 B 1 +ATOM 3851 O O . PRO B ? 137 ? -18.951 8.406 -29.771 1.0 86.76 137 B 1 +ATOM 3852 C CB . PRO B ? 137 ? -20.334 5.467 -28.941 1.0 86.45 137 B 1 +ATOM 3853 C CG . PRO B ? 137 ? -19.997 5.884 -27.512 1.0 84.71 137 B 1 +ATOM 3854 C CD . PRO B ? 137 ? -18.476 5.740 -27.467 1.0 88.72 137 B 1 +ATOM 3855 N N . PHE B ? 138 ? -20.138 7.448 -31.414 1.0 89.88 138 B 1 +ATOM 3856 C CA . PHE B ? 138 ? -20.636 8.711 -31.946 1.0 85.91 138 B 1 +ATOM 3857 C C . PHE B ? 138 ? -21.399 9.498 -30.868 1.0 84.21 138 B 1 +ATOM 3858 O O . PHE B ? 138 ? -22.182 8.926 -30.109 1.0 82.19 138 B 1 +ATOM 3859 C CB . PHE B ? 138 ? -21.523 8.436 -33.167 1.0 86.14 138 B 1 +ATOM 3860 C CG . PHE B ? 138 ? -22.101 9.699 -33.775 1.0 85.57 138 B 1 +ATOM 3861 C CD1 . PHE B ? 138 ? -23.394 10.131 -33.421 1.0 82.16 138 B 1 +ATOM 3862 C CD2 . PHE B ? 138 ? -21.333 10.475 -34.664 1.0 85.2 138 B 1 +ATOM 3863 C CE1 . PHE B ? 138 ? -23.913 11.324 -33.956 1.0 81.54 138 B 1 +ATOM 3864 C CE2 . PHE B ? 138 ? -21.846 11.670 -35.202 1.0 84.7 138 B 1 +ATOM 3865 C CZ . PHE B ? 138 ? -23.136 12.093 -34.847 1.0 85.54 138 B 1 +ATOM 3866 N N . GLY B ? 139 ? -21.167 10.799 -30.810 1.0 87.6 139 B 1 +ATOM 3867 C CA . GLY B ? 139 ? -21.720 11.680 -29.774 1.0 84.34 139 B 1 +ATOM 3868 C C . GLY B ? 139 ? -20.818 11.842 -28.546 1.0 85.9 139 B 1 +ATOM 3869 O O . GLY B ? 139 ? -21.107 12.678 -27.692 1.0 82.42 139 B 1 +ATOM 3870 N N . GLY B ? 140 ? -19.723 11.102 -28.468 1.0 89.08 140 B 1 +ATOM 3871 C CA . GLY B ? 140 ? -18.756 11.193 -27.381 1.0 88.29 140 B 1 +ATOM 3872 C C . GLY B ? 140 ? -19.064 10.264 -26.207 1.0 88.8 140 B 1 +ATOM 3873 O O . GLY B ? 140 ? -19.912 9.374 -26.278 1.0 87.13 140 B 1 +ATOM 3874 N N . THR B ? 141 ? -18.331 10.467 -25.104 1.0 90.16 141 B 1 +ATOM 3875 C CA . THR B ? 141 ? -18.480 9.695 -23.866 1.0 90.81 141 B 1 +ATOM 3876 C C . THR B ? 141 ? -18.361 10.608 -22.649 1.0 91.73 141 B 1 +ATOM 3877 O O . THR B ? 141 ? -17.857 11.731 -22.744 1.0 90.57 141 B 1 +ATOM 3878 C CB . THR B ? 141 ? -17.464 8.541 -23.821 1.0 89.04 141 B 1 +ATOM 3879 O OG1 . THR B ? 141 ? -17.808 7.665 -22.772 1.0 84.58 141 B 1 +ATOM 3880 C CG2 . THR B ? 141 ? -16.019 8.988 -23.597 1.0 84.34 141 B 1 +ATOM 3881 N N . LYS B ? 142 ? -18.821 10.136 -21.489 1.0 93.86 142 B 1 +ATOM 3882 C CA . LYS B ? 142 ? -18.591 10.826 -20.219 1.0 94.36 142 B 1 +ATOM 3883 C C . LYS B ? 142 ? -17.262 10.388 -19.613 1.0 95.51 142 B 1 +ATOM 3884 O O . LYS B ? 142 ? -16.961 9.197 -19.562 1.0 94.19 142 B 1 +ATOM 3885 C CB . LYS B ? 142 ? -19.753 10.594 -19.244 1.0 91.15 142 B 1 +ATOM 3886 C CG . LYS B ? 142 ? -20.960 11.482 -19.584 1.0 76.92 142 B 1 +ATOM 3887 C CD . LYS B ? 142 ? -22.053 11.328 -18.520 1.0 75.0 142 B 1 +ATOM 3888 C CE . LYS B ? 142 ? -23.191 12.316 -18.781 1.0 63.28 142 B 1 +ATOM 3889 N NZ . LYS B ? 142 ? -24.252 12.210 -17.748 1.0 56.02 142 B 1 +ATOM 3890 N N . LEU B ? 143 ? -16.514 11.362 -19.110 1.0 95.98 143 B 1 +ATOM 3891 C CA . LEU B ? 143 ? -15.404 11.102 -18.201 1.0 96.48 143 B 1 +ATOM 3892 C C . LEU B ? 143 ? -15.954 10.711 -16.827 1.0 97.2 143 B 1 +ATOM 3893 O O . LEU B ? 143 ? -16.973 11.234 -16.377 1.0 96.67 143 B 1 +ATOM 3894 C CB . LEU B ? 143 ? -14.499 12.337 -18.112 1.0 95.26 143 B 1 +ATOM 3895 C CG . LEU B ? 143 ? -13.767 12.681 -19.420 1.0 92.28 143 B 1 +ATOM 3896 C CD1 . LEU B ? 143 ? -13.030 14.005 -19.251 1.0 89.34 143 B 1 +ATOM 3897 C CD2 . LEU B ? 143 ? -12.743 11.616 -19.810 1.0 88.56 143 B 1 +ATOM 3898 N N . ILE B ? 144 ? -15.261 9.803 -16.163 1.0 96.63 144 B 1 +ATOM 3899 C CA . ILE B ? 144 ? -15.604 9.309 -14.829 1.0 97.04 144 B 1 +ATOM 3900 C C . ILE B ? 144 ? -14.779 10.094 -13.809 1.0 97.48 144 B 1 +ATOM 3901 O O . ILE B ? 144 ? -13.557 10.140 -13.910 1.0 97.46 144 B 1 +ATOM 3902 C CB . ILE B ? 144 ? -15.353 7.788 -14.749 1.0 96.9 144 B 1 +ATOM 3903 C CG1 . ILE B ? 144 ? -16.223 7.025 -15.782 1.0 95.96 144 B 1 +ATOM 3904 C CG2 . ILE B ? 144 ? -15.626 7.265 -13.327 1.0 96.19 144 B 1 +ATOM 3905 C CD1 . ILE B ? 144 ? -15.787 5.572 -15.996 1.0 92.99 144 B 1 +ATOM 3906 N N . ASP B ? 145 ? -15.430 10.700 -12.811 1.0 96.21 145 B 1 +ATOM 3907 C CA . ASP B ? 145 ? -14.717 11.355 -11.713 1.0 96.88 145 B 1 +ATOM 3908 C C . ASP B ? 145 ? -14.136 10.295 -10.765 1.0 97.07 145 B 1 +ATOM 3909 O O . ASP B ? 145 ? -14.877 9.530 -10.144 1.0 97.22 145 B 1 +ATOM 3910 C CB . ASP B ? 145 ? -15.645 12.350 -10.992 1.0 96.82 145 B 1 +ATOM 3911 C CG . ASP B ? 145 ? -14.890 13.234 -9.990 1.0 97.15 145 B 1 +ATOM 3912 O OD1 . ASP B ? 145 ? -13.833 12.821 -9.470 1.0 95.43 145 B 1 +ATOM 3913 O OD2 . ASP B ? 145 ? -15.307 14.384 -9.744 1.0 94.91 145 B 1 +ATOM 3914 N N . GLY B ? 146 ? -12.812 10.257 -10.641 1.0 97.53 146 B 1 +ATOM 3915 C CA . GLY B ? 146 ? -12.113 9.301 -9.791 1.0 97.52 146 B 1 +ATOM 3916 C C . GLY B ? 146 ? -12.426 9.431 -8.301 1.0 97.85 146 B 1 +ATOM 3917 O O . GLY B ? 146 ? -12.365 8.436 -7.581 1.0 97.88 146 B 1 +ATOM 3918 N N . ILE B ? 147 ? -12.818 10.614 -7.821 1.0 98.11 147 B 1 +ATOM 3919 C CA . ILE B ? 147 ? -13.157 10.830 -6.403 1.0 98.05 147 B 1 +ATOM 3920 C C . ILE B ? 147 ? -14.375 9.991 -5.989 1.0 97.98 147 B 1 +ATOM 3921 O O . ILE B ? 147 ? -14.227 9.139 -5.115 1.0 98.0 147 B 1 +ATOM 3922 C CB . ILE B ? 147 ? -13.338 12.323 -6.057 1.0 98.09 147 B 1 +ATOM 3923 C CG1 . ILE B ? 147 ? -12.038 13.120 -6.297 1.0 97.45 147 B 1 +ATOM 3924 C CG2 . ILE B ? 147 ? -13.794 12.479 -4.590 1.0 97.43 147 B 1 +ATOM 3925 C CD1 . ILE B ? 147 ? -12.233 14.637 -6.161 1.0 96.5 147 B 1 +ATOM 3926 N N . PRO B ? 148 ? -15.575 10.180 -6.567 1.0 98.28 148 B 1 +ATOM 3927 C CA . PRO B ? 148 ? -16.704 9.320 -6.224 1.0 98.01 148 B 1 +ATOM 3928 C C . PRO B ? 148 ? -16.460 7.872 -6.655 1.0 97.91 148 B 1 +ATOM 3929 O O . PRO B ? 148 ? -16.741 6.971 -5.876 1.0 97.68 148 B 1 +ATOM 3930 C CB . PRO B ? 148 ? -17.926 9.935 -6.913 1.0 97.49 148 B 1 +ATOM 3931 C CG . PRO B ? 148 ? -17.322 10.730 -8.072 1.0 95.63 148 B 1 +ATOM 3932 C CD . PRO B ? 148 ? -15.998 11.207 -7.498 1.0 97.81 148 B 1 +ATOM 3933 N N . ARG B ? 149 ? -15.896 7.634 -7.839 1.0 98.11 149 B 1 +ATOM 3934 C CA . ARG B ? 149 ? -15.749 6.282 -8.404 1.0 97.94 149 B 1 +ATOM 3935 C C . ARG B ? 149 ? -14.934 5.352 -7.505 1.0 97.94 149 B 1 +ATOM 3936 O O . ARG B ? 149 ? -15.403 4.263 -7.177 1.0 97.56 149 B 1 +ATOM 3937 C CB . ARG B ? 149 ? -15.144 6.388 -9.814 1.0 97.78 149 B 1 +ATOM 3938 C CG . ARG B ? 149 ? -14.850 5.025 -10.480 1.0 97.03 149 B 1 +ATOM 3939 C CD . ARG B ? 149 ? -16.098 4.136 -10.594 1.0 95.7 149 B 1 +ATOM 3940 N NE . ARG B ? 149 ? -15.781 2.872 -11.261 1.0 95.26 149 B 1 +ATOM 3941 C CZ . ARG B ? 149 ? -16.454 1.745 -11.178 1.0 94.95 149 B 1 +ATOM 3942 N NH1 . ARG B ? 149 ? -17.553 1.651 -10.484 1.0 90.92 149 B 1 +ATOM 3943 N NH2 . ARG B ? 149 ? -16.016 0.686 -11.797 1.0 91.59 149 B 1 +ATOM 3944 N N . ASP B ? 150 ? -13.736 5.766 -7.116 1.0 98.56 150 B 1 +ATOM 3945 C CA . ASP B ? 150 ? -12.781 4.934 -6.372 1.0 98.52 150 B 1 +ATOM 3946 C C . ASP B ? 150 ? -12.702 5.292 -4.874 1.0 98.48 150 B 1 +ATOM 3947 O O . ASP B ? 150 ? -12.128 4.532 -4.087 1.0 97.96 150 B 1 +ATOM 3948 C CB . ASP B ? 150 ? -11.397 5.029 -7.039 1.0 98.48 150 B 1 +ATOM 3949 C CG . ASP B ? 150 ? -11.322 4.393 -8.437 1.0 98.6 150 B 1 +ATOM 3950 O OD1 . ASP B ? 150 ? -12.108 3.470 -8.742 1.0 97.43 150 B 1 +ATOM 3951 O OD2 . ASP B ? 150 ? -10.431 4.797 -9.215 1.0 97.41 150 B 1 +ATOM 3952 N N . GLY B ? 151 ? -13.302 6.410 -4.466 1.0 98.58 151 B 1 +ATOM 3953 C CA . GLY B ? 151 ? -13.260 6.900 -3.093 1.0 98.48 151 B 1 +ATOM 3954 C C . GLY B ? 151 ? -14.590 6.865 -2.337 1.0 98.55 151 B 1 +ATOM 3955 O O . GLY B ? 151 ? -14.657 6.320 -1.235 1.0 97.95 151 B 1 +ATOM 3956 N N . LEU B ? 152 ? -15.649 7.454 -2.908 1.0 98.56 152 B 1 +ATOM 3957 C CA . LEU B ? 152 ? -16.841 7.853 -2.145 1.0 98.57 152 B 1 +ATOM 3958 C C . LEU B ? 152 ? -18.146 7.134 -2.521 1.0 98.51 152 B 1 +ATOM 3959 O O . LEU B ? 152 ? -19.149 7.321 -1.825 1.0 97.91 152 B 1 +ATOM 3960 C CB . LEU B ? 152 ? -17.026 9.378 -2.252 1.0 98.44 152 B 1 +ATOM 3961 C CG . LEU B ? 152 ? -15.821 10.239 -1.823 1.0 97.96 152 B 1 +ATOM 3962 C CD1 . LEU B ? 152 ? -16.223 11.710 -1.897 1.0 97.22 152 B 1 +ATOM 3963 C CD2 . LEU B ? 152 ? -15.355 9.946 -0.398 1.0 96.95 152 B 1 +ATOM 3964 N N . ASN B ? 153 ? -18.188 6.352 -3.599 1.0 98.41 153 B 1 +ATOM 3965 C CA . ASN B ? 153 ? -19.379 5.616 -4.026 1.0 98.27 153 B 1 +ATOM 3966 C C . ASN B ? 153 ? -19.367 4.194 -3.465 1.0 98.24 153 B 1 +ATOM 3967 O O . ASN B ? 153 ? -18.421 3.444 -3.702 1.0 97.59 153 B 1 +ATOM 3968 C CB . ASN B ? 153 ? -19.492 5.631 -5.558 1.0 97.82 153 B 1 +ATOM 3969 C CG . ASN B ? 153 ? -20.903 5.291 -6.022 1.0 95.19 153 B 1 +ATOM 3970 O OD1 . ASN B ? 153 ? -21.843 6.000 -5.722 1.0 85.38 153 B 1 +ATOM 3971 N ND2 . ASN B ? 153 ? -21.086 4.229 -6.771 1.0 85.04 153 B 1 +ATOM 3972 N N . ASP B ? 154 ? -20.424 3.815 -2.749 1.0 98.21 154 B 1 +ATOM 3973 C CA . ASP B ? 154 ? -20.682 2.426 -2.381 1.0 98.08 154 B 1 +ATOM 3974 C C . ASP B ? 154 ? -21.063 1.648 -3.645 1.0 98.07 154 B 1 +ATOM 3975 O O . ASP B ? 154 ? -22.128 1.859 -4.224 1.0 97.25 154 B 1 +ATOM 3976 C CB . ASP B ? 154 ? -21.788 2.365 -1.319 1.0 97.52 154 B 1 +ATOM 3977 C CG . ASP B ? 154 ? -22.101 0.927 -0.902 1.0 96.62 154 B 1 +ATOM 3978 O OD1 . ASP B ? 154 ? -22.716 0.189 -1.700 1.0 91.69 154 B 1 +ATOM 3979 O OD2 . ASP B ? 154 ? -21.734 0.543 0.225 1.0 91.17 154 B 1 +ATOM 3980 N N . VAL B ? 155 ? -20.196 0.748 -4.078 1.0 97.9 155 B 1 +ATOM 3981 C CA . VAL B ? 155 ? -20.373 -0.003 -5.332 1.0 97.7 155 B 1 +ATOM 3982 C C . VAL B ? 155 ? -21.424 -1.110 -5.242 1.0 97.78 155 B 1 +ATOM 3983 O O . VAL B ? 155 ? -21.805 -1.671 -6.262 1.0 96.23 155 B 1 +ATOM 3984 C CB . VAL B ? 155 ? -19.038 -0.599 -5.820 1.0 96.65 155 B 1 +ATOM 3985 C CG1 . VAL B ? 155 ? -17.975 0.484 -6.024 1.0 91.95 155 B 1 +ATOM 3986 C CG2 . VAL B ? 155 ? -18.486 -1.662 -4.851 1.0 92.17 155 B 1 +ATOM 3987 N N . TYR B ? 156 ? -21.878 -1.456 -4.036 1.0 97.39 156 B 1 +ATOM 3988 C CA . TYR B ? 156 ? -22.844 -2.535 -3.813 1.0 97.07 156 B 1 +ATOM 3989 C C . TYR B ? 156 ? -24.281 -2.030 -3.928 1.0 97.19 156 B 1 +ATOM 3990 O O . TYR B ? 156 ? -25.151 -2.742 -4.417 1.0 95.24 156 B 1 +ATOM 3991 C CB . TYR B ? 156 ? -22.601 -3.169 -2.438 1.0 96.64 156 B 1 +ATOM 3992 C CG . TYR B ? 156 ? -21.150 -3.505 -2.157 1.0 97.16 156 B 1 +ATOM 3993 C CD1 . TYR B ? 156 ? -20.566 -4.677 -2.684 1.0 95.44 156 B 1 +ATOM 3994 C CD2 . TYR B ? 156 ? -20.354 -2.606 -1.415 1.0 95.81 156 B 1 +ATOM 3995 C CE1 . TYR B ? 156 ? -19.203 -4.946 -2.473 1.0 95.0 156 B 1 +ATOM 3996 C CE2 . TYR B ? 156 ? -18.990 -2.864 -1.200 1.0 94.86 156 B 1 +ATOM 3997 C CZ . TYR B ? 156 ? -18.415 -4.034 -1.731 1.0 96.6 156 B 1 +ATOM 3998 O OH . TYR B ? 156 ? -17.082 -4.273 -1.531 1.0 95.72 156 B 1 +ATOM 3999 N N . ASN B ? 157 ? -24.517 -0.797 -3.481 1.0 97.55 157 B 1 +ATOM 4000 C CA . ASN B ? 157 ? -25.824 -0.134 -3.532 1.0 97.4 157 B 1 +ATOM 4001 C C . ASN B ? 157 ? -25.870 1.003 -4.569 1.0 97.83 157 B 1 +ATOM 4002 O O . ASN B ? 157 ? -26.925 1.589 -4.777 1.0 96.63 157 B 1 +ATOM 4003 C CB . ASN B ? 157 ? -26.156 0.384 -2.125 1.0 96.84 157 B 1 +ATOM 4004 C CG . ASN B ? 157 ? -26.128 -0.715 -1.078 1.0 95.36 157 B 1 +ATOM 4005 O OD1 . ASN B ? 157 ? -27.077 -1.464 -0.907 1.0 87.8 157 B 1 +ATOM 4006 N ND2 . ASN B ? 157 ? -25.039 -0.840 -0.349 1.0 87.05 157 B 1 +ATOM 4007 N N . ASP B ? 158 ? -24.739 1.316 -5.183 1.0 97.64 158 B 1 +ATOM 4008 C CA . ASP B ? 158 ? -24.530 2.413 -6.137 1.0 97.92 158 B 1 +ATOM 4009 C C . ASP B ? 158 ? -25.008 3.782 -5.621 1.0 98.2 158 B 1 +ATOM 4010 O O . ASP B ? 158 ? -25.701 4.544 -6.291 1.0 97.63 158 B 1 +ATOM 4011 C CB . ASP B ? 158 ? -25.037 2.030 -7.538 1.0 97.49 158 B 1 +ATOM 4012 C CG . ASP B ? 158 ? -24.432 2.918 -8.632 1.0 96.36 158 B 1 +ATOM 4013 O OD1 . ASP B ? 158 ? -23.279 3.389 -8.440 1.0 93.68 158 B 1 +ATOM 4014 O OD2 . ASP B ? 158 ? -25.087 3.097 -9.679 1.0 92.81 158 B 1 +ATOM 4015 N N . ILE B ? 159 ? -24.627 4.092 -4.384 1.0 98.38 159 B 1 +ATOM 4016 C CA . ILE B ? 159 ? -24.923 5.362 -3.715 1.0 98.46 159 B 1 +ATOM 4017 C C . ILE B ? 159 ? -23.667 5.923 -3.042 1.0 98.59 159 B 1 +ATOM 4018 O O . ILE B ? 159 ? -22.773 5.187 -2.627 1.0 98.32 159 B 1 +ATOM 4019 C CB . ILE B ? 159 ? -26.092 5.225 -2.709 1.0 98.22 159 B 1 +ATOM 4020 C CG1 . ILE B ? 159 ? -25.797 4.199 -1.596 1.0 97.4 159 B 1 +ATOM 4021 C CG2 . ILE B ? 159 ? -27.404 4.904 -3.452 1.0 96.74 159 B 1 +ATOM 4022 C CD1 . ILE B ? 159 ? -26.893 4.082 -0.526 1.0 96.31 159 B 1 +ATOM 4023 N N . LEU B ? 160 ? -23.606 7.243 -2.884 1.0 98.44 160 B 1 +ATOM 4024 C CA . LEU B ? 160 ? -22.489 7.894 -2.197 1.0 98.54 160 B 1 +ATOM 4025 C C . LEU B ? 160 ? -22.488 7.579 -0.692 1.0 98.62 160 B 1 +ATOM 4026 O O . LEU B ? 160 ? -23.531 7.335 -0.088 1.0 98.48 160 B 1 +ATOM 4027 C CB . LEU B ? 160 ? -22.538 9.408 -2.455 1.0 98.48 160 B 1 +ATOM 4028 C CG . LEU B ? 160 ? -22.270 9.820 -3.917 1.0 98.09 160 B 1 +ATOM 4029 C CD1 . LEU B ? 160 ? -22.537 11.314 -4.087 1.0 97.23 160 B 1 +ATOM 4030 C CD2 . LEU B ? 160 ? -20.819 9.554 -4.333 1.0 97.06 160 B 1 +ATOM 4031 N N . MET B ? 161 ? -21.320 7.689 -0.062 1.0 98.66 161 B 1 +ATOM 4032 C CA . MET B ? 161 ? -21.158 7.515 1.389 1.0 98.67 161 B 1 +ATOM 4033 C C . MET B ? 161 ? -22.149 8.362 2.212 1.0 98.76 161 B 1 +ATOM 4034 O O . MET B ? 161 ? -22.680 7.891 3.213 1.0 98.73 161 B 1 +ATOM 4035 C CB . MET B ? 161 ? -19.722 7.887 1.796 1.0 98.64 161 B 1 +ATOM 4036 C CG . MET B ? 161 ? -18.622 6.990 1.212 1.0 97.95 161 B 1 +ATOM 4037 S SD . MET B ? 161 ? -18.604 5.265 1.776 1.0 97.7 161 B 1 +ATOM 4038 C CE . MET B ? 161 ? -19.672 4.482 0.542 1.0 94.75 161 B 1 +ATOM 4039 N N . GLY B ? 162 ? -22.443 9.577 1.764 1.0 98.73 162 B 1 +ATOM 4040 C CA . GLY B ? 162 ? -23.423 10.442 2.429 1.0 98.79 162 B 1 +ATOM 4041 C C . GLY B ? 162 ? -24.852 9.890 2.402 1.0 98.84 162 B 1 +ATOM 4042 O O . GLY B ? 162 ? -25.572 10.034 3.385 1.0 98.76 162 B 1 +ATOM 4043 N N . ALA B ? 163 ? -25.253 9.198 1.330 1.0 98.78 163 B 1 +ATOM 4044 C CA . ALA B ? 163 ? -26.552 8.523 1.264 1.0 98.77 163 B 1 +ATOM 4045 C C . ALA B ? 163 ? -26.601 7.283 2.179 1.0 98.79 163 B 1 +ATOM 4046 O O . ALA B ? 163 ? -27.629 7.003 2.793 1.0 98.61 163 B 1 +ATOM 4047 C CB . ALA B ? 163 ? -26.845 8.171 -0.200 1.0 98.7 163 B 1 +ATOM 4048 N N . CYS B ? 164 ? -25.479 6.583 2.346 1.0 98.79 164 B 1 +ATOM 4049 C CA . CYS B ? 164 ? -25.350 5.533 3.360 1.0 98.77 164 B 1 +ATOM 4050 C C . CYS B ? 164 ? -25.503 6.109 4.782 1.0 98.81 164 B 1 +ATOM 4051 O O . CYS B ? 164 ? -26.190 5.523 5.617 1.0 98.72 164 B 1 +ATOM 4052 C CB . CYS B ? 164 ? -23.993 4.827 3.218 1.0 98.71 164 B 1 +ATOM 4053 S SG . CYS B ? 164 ? -23.728 4.141 1.558 1.0 98.41 164 B 1 +ATOM 4054 N N . ALA B ? 165 ? -24.909 7.282 5.046 1.0 98.81 165 B 1 +ATOM 4055 C CA . ALA B ? 165 ? -25.051 7.972 6.329 1.0 98.83 165 B 1 +ATOM 4056 C C . ALA B ? 165 ? -26.499 8.433 6.588 1.0 98.84 165 B 1 +ATOM 4057 O O . ALA B ? 165 ? -26.989 8.273 7.705 1.0 98.77 165 B 1 +ATOM 4058 C CB . ALA B ? 165 ? -24.061 9.139 6.375 1.0 98.79 165 B 1 +ATOM 4059 N N . ASP B ? 166 ? -27.212 8.919 5.563 1.0 98.82 166 B 1 +ATOM 4060 C CA . ASP B ? 166 ? -28.646 9.244 5.648 1.0 98.8 166 B 1 +ATOM 4061 C C . ASP B ? 166 ? -29.483 8.026 6.062 1.0 98.77 166 B 1 +ATOM 4062 O O . ASP B ? 166 ? -30.345 8.128 6.937 1.0 98.59 166 B 1 +ATOM 4063 C CB . ASP B ? 166 ? -29.159 9.762 4.291 1.0 98.7 166 B 1 +ATOM 4064 C CG . ASP B ? 166 ? -28.897 11.244 4.020 1.0 98.54 166 B 1 +ATOM 4065 O OD1 . ASP B ? 166 ? -28.805 12.030 4.989 1.0 96.75 166 B 1 +ATOM 4066 O OD2 . ASP B ? 166 ? -28.907 11.627 2.829 1.0 96.99 166 B 1 +ATOM 4067 N N . LYS B ? 167 ? -29.201 6.850 5.475 1.0 98.72 167 B 1 +ATOM 4068 C CA . LYS B ? 167 ? -29.876 5.594 5.830 1.0 98.61 167 B 1 +ATOM 4069 C C . LYS B ? 167 ? -29.636 5.231 7.299 1.0 98.68 167 B 1 +ATOM 4070 O O . LYS B ? 167 ? -30.592 4.920 8.007 1.0 98.39 167 B 1 +ATOM 4071 C CB . LYS B ? 167 ? -29.437 4.485 4.856 1.0 98.22 167 B 1 +ATOM 4072 C CG . LYS B ? 167 ? -30.070 3.102 5.133 1.0 96.31 167 B 1 +ATOM 4073 C CD . LYS B ? 167 ? -29.148 2.193 5.965 1.0 92.55 167 B 1 +ATOM 4074 C CE . LYS B ? 167 ? -29.762 0.808 6.190 1.0 89.95 167 B 1 +ATOM 4075 N NZ . LYS B ? 167 ? -28.818 -0.113 6.854 1.0 84.89 167 B 1 +ATOM 4076 N N . VAL B ? 168 ? -28.399 5.300 7.765 1.0 98.72 168 B 1 +ATOM 4077 C CA . VAL B ? 168 ? -28.046 5.024 9.170 1.0 98.74 168 B 1 +ATOM 4078 C C . VAL B ? 168 ? -28.747 6.011 10.106 1.0 98.77 168 B 1 +ATOM 4079 O O . VAL B ? 168 ? -29.375 5.591 11.075 1.0 98.66 168 B 1 +ATOM 4080 C CB . VAL B ? 168 ? -26.516 5.038 9.368 1.0 98.61 168 B 1 +ATOM 4081 C CG1 . VAL B ? 168 ? -26.102 4.970 10.842 1.0 97.82 168 B 1 +ATOM 4082 C CG2 . VAL B ? 168 ? -25.871 3.833 8.663 1.0 97.81 168 B 1 +ATOM 4083 N N . ALA B ? 169 ? -28.718 7.311 9.787 1.0 98.82 169 B 1 +ATOM 4084 C CA . ALA B ? 169 ? -29.383 8.337 10.588 1.0 98.82 169 B 1 +ATOM 4085 C C . ALA B ? 169 ? -30.891 8.078 10.721 1.0 98.77 169 B 1 +ATOM 4086 O O . ALA B ? 169 ? -31.434 8.136 11.824 1.0 98.59 169 B 1 +ATOM 4087 C CB . ALA B ? 169 ? -29.110 9.703 9.951 1.0 98.76 169 B 1 +ATOM 4088 N N . LYS B ? 170 ? -31.552 7.722 9.620 1.0 98.73 170 B 1 +ATOM 4089 C CA . LYS B ? 170 ? -32.990 7.416 9.599 1.0 98.63 170 B 1 +ATOM 4090 C C . LYS B ? 170 ? -33.310 6.139 10.380 1.0 98.58 170 B 1 +ATOM 4091 O O . LYS B ? 170 ? -34.251 6.122 11.165 1.0 98.12 170 B 1 +ATOM 4092 C CB . LYS B ? 170 ? -33.465 7.361 8.132 1.0 98.29 170 B 1 +ATOM 4093 C CG . LYS B ? 170 ? -34.994 7.507 7.974 1.0 93.63 170 B 1 +ATOM 4094 C CD . LYS B ? 170 ? -35.377 7.646 6.485 1.0 88.66 170 B 1 +ATOM 4095 C CE . LYS B ? 170 ? -36.868 7.995 6.299 1.0 77.6 170 B 1 +ATOM 4096 N NZ . LYS B ? 170 ? -37.216 8.345 4.884 1.0 67.39 170 B 1 +ATOM 4097 N N . GLN B ? 171 ? -32.511 5.093 10.202 1.0 98.58 171 B 1 +ATOM 4098 C CA . GLN B ? 171 ? -32.719 3.802 10.868 1.0 98.45 171 B 1 +ATOM 4099 C C . GLN B ? 171 ? -32.548 3.881 12.389 1.0 98.44 171 B 1 +ATOM 4100 O O . GLN B ? 171 ? -33.299 3.242 13.127 1.0 97.87 171 B 1 +ATOM 4101 C CB . GLN B ? 171 ? -31.764 2.771 10.252 1.0 98.18 171 B 1 +ATOM 4102 C CG . GLN B ? 171 ? -31.933 1.372 10.876 1.0 96.24 171 B 1 +ATOM 4103 C CD . GLN B ? 171 ? -31.061 0.302 10.212 1.0 95.3 171 B 1 +ATOM 4104 O OE1 . GLN B ? 171 ? -30.454 0.485 9.173 1.0 89.66 171 B 1 +ATOM 4105 N NE2 . GLN B ? 171 ? -30.979 -0.874 10.790 1.0 87.85 171 B 1 +ATOM 4106 N N . PHE B ? 172 ? -31.583 4.657 12.867 1.0 98.56 172 B 1 +ATOM 4107 C CA . PHE B ? 172 ? -31.235 4.757 14.289 1.0 98.44 172 B 1 +ATOM 4108 C C . PHE B ? 172 ? -31.695 6.066 14.946 1.0 98.41 172 B 1 +ATOM 4109 O O . PHE B ? 172 ? -31.243 6.399 16.044 1.0 97.64 172 B 1 +ATOM 4110 C CB . PHE B ? 172 ? -29.740 4.483 14.461 1.0 98.27 172 B 1 +ATOM 4111 C CG . PHE B ? 172 ? -29.323 3.091 14.031 1.0 98.03 172 B 1 +ATOM 4112 C CD1 . PHE B ? 172 ? -29.648 1.978 14.833 1.0 96.38 172 B 1 +ATOM 4113 C CD2 . PHE B ? 172 ? -28.631 2.892 12.825 1.0 96.5 172 B 1 +ATOM 4114 C CE1 . PHE B ? 172 ? -29.273 0.685 14.437 1.0 95.33 172 B 1 +ATOM 4115 C CE2 . PHE B ? 172 ? -28.256 1.599 12.421 1.0 95.38 172 B 1 +ATOM 4116 C CZ . PHE B ? 172 ? -28.576 0.492 13.228 1.0 95.83 172 B 1 +ATOM 4117 N N . ALA B ? 173 ? -32.602 6.806 14.291 1.0 98.44 173 B 1 +ATOM 4118 C CA . ALA B ? 173 ? -33.193 8.049 14.789 1.0 98.35 173 B 1 +ATOM 4119 C C . ALA B ? 173 ? -32.163 9.109 15.241 1.0 98.47 173 B 1 +ATOM 4120 O O . ALA B ? 173 ? -32.359 9.798 16.243 1.0 97.66 173 B 1 +ATOM 4121 C CB . ALA B ? 173 ? -34.268 7.708 15.830 1.0 97.83 173 B 1 +ATOM 4122 N N . ILE B ? 174 ? -31.071 9.258 14.502 1.0 98.7 174 B 1 +ATOM 4123 C CA . ILE B ? 174 ? -30.107 10.354 14.685 1.0 98.77 174 B 1 +ATOM 4124 C C . ILE B ? 174 ? -30.628 11.568 13.904 1.0 98.8 174 B 1 +ATOM 4125 O O . ILE B ? 174 ? -30.482 11.656 12.685 1.0 98.57 174 B 1 +ATOM 4126 C CB . ILE B ? 174 ? -28.686 9.945 14.248 1.0 98.66 174 B 1 +ATOM 4127 C CG1 . ILE B ? 174 ? -28.201 8.605 14.848 1.0 97.33 174 B 1 +ATOM 4128 C CG2 . ILE B ? 174 ? -27.693 11.073 14.583 1.0 98.08 174 B 1 +ATOM 4129 C CD1 . ILE B ? 174 ? -28.097 8.555 16.370 1.0 91.22 174 B 1 +ATOM 4130 N N . THR B ? 175 ? -31.262 12.498 14.594 1.0 98.69 175 B 1 +ATOM 4131 C CA . THR B ? 175 ? -32.012 13.597 13.975 1.0 98.68 175 B 1 +ATOM 4132 C C . THR B ? 175 ? -31.114 14.617 13.278 1.0 98.79 175 B 1 +ATOM 4133 O O . THR B ? 175 ? -29.918 14.734 13.547 1.0 98.63 175 B 1 +ATOM 4134 C CB . THR B ? 175 ? -32.913 14.315 14.993 1.0 98.38 175 B 1 +ATOM 4135 O OG1 . THR B ? 175 ? -32.131 14.977 15.951 1.0 96.34 175 B 1 +ATOM 4136 C CG2 . THR B ? 175 ? -33.872 13.368 15.715 1.0 95.69 175 B 1 +ATOM 4137 N N . ARG B ? 176 ? -31.714 15.416 12.381 1.0 98.59 176 B 1 +ATOM 4138 C CA . ARG B ? 176 ? -31.048 16.552 11.736 1.0 98.65 176 B 1 +ATOM 4139 C C . ARG B ? 176 ? -30.550 17.568 12.766 1.0 98.76 176 B 1 +ATOM 4140 O O . ARG B ? 176 ? -29.406 18.010 12.659 1.0 98.61 176 B 1 +ATOM 4141 C CB . ARG B ? 176 ? -32.014 17.179 10.720 1.0 98.2 176 B 1 +ATOM 4142 C CG . ARG B ? 176 ? -31.506 18.493 10.112 1.0 96.55 176 B 1 +ATOM 4143 C CD . ARG B ? 176 ? -30.194 18.350 9.331 1.0 95.15 176 B 1 +ATOM 4144 N NE . ARG B ? 176 ? -29.738 19.665 8.886 1.0 94.93 176 B 1 +ATOM 4145 C CZ . ARG B ? 176 ? -30.150 20.353 7.826 1.0 96.11 176 B 1 +ATOM 4146 N NH1 . ARG B ? 176 ? -30.986 19.868 6.960 1.0 91.66 176 B 1 +ATOM 4147 N NH2 . ARG B ? 176 ? -29.722 21.565 7.656 1.0 93.37 176 B 1 +ATOM 4148 N N . GLU B ? 177 ? -31.375 17.900 13.762 1.0 98.67 177 B 1 +ATOM 4149 C CA . GLU B ? 177 ? -30.974 18.816 14.841 1.0 98.66 177 B 1 +ATOM 4150 C C . GLU B ? 177 ? -29.750 18.307 15.611 1.0 98.77 177 B 1 +ATOM 4151 O O . GLU B ? 177 ? -28.851 19.086 15.905 1.0 98.6 177 B 1 +ATOM 4152 C CB . GLU B ? 177 ? -32.114 19.030 15.852 1.0 98.3 177 B 1 +ATOM 4153 C CG . GLU B ? 177 ? -33.126 20.110 15.449 1.0 84.25 177 B 1 +ATOM 4154 C CD . GLU B ? 177 ? -34.357 19.603 14.694 1.0 76.04 177 B 1 +ATOM 4155 O OE1 . GLU B ? 177 ? -35.171 20.475 14.318 1.0 69.48 177 B 1 +ATOM 4156 O OE2 . GLU B ? 177 ? -34.471 18.370 14.476 1.0 69.86 177 B 1 +ATOM 4157 N N . GLU B ? 178 ? -29.696 17.018 15.936 1.0 98.76 178 B 1 +ATOM 4158 C CA . GLU B ? 178 ? -28.545 16.439 16.638 1.0 98.74 178 B 1 +ATOM 4159 C C . GLU B ? 178 ? -27.267 16.515 15.795 1.0 98.83 178 B 1 +ATOM 4160 O O . GLU B ? 178 ? -26.216 16.900 16.310 1.0 98.73 178 B 1 +ATOM 4161 C CB . GLU B ? 178 ? -28.827 14.980 17.016 1.0 98.49 178 B 1 +ATOM 4162 C CG . GLU B ? 178 ? -29.831 14.851 18.173 1.0 94.0 178 B 1 +ATOM 4163 C CD . GLU B ? 178 ? -30.120 13.376 18.483 1.0 93.98 178 B 1 +ATOM 4164 O OE1 . GLU B ? 178 ? -30.018 12.983 19.666 1.0 86.39 178 B 1 +ATOM 4165 O OE2 . GLU B ? 178 ? -30.404 12.591 17.550 1.0 88.62 178 B 1 +ATOM 4166 N N . GLN B ? 179 ? -27.358 16.202 14.505 1.0 98.87 179 B 1 +ATOM 4167 C CA . GLN B ? 179 ? -26.223 16.270 13.581 1.0 98.89 179 B 1 +ATOM 4168 C C . GLN B ? 179 ? -25.704 17.703 13.417 1.0 98.91 179 B 1 +ATOM 4169 O O . GLN B ? 179 ? -24.499 17.935 13.489 1.0 98.86 179 B 1 +ATOM 4170 C CB . GLN B ? 179 ? -26.624 15.687 12.221 1.0 98.87 179 B 1 +ATOM 4171 C CG . GLN B ? 179 ? -26.849 14.167 12.259 1.0 98.69 179 B 1 +ATOM 4172 C CD . GLN B ? 179 ? -27.392 13.651 10.935 1.0 98.69 179 B 1 +ATOM 4173 O OE1 . GLN B ? 179 ? -26.810 13.824 9.877 1.0 93.91 179 B 1 +ATOM 4174 N NE2 . GLN B ? 179 ? -28.536 13.013 10.945 1.0 93.79 179 B 1 +ATOM 4175 N N . ASP B ? 180 ? -26.606 18.675 13.243 1.0 98.85 180 B 1 +ATOM 4176 C CA . ASP B ? 180 ? -26.231 20.087 13.114 1.0 98.84 180 B 1 +ATOM 4177 C C . ASP B ? 180 ? -25.637 20.637 14.422 1.0 98.84 180 B 1 +ATOM 4178 O O . ASP B ? 180 ? -24.636 21.354 14.408 1.0 98.68 180 B 1 +ATOM 4179 C CB . ASP B ? 180 ? -27.452 20.918 12.676 1.0 98.77 180 B 1 +ATOM 4180 C CG . ASP B ? 180 ? -27.856 20.740 11.205 1.0 98.7 180 B 1 +ATOM 4181 O OD1 . ASP B ? 180 ? -27.149 20.065 10.428 1.0 97.77 180 B 1 +ATOM 4182 O OD2 . ASP B ? 180 ? -28.868 21.353 10.793 1.0 97.78 180 B 1 +ATOM 4183 N N . LYS B ? 181 ? -26.206 20.261 15.571 1.0 98.82 181 B 1 +ATOM 4184 C CA . LYS B ? 181 ? -25.678 20.644 16.887 1.0 98.78 181 B 1 +ATOM 4185 C C . LYS B ? 181 ? -24.275 20.079 17.116 1.0 98.83 181 B 1 +ATOM 4186 O O . LYS B ? 181 ? -23.402 20.793 17.610 1.0 98.67 181 B 1 +ATOM 4187 C CB . LYS B ? 181 ? -26.673 20.178 17.960 1.0 98.41 181 B 1 +ATOM 4188 C CG . LYS B ? 181 ? -26.432 20.846 19.322 1.0 89.56 181 B 1 +ATOM 4189 C CD . LYS B ? 181 ? -27.458 20.320 20.328 1.0 87.03 181 B 1 +ATOM 4190 C CE . LYS B ? 181 ? -27.298 21.003 21.688 1.0 72.97 181 B 1 +ATOM 4191 N NZ . LYS B ? 181 ? -28.190 20.390 22.699 1.0 64.3 181 B 1 +ATOM 4192 N N . TYR B ? 182 ? -24.042 18.825 16.721 1.0 98.84 182 B 1 +ATOM 4193 C CA . TYR B ? 182 ? -22.720 18.204 16.783 1.0 98.87 182 B 1 +ATOM 4194 C C . TYR B ? 182 ? -21.722 18.877 15.831 1.0 98.9 182 B 1 +ATOM 4195 O O . TYR B ? 182 ? -20.598 19.166 16.231 1.0 98.84 182 B 1 +ATOM 4196 C CB . TYR B ? 182 ? -22.838 16.703 16.494 1.0 98.84 182 B 1 +ATOM 4197 C CG . TYR B ? 182 ? -21.521 15.985 16.692 1.0 98.83 182 B 1 +ATOM 4198 C CD1 . TYR B ? 182 ? -20.566 15.953 15.658 1.0 98.56 182 B 1 +ATOM 4199 C CD2 . TYR B ? 182 ? -21.198 15.432 17.947 1.0 98.57 182 B 1 +ATOM 4200 C CE1 . TYR B ? 182 ? -19.296 15.397 15.880 1.0 98.39 182 B 1 +ATOM 4201 C CE2 . TYR B ? 182 ? -19.933 14.870 18.182 1.0 98.33 182 B 1 +ATOM 4202 C CZ . TYR B ? 182 ? -18.978 14.869 17.146 1.0 98.5 182 B 1 +ATOM 4203 O OH . TYR B ? 182 ? -17.724 14.372 17.384 1.0 97.92 182 B 1 +ATOM 4204 N N . ALA B ? 183 ? -22.140 19.202 14.607 1.0 98.89 183 B 1 +ATOM 4205 C CA . ALA B ? 183 ? -21.301 19.928 13.653 1.0 98.89 183 B 1 +ATOM 4206 C C . ALA B ? 183 ? -20.873 21.297 14.206 1.0 98.89 183 B 1 +ATOM 4207 O O . ALA B ? 183 ? -19.689 21.633 14.192 1.0 98.82 183 B 1 +ATOM 4208 C CB . ALA B ? 183 ? -22.061 20.063 12.331 1.0 98.84 183 B 1 +ATOM 4209 N N . ILE B ? 184 ? -21.808 22.058 14.782 1.0 98.85 184 B 1 +ATOM 4210 C CA . ILE B ? 184 ? -21.514 23.334 15.457 1.0 98.82 184 B 1 +ATOM 4211 C C . ILE B ? 184 ? -20.500 23.133 16.592 1.0 98.83 184 B 1 +ATOM 4212 O O . ILE B ? 184 ? -19.577 23.939 16.739 1.0 98.69 184 B 1 +ATOM 4213 C CB . ILE B ? 184 ? -22.824 23.981 15.971 1.0 98.69 184 B 1 +ATOM 4214 C CG1 . ILE B ? 184 ? -23.674 24.489 14.780 1.0 98.02 184 B 1 +ATOM 4215 C CG2 . ILE B ? 184 ? -22.551 25.143 16.952 1.0 98.25 184 B 1 +ATOM 4216 C CD1 . ILE B ? 184 ? -25.126 24.832 15.142 1.0 95.17 184 B 1 +ATOM 4217 N N . LEU B ? 185 ? -20.650 22.068 17.387 1.0 98.77 185 B 1 +ATOM 4218 C CA . LEU B ? 185 ? -19.708 21.734 18.454 1.0 98.76 185 B 1 +ATOM 4219 C C . LEU B ? 185 ? -18.313 21.431 17.892 1.0 98.83 185 B 1 +ATOM 4220 O O . LEU B ? 185 ? -17.334 21.970 18.406 1.0 98.75 185 B 1 +ATOM 4221 C CB . LEU B ? 185 ? -20.275 20.562 19.275 1.0 98.62 185 B 1 +ATOM 4222 C CG . LEU B ? 185 ? -19.392 20.133 20.464 1.0 97.39 185 B 1 +ATOM 4223 C CD1 . LEU B ? 185 ? -19.263 21.238 21.513 1.0 95.43 185 B 1 +ATOM 4224 C CD2 . LEU B ? 185 ? -20.005 18.902 21.130 1.0 95.36 185 B 1 +ATOM 4225 N N . SER B ? 186 ? -18.219 20.648 16.815 1.0 98.84 186 B 1 +ATOM 4226 C CA . SER B ? 186 ? -16.957 20.342 16.131 1.0 98.88 186 B 1 +ATOM 4227 C C . SER B ? 186 ? -16.249 21.622 15.661 1.0 98.89 186 B 1 +ATOM 4228 O O . SER B ? 186 ? -15.092 21.846 16.010 1.0 98.85 186 B 1 +ATOM 4229 C CB . SER B ? 186 ? -17.213 19.385 14.960 1.0 98.87 186 B 1 +ATOM 4230 O OG . SER B ? 186 ? -15.980 18.938 14.415 1.0 98.59 186 B 1 +ATOM 4231 N N . TYR B ? 187 ? -16.959 22.522 14.976 1.0 98.87 187 B 1 +ATOM 4232 C CA . TYR B ? 187 ? -16.402 23.809 14.526 1.0 98.86 187 B 1 +ATOM 4233 C C . TYR B ? 187 ? -15.956 24.714 15.685 1.0 98.84 187 B 1 +ATOM 4234 O O . TYR B ? 187 ? -14.929 25.383 15.588 1.0 98.66 187 B 1 +ATOM 4235 C CB . TYR B ? 187 ? -17.428 24.548 13.659 1.0 98.8 187 B 1 +ATOM 4236 C CG . TYR B ? 187 ? -17.438 24.106 12.212 1.0 98.72 187 B 1 +ATOM 4237 C CD1 . TYR B ? 187 ? -16.417 24.531 11.340 1.0 97.96 187 B 1 +ATOM 4238 C CD2 . TYR B ? 187 ? -18.461 23.273 11.721 1.0 98.19 187 B 1 +ATOM 4239 C CE1 . TYR B ? 187 ? -16.412 24.123 9.995 1.0 97.84 187 B 1 +ATOM 4240 C CE2 . TYR B ? 187 ? -18.466 22.855 10.378 1.0 97.7 187 B 1 +ATOM 4241 C CZ . TYR B ? 187 ? -17.433 23.283 9.517 1.0 97.98 187 B 1 +ATOM 4242 O OH . TYR B ? 187 ? -17.425 22.867 8.209 1.0 96.85 187 B 1 +ATOM 4243 N N . LYS B ? 188 ? -16.705 24.738 16.798 1.0 98.8 188 B 1 +ATOM 4244 C CA . LYS B ? 188 ? -16.304 25.510 17.986 1.0 98.76 188 B 1 +ATOM 4245 C C . LYS B ? 188 ? -15.058 24.923 18.649 1.0 98.8 188 B 1 +ATOM 4246 O O . LYS B ? 188 ? -14.170 25.679 19.044 1.0 98.61 188 B 1 +ATOM 4247 C CB . LYS B ? 188 ? -17.468 25.599 18.982 1.0 98.64 188 B 1 +ATOM 4248 C CG . LYS B ? 188 ? -18.542 26.587 18.499 1.0 97.04 188 B 1 +ATOM 4249 C CD . LYS B ? 188 ? -19.689 26.667 19.511 1.0 91.61 188 B 1 +ATOM 4250 C CE . LYS B ? 188 ? -20.717 27.698 19.033 1.0 87.22 188 B 1 +ATOM 4251 N NZ . LYS B ? 188 ? -21.839 27.849 19.992 1.0 77.04 188 B 1 +ATOM 4252 N N . ARG B ? 189 ? -14.974 23.601 18.746 1.0 98.85 189 B 1 +ATOM 4253 C CA . ARG B ? 189 ? -13.827 22.897 19.336 1.0 98.86 189 B 1 +ATOM 4254 C C . ARG B ? 189 ? -12.560 23.045 18.492 1.0 98.88 189 B 1 +ATOM 4255 O O . ARG B ? 189 ? -11.516 23.364 19.056 1.0 98.74 189 B 1 +ATOM 4256 C CB . ARG B ? 189 ? -14.178 21.419 19.531 1.0 98.69 189 B 1 +ATOM 4257 C CG . ARG B ? 189 ? -15.099 21.185 20.740 1.0 98.13 189 B 1 +ATOM 4258 C CD . ARG B ? 189 ? -15.491 19.709 20.782 1.0 97.15 189 B 1 +ATOM 4259 N NE . ARG B ? 189 ? -16.146 19.328 22.047 1.0 95.76 189 B 1 +ATOM 4260 C CZ . ARG B ? 189 ? -16.590 18.120 22.345 1.0 95.36 189 B 1 +ATOM 4261 N NH1 . ARG B ? 189 ? -16.547 17.141 21.489 1.0 91.07 189 B 1 +ATOM 4262 N NH2 . ARG B ? 189 ? -17.080 17.867 23.521 1.0 91.54 189 B 1 +ATOM 4263 N N . SER B ? 190 ? -12.643 22.888 17.176 1.0 98.89 190 B 1 +ATOM 4264 C CA . SER B ? 190 ? -11.486 23.071 16.287 1.0 98.86 190 B 1 +ATOM 4265 C C . SER B ? 190 ? -10.978 24.516 16.291 1.0 98.87 190 B 1 +ATOM 4266 O O . SER B ? 190 ? -9.775 24.740 16.409 1.0 98.71 190 B 1 +ATOM 4267 C CB . SER B ? 190 ? -11.814 22.608 14.867 1.0 98.56 190 B 1 +ATOM 4268 O OG . SER B ? 190 ? -12.919 23.309 14.335 1.0 90.94 190 B 1 +ATOM 4269 N N . ALA B ? 191 ? -11.883 25.504 16.274 1.0 98.79 191 B 1 +ATOM 4270 C CA . ALA B ? 191 ? -11.507 26.914 16.377 1.0 98.72 191 B 1 +ATOM 4271 C C . ALA B ? 191 ? -10.835 27.241 17.725 1.0 98.73 191 B 1 +ATOM 4272 O O . ALA B ? 191 ? -9.844 27.970 17.757 1.0 98.5 191 B 1 +ATOM 4273 C CB . ALA B ? 191 ? -12.754 27.778 16.147 1.0 98.51 191 B 1 +ATOM 4274 N N . ALA B ? 192 ? -11.344 26.689 18.829 1.0 98.74 192 B 1 +ATOM 4275 C CA . ALA B ? 192 ? -10.719 26.845 20.142 1.0 98.72 192 B 1 +ATOM 4276 C C . ALA B ? 192 ? -9.331 26.183 20.189 1.0 98.73 192 B 1 +ATOM 4277 O O . ALA B ? 192 ? -8.376 26.818 20.635 1.0 98.5 192 B 1 +ATOM 4278 C CB . ALA B ? 192 ? -11.661 26.285 21.215 1.0 98.64 192 B 1 +ATOM 4279 N N . ALA B ? 193 ? -9.202 24.961 19.658 1.0 98.81 193 B 1 +ATOM 4280 C CA . ALA B ? 193 ? -7.937 24.233 19.600 1.0 98.79 193 B 1 +ATOM 4281 C C . ALA B ? 193 ? -6.866 24.988 18.795 1.0 98.76 193 B 1 +ATOM 4282 O O . ALA B ? 193 ? -5.733 25.129 19.256 1.0 98.54 193 B 1 +ATOM 4283 C CB . ALA B ? 193 ? -8.207 22.844 19.009 1.0 98.72 193 B 1 +ATOM 4284 N N . TRP B ? 194 ? -7.228 25.536 17.633 1.0 98.71 194 B 1 +ATOM 4285 C CA . TRP B ? 194 ? -6.332 26.384 16.842 1.0 98.66 194 B 1 +ATOM 4286 C C . TRP B ? 194 ? -5.928 27.659 17.588 1.0 98.52 194 B 1 +ATOM 4287 O O . TRP B ? 194 ? -4.752 28.012 17.621 1.0 97.99 194 B 1 +ATOM 4288 C CB . TRP B ? 194 ? -6.986 26.705 15.494 1.0 98.56 194 B 1 +ATOM 4289 C CG . TRP B ? 194 ? -6.582 25.743 14.422 1.0 98.43 194 B 1 +ATOM 4290 C CD1 . TRP B ? 194 ? -7.322 24.740 13.905 1.0 97.59 194 B 1 +ATOM 4291 C CD2 . TRP B ? 194 ? -5.271 25.654 13.786 1.0 98.28 194 B 1 +ATOM 4292 N NE1 . TRP B ? 194 ? -6.566 24.023 12.986 1.0 97.55 194 B 1 +ATOM 4293 C CE2 . TRP B ? 194 ? -5.293 24.541 12.901 1.0 97.79 194 B 1 +ATOM 4294 C CE3 . TRP B ? 194 ? -4.072 26.389 13.898 1.0 97.58 194 B 1 +ATOM 4295 C CZ2 . TRP B ? 194 ? -4.146 24.145 12.179 1.0 96.99 194 B 1 +ATOM 4296 C CZ3 . TRP B ? 194 ? -2.933 25.998 13.170 1.0 96.61 194 B 1 +ATOM 4297 C CH2 . TRP B ? 194 ? -2.967 24.883 12.332 1.0 96.54 194 B 1 +ATOM 4298 N N . LYS B ? 195 ? -6.891 28.321 18.248 1.0 98.4 195 B 1 +ATOM 4299 C CA . LYS B ? 195 ? -6.638 29.541 19.022 1.0 98.24 195 B 1 +ATOM 4300 C C . LYS B ? 195 ? -5.697 29.303 20.207 1.0 98.16 195 B 1 +ATOM 4301 O O . LYS B ? 195 ? -4.901 30.180 20.533 1.0 97.57 195 B 1 +ATOM 4302 C CB . LYS B ? 195 ? -7.987 30.108 19.476 1.0 98.02 195 B 1 +ATOM 4303 C CG . LYS B ? 195 ? -7.840 31.503 20.101 1.0 94.02 195 B 1 +ATOM 4304 C CD . LYS B ? 195 ? -9.207 32.026 20.550 1.0 89.51 195 B 1 +ATOM 4305 C CE . LYS B ? 195 ? -9.033 33.409 21.184 1.0 79.24 195 B 1 +ATOM 4306 N NZ . LYS B ? 195 ? -10.305 33.912 21.739 1.0 69.24 195 B 1 +ATOM 4307 N N . GLU B ? 196 ? -5.777 28.131 20.834 1.0 98.49 196 B 1 +ATOM 4308 C CA . GLU B ? 196 ? -4.912 27.728 21.952 1.0 98.29 196 B 1 +ATOM 4309 C C . GLU B ? 196 ? -3.567 27.121 21.499 1.0 98.23 196 B 1 +ATOM 4310 O O . GLU B ? 196 ? -2.723 26.792 22.331 1.0 97.28 196 B 1 +ATOM 4311 C CB . GLU B ? 196 ? -5.664 26.768 22.886 1.0 97.89 196 B 1 +ATOM 4312 C CG . GLU B ? 196 ? -6.887 27.422 23.547 1.0 91.55 196 B 1 +ATOM 4313 C CD . GLU B ? 196 ? -7.023 27.163 25.054 1.0 83.7 196 B 1 +ATOM 4314 O OE1 . GLU B ? 196 ? -7.774 27.939 25.694 1.0 73.95 196 B 1 +ATOM 4315 O OE2 . GLU B ? 196 ? -6.360 26.232 25.575 1.0 75.07 196 B 1 +ATOM 4316 N N . GLY B ? 197 ? -3.342 26.967 20.196 1.0 98.29 197 B 1 +ATOM 4317 C CA . GLY B ? 197 ? -2.102 26.398 19.657 1.0 98.04 197 B 1 +ATOM 4318 C C . GLY B ? 197 ? -1.940 24.895 19.904 1.0 98.19 197 B 1 +ATOM 4319 O O . GLY B ? 197 ? -0.813 24.390 19.882 1.0 97.18 197 B 1 +ATOM 4320 N N . ILE B ? 198 ? -3.037 24.163 20.112 1.0 98.38 198 B 1 +ATOM 4321 C CA . ILE B ? 198 ? -3.035 22.719 20.413 1.0 98.33 198 B 1 +ATOM 4322 C C . ILE B ? 198 ? -2.286 21.904 19.352 1.0 98.26 198 B 1 +ATOM 4323 O O . ILE B ? 198 ? -1.556 20.973 19.685 1.0 97.28 198 B 1 +ATOM 4324 C CB . ILE B ? 198 ? -4.489 22.226 20.577 1.0 98.0 198 B 1 +ATOM 4325 C CG1 . ILE B ? 198 ? -5.188 22.852 21.808 1.0 96.43 198 B 1 +ATOM 4326 C CG2 . ILE B ? 198 ? -4.583 20.686 20.642 1.0 96.82 198 B 1 +ATOM 4327 C CD1 . ILE B ? 198 ? -4.614 22.471 23.177 1.0 92.21 198 B 1 +ATOM 4328 N N . PHE B ? 199 ? -2.423 22.271 18.082 1.0 98.44 199 B 1 +ATOM 4329 C CA . PHE B ? 199 ? -1.835 21.541 16.961 1.0 98.33 199 B 1 +ATOM 4330 C C . PHE B ? 199 ? -0.356 21.868 16.701 1.0 98.0 199 B 1 +ATOM 4331 O O . PHE B ? 199 ? 0.272 21.225 15.863 1.0 96.75 199 B 1 +ATOM 4332 C CB . PHE B ? 199 ? -2.694 21.761 15.712 1.0 98.24 199 B 1 +ATOM 4333 C CG . PHE B ? 199 ? -4.146 21.361 15.874 1.0 98.53 199 B 1 +ATOM 4334 C CD1 . PHE B ? 199 ? -4.486 20.029 16.182 1.0 97.96 199 B 1 +ATOM 4335 C CD2 . PHE B ? 199 ? -5.165 22.317 15.723 1.0 97.95 199 B 1 +ATOM 4336 C CE1 . PHE B ? 199 ? -5.832 19.656 16.331 1.0 97.55 199 B 1 +ATOM 4337 C CE2 . PHE B ? 199 ? -6.516 21.948 15.866 1.0 97.51 199 B 1 +ATOM 4338 C CZ . PHE B ? 199 ? -6.851 20.615 16.171 1.0 98.02 199 B 1 +ATOM 4339 N N . ALA B ? 200 ? 0.238 22.817 17.433 1.0 96.89 200 B 1 +ATOM 4340 C CA . ALA B ? 200 ? 1.603 23.292 17.178 1.0 95.82 200 B 1 +ATOM 4341 C C . ALA B ? 200 ? 2.681 22.188 17.211 1.0 95.86 200 B 1 +ATOM 4342 O O . ALA B ? 200 ? 3.721 22.314 16.569 1.0 94.24 200 B 1 +ATOM 4343 C CB . ALA B ? 200 ? 1.926 24.382 18.204 1.0 94.16 200 B 1 +ATOM 4344 N N . LYS B ? 201 ? 2.442 21.100 17.948 1.0 96.37 201 B 1 +ATOM 4345 C CA . LYS B ? 201 ? 3.372 19.961 18.030 1.0 95.72 201 B 1 +ATOM 4346 C C . LYS B ? 201 ? 3.287 19.011 16.837 1.0 96.87 201 B 1 +ATOM 4347 O O . LYS B ? 201 ? 4.222 18.247 16.625 1.0 95.41 201 B 1 +ATOM 4348 C CB . LYS B ? 201 ? 3.122 19.178 19.324 1.0 92.5 201 B 1 +ATOM 4349 C CG . LYS B ? 201 ? 3.534 19.968 20.572 1.0 83.21 201 B 1 +ATOM 4350 C CD . LYS B ? 201 ? 3.321 19.092 21.809 1.0 78.87 201 B 1 +ATOM 4351 C CE . LYS B ? 201 ? 3.726 19.849 23.074 1.0 67.89 201 B 1 +ATOM 4352 N NZ . LYS B ? 201 ? 3.445 19.036 24.279 1.0 59.88 201 B 1 +ATOM 4353 N N . GLU B ? 202 ? 2.167 19.016 16.120 1.0 97.77 202 B 1 +ATOM 4354 C CA . GLU B ? 202 ? 1.890 18.029 15.069 1.0 97.9 202 B 1 +ATOM 4355 C C . GLU B ? 202 ? 1.816 18.622 13.658 1.0 98.48 202 B 1 +ATOM 4356 O O . GLU B ? 202 ? 2.053 17.901 12.694 1.0 98.11 202 B 1 +ATOM 4357 C CB . GLU B ? 202 ? 0.627 17.230 15.425 1.0 95.32 202 B 1 +ATOM 4358 C CG . GLU B ? 202 ? -0.689 18.019 15.345 1.0 90.2 202 B 1 +ATOM 4359 C CD . GLU B ? 202 ? -1.876 17.210 15.891 1.0 95.62 202 B 1 +ATOM 4360 O OE1 . GLU B ? 202 ? -2.805 16.909 15.120 1.0 91.43 202 B 1 +ATOM 4361 O OE2 . GLU B ? 202 ? -1.856 16.886 17.102 1.0 93.72 202 B 1 +ATOM 4362 N N . ILE B ? 203 ? 1.534 19.918 13.530 1.0 98.45 203 B 1 +ATOM 4363 C CA . ILE B ? 203 ? 1.507 20.611 12.237 1.0 98.35 203 B 1 +ATOM 4364 C C . ILE B ? 203 ? 2.929 20.915 11.768 1.0 98.39 203 B 1 +ATOM 4365 O O . ILE B ? 203 ? 3.759 21.434 12.509 1.0 97.42 203 B 1 +ATOM 4366 C CB . ILE B ? 203 ? 0.647 21.894 12.306 1.0 96.95 203 B 1 +ATOM 4367 C CG1 . ILE B ? 203 ? -0.851 21.565 12.503 1.0 91.57 203 B 1 +ATOM 4368 C CG2 . ILE B ? 203 ? 0.829 22.789 11.069 1.0 93.41 203 B 1 +ATOM 4369 C CD1 . ILE B ? 203 ? -1.607 21.129 11.246 1.0 83.82 203 B 1 +ATOM 4370 N N . ILE B ? 204 ? 3.169 20.657 10.492 1.0 98.5 204 B 1 +ATOM 4371 C CA . ILE B ? 204 ? 4.333 21.146 9.764 1.0 98.14 204 B 1 +ATOM 4372 C C . ILE B ? 204 ? 3.884 22.182 8.723 1.0 98.42 204 B 1 +ATOM 4373 O O . ILE B ? 204 ? 2.944 21.921 7.972 1.0 97.78 204 B 1 +ATOM 4374 C CB . ILE B ? 204 ? 5.129 19.994 9.129 1.0 96.06 204 B 1 +ATOM 4375 C CG1 . ILE B ? 204 ? 4.249 18.952 8.403 1.0 85.06 204 B 1 +ATOM 4376 C CG2 . ILE B ? 204 ? 5.980 19.293 10.198 1.0 77.13 204 B 1 +ATOM 4377 C CD1 . ILE B ? 204 ? 4.823 18.597 7.048 1.0 74.01 204 B 1 +ATOM 4378 N N . PRO B ? 205 ? 4.549 23.343 8.634 1.0 98.09 205 B 1 +ATOM 4379 C CA . PRO B ? 205 ? 4.306 24.287 7.553 1.0 97.74 205 B 1 +ATOM 4380 C C . PRO B ? 205 ? 4.663 23.670 6.197 1.0 97.85 205 B 1 +ATOM 4381 O O . PRO B ? 205 ? 5.663 22.959 6.078 1.0 96.93 205 B 1 +ATOM 4382 C CB . PRO B ? 205 ? 5.170 25.513 7.861 1.0 96.25 205 B 1 +ATOM 4383 C CG . PRO B ? 205 ? 5.536 25.358 9.340 1.0 92.76 205 B 1 +ATOM 4384 C CD . PRO B ? 205 ? 5.554 23.849 9.538 1.0 96.65 205 B 1 +ATOM 4385 N N . LEU B ? 206 ? 3.885 23.980 5.159 1.0 97.8 206 B 1 +ATOM 4386 C CA . LEU B ? 206 ? 4.218 23.649 3.773 1.0 97.72 206 B 1 +ATOM 4387 C C . LEU B ? 206 ? 4.396 24.917 2.949 1.0 97.91 206 B 1 +ATOM 4388 O O . LEU B ? 206 ? 3.509 25.762 2.896 1.0 96.88 206 B 1 +ATOM 4389 C CB . LEU B ? 206 ? 3.154 22.744 3.131 1.0 96.34 206 B 1 +ATOM 4390 C CG . LEU B ? 206 ? 3.569 21.267 3.119 1.0 90.66 206 B 1 +ATOM 4391 C CD1 . LEU B ? 206 ? 3.210 20.588 4.427 1.0 84.48 206 B 1 +ATOM 4392 C CD2 . LEU B ? 206 ? 2.874 20.525 1.980 1.0 85.53 206 B 1 +ATOM 4393 N N . GLU B ? 207 ? 5.516 25.007 2.241 1.0 96.97 207 B 1 +ATOM 4394 C CA . GLU B ? 207 ? 5.656 25.969 1.156 1.0 96.47 207 B 1 +ATOM 4395 C C . GLU B ? 207 ? 4.964 25.454 -0.108 1.0 96.61 207 B 1 +ATOM 4396 O O . GLU B ? 207 ? 5.223 24.346 -0.585 1.0 95.02 207 B 1 +ATOM 4397 C CB . GLU B ? 207 ? 7.124 26.285 0.871 1.0 94.84 207 B 1 +ATOM 4398 C CG . GLU B ? 207 ? 7.735 27.185 1.949 1.0 83.98 207 B 1 +ATOM 4399 C CD . GLU B ? 207 ? 9.108 27.733 1.549 1.0 79.53 207 B 1 +ATOM 4400 O OE1 . GLU B ? 207 ? 9.540 28.715 2.195 1.0 72.1 207 B 1 +ATOM 4401 O OE2 . GLU B ? 207 ? 9.709 27.206 0.580 1.0 72.99 207 B 1 +ATOM 4402 N N . VAL B ? 208 ? 4.095 26.286 -0.669 1.0 95.76 208 B 1 +ATOM 4403 C CA . VAL B ? 208 ? 3.360 26.011 -1.896 1.0 95.39 208 B 1 +ATOM 4404 C C . VAL B ? 208 ? 3.558 27.150 -2.880 1.0 95.14 208 B 1 +ATOM 4405 O O . VAL B ? 208 ? 3.440 28.321 -2.533 1.0 92.98 208 B 1 +ATOM 4406 C CB . VAL B ? 208 ? 1.854 25.772 -1.664 1.0 93.58 208 B 1 +ATOM 4407 C CG1 . VAL B ? 208 ? 1.511 24.332 -2.040 1.0 86.57 208 B 1 +ATOM 4408 C CG2 . VAL B ? 208 ? 1.367 26.001 -0.226 1.0 87.2 208 B 1 +ATOM 4409 N N . THR B ? 209 ? 3.839 26.810 -4.126 1.0 92.15 209 B 1 +ATOM 4410 C CA . THR B ? 209 ? 3.974 27.804 -5.192 1.0 89.88 209 B 1 +ATOM 4411 C C . THR B ? 209 ? 2.635 27.966 -5.906 1.0 88.91 209 B 1 +ATOM 4412 O O . THR B ? 209 ? 2.167 27.054 -6.581 1.0 84.52 209 B 1 +ATOM 4413 C CB . THR B ? 209 ? 5.098 27.432 -6.161 1.0 86.35 209 B 1 +ATOM 4414 O OG1 . THR B ? 209 ? 6.285 27.181 -5.444 1.0 76.05 209 B 1 +ATOM 4415 C CG2 . THR B ? 209 ? 5.405 28.567 -7.133 1.0 73.47 209 B 1 +ATOM 4416 N N . GLN B ? 210 ? 2.027 29.144 -5.789 1.0 86.27 210 B 1 +ATOM 4417 C CA . GLN B ? 210 ? 0.840 29.544 -6.544 1.0 84.12 210 B 1 +ATOM 4418 C C . GLN B ? 210 ? 1.247 30.558 -7.620 1.0 84.26 210 B 1 +ATOM 4419 O O . GLN B ? 210 ? 1.472 31.742 -7.348 1.0 78.36 210 B 1 +ATOM 4420 C CB . GLN B ? 210 ? -0.241 30.093 -5.605 1.0 80.1 210 B 1 +ATOM 4421 C CG . GLN B ? 210 ? -0.896 28.990 -4.753 1.0 73.52 210 B 1 +ATOM 4422 C CD . GLN B ? 210 ? -2.080 29.512 -3.932 1.0 69.07 210 B 1 +ATOM 4423 O OE1 . GLN B ? 210 ? -2.397 30.692 -3.920 1.0 63.38 210 B 1 +ATOM 4424 N NE2 . GLN B ? 210 ? -2.768 28.648 -3.215 1.0 62.25 210 B 1 +ATOM 4425 N N . GLY B ? 211 ? 1.374 30.079 -8.850 1.0 81.96 211 B 1 +ATOM 4426 C CA . GLY B ? 211 ? 1.882 30.879 -9.963 1.0 82.16 211 B 1 +ATOM 4427 C C . GLY B ? 211 ? 3.314 31.358 -9.696 1.0 84.61 211 B 1 +ATOM 4428 O O . GLY B ? 211 ? 4.254 30.566 -9.693 1.0 80.44 211 B 1 +ATOM 4429 N N . LYS B ? 212 ? 3.487 32.668 -9.481 1.0 85.92 212 B 1 +ATOM 4430 C CA . LYS B ? 212 ? 4.801 33.286 -9.203 1.0 87.94 212 B 1 +ATOM 4431 C C . LYS B ? 212 ? 5.058 33.552 -7.714 1.0 89.61 212 B 1 +ATOM 4432 O O . LYS B ? 212 ? 6.107 34.093 -7.376 1.0 85.44 212 B 1 +ATOM 4433 C CB . LYS B ? 212 ? 4.958 34.585 -10.005 1.0 85.41 212 B 1 +ATOM 4434 C CG . LYS B ? 212 ? 5.019 34.348 -11.520 1.0 77.61 212 B 1 +ATOM 4435 C CD . LYS B ? 212 ? 5.356 35.666 -12.236 1.0 69.23 212 B 1 +ATOM 4436 C CE . LYS B ? 212 ? 5.451 35.429 -13.748 1.0 61.35 212 B 1 +ATOM 4437 N NZ . LYS B ? 212 ? 5.824 36.669 -14.482 1.0 51.37 212 B 1 +ATOM 4438 N N . LYS B ? 213 ? 4.104 33.251 -6.836 1.0 89.23 213 B 1 +ATOM 4439 C CA . LYS B ? 213 ? 4.230 33.478 -5.395 1.0 90.39 213 B 1 +ATOM 4440 C C . LYS B ? 213 ? 4.402 32.152 -4.668 1.0 91.94 213 B 1 +ATOM 4441 O O . LYS B ? 213 ? 3.631 31.222 -4.887 1.0 89.04 213 B 1 +ATOM 4442 C CB . LYS B ? 213 ? 3.028 34.257 -4.848 1.0 86.52 213 B 1 +ATOM 4443 C CG . LYS B ? 213 ? 3.070 35.744 -5.238 1.0 74.89 213 B 1 +ATOM 4444 C CD . LYS B ? 213 ? 1.935 36.502 -4.540 1.0 70.82 213 B 1 +ATOM 4445 C CE . LYS B ? 213 ? 2.032 38.008 -4.823 1.0 61.09 213 B 1 +ATOM 4446 N NZ . LYS B ? 213 ? 0.987 38.765 -4.090 1.0 54.14 213 B 1 +ATOM 4447 N N . THR B ? 214 ? 5.369 32.118 -3.760 1.0 92.18 214 B 1 +ATOM 4448 C CA . THR B ? 214 ? 5.477 31.073 -2.747 1.0 92.86 214 B 1 +ATOM 4449 C C . THR B ? 214 ? 4.725 31.532 -1.506 1.0 93.76 214 B 1 +ATOM 4450 O O . THR B ? 214 ? 4.905 32.661 -1.052 1.0 91.8 214 B 1 +ATOM 4451 C CB . THR B ? 214 ? 6.942 30.749 -2.436 1.0 90.35 214 B 1 +ATOM 4452 O OG1 . THR B ? 214 ? 7.621 30.473 -3.645 1.0 81.28 214 B 1 +ATOM 4453 C CG2 . THR B ? 214 ? 7.081 29.519 -1.551 1.0 79.88 214 B 1 +ATOM 4454 N N . ILE B ? 215 ? 3.841 30.684 -0.997 1.0 94.85 215 B 1 +ATOM 4455 C CA . ILE B ? 215 ? 3.043 30.914 0.205 1.0 94.8 215 B 1 +ATOM 4456 C C . ILE B ? 215 ? 3.332 29.766 1.167 1.0 96.23 215 B 1 +ATOM 4457 O O . ILE B ? 215 ? 3.370 28.611 0.749 1.0 95.3 215 B 1 +ATOM 4458 C CB . ILE B ? 215 ? 1.535 31.012 -0.125 1.0 91.72 215 B 1 +ATOM 4459 C CG1 . ILE B ? 215 ? 1.261 32.008 -1.286 1.0 78.47 215 B 1 +ATOM 4460 C CG2 . ILE B ? 215 ? 0.750 31.421 1.136 1.0 75.8 215 B 1 +ATOM 4461 C CD1 . ILE B ? 215 ? -0.213 32.096 -1.707 1.0 71.38 215 B 1 +ATOM 4462 N N . THR B ? 216 ? 3.503 30.074 2.444 1.0 96.72 216 B 1 +ATOM 4463 C CA . THR B ? 216 ? 3.586 29.063 3.498 1.0 97.15 216 B 1 +ATOM 4464 C C . THR B ? 216 ? 2.189 28.808 4.041 1.0 97.32 216 B 1 +ATOM 4465 O O . THR B ? 216 ? 1.509 29.738 4.465 1.0 96.54 216 B 1 +ATOM 4466 C CB . THR B ? 216 ? 4.548 29.483 4.613 1.0 96.55 216 B 1 +ATOM 4467 O OG1 . THR B ? 216 ? 5.779 29.892 4.059 1.0 91.68 216 B 1 +ATOM 4468 C CG2 . THR B ? 216 ? 4.850 28.330 5.561 1.0 91.67 216 B 1 +ATOM 4469 N N . VAL B ? 217 ? 1.742 27.552 4.000 1.0 97.79 217 B 1 +ATOM 4470 C CA . VAL B ? 217 ? 0.475 27.102 4.584 1.0 97.97 217 B 1 +ATOM 4471 C C . VAL B ? 217 ? 0.784 26.462 5.932 1.0 98.18 217 B 1 +ATOM 4472 O O . VAL B ? 217 ? 1.501 25.464 5.996 1.0 97.93 217 B 1 +ATOM 4473 C CB . VAL B ? 217 ? -0.264 26.127 3.653 1.0 97.62 217 B 1 +ATOM 4474 C CG1 . VAL B ? 217 ? -1.636 25.754 4.222 1.0 96.44 217 B 1 +ATOM 4475 C CG2 . VAL B ? 217 ? -0.477 26.737 2.260 1.0 96.53 217 B 1 +ATOM 4476 N N . GLU B ? 218 ? 0.240 27.040 7.005 1.0 97.92 218 B 1 +ATOM 4477 C CA . GLU B ? 218 ? 0.526 26.659 8.394 1.0 97.45 218 B 1 +ATOM 4478 C C . GLU B ? 218 ? -0.730 26.268 9.177 1.0 97.79 218 B 1 +ATOM 4479 O O . GLU B ? 218 ? -0.629 25.731 10.280 1.0 96.69 218 B 1 +ATOM 4480 C CB . GLU B ? 218 ? 1.242 27.815 9.110 1.0 94.91 218 B 1 +ATOM 4481 C CG . GLU B ? 218 ? 2.521 28.254 8.382 1.0 84.51 218 B 1 +ATOM 4482 C CD . GLU B ? 218 ? 3.333 29.297 9.152 1.0 84.06 218 B 1 +ATOM 4483 O OE1 . GLU B ? 218 ? 4.572 29.133 9.195 1.0 76.25 218 B 1 +ATOM 4484 O OE2 . GLU B ? 218 ? 2.727 30.257 9.675 1.0 78.51 218 B 1 +ATOM 4485 N N . GLU B ? 219 ? -1.918 26.515 8.616 1.0 98.01 219 B 1 +ATOM 4486 C CA . GLU B ? 219 ? -3.213 26.276 9.248 1.0 98.02 219 B 1 +ATOM 4487 C C . GLU B ? 219 ? -4.114 25.380 8.402 1.0 98.45 219 B 1 +ATOM 4488 O O . GLU B ? 219 ? -4.117 25.442 7.175 1.0 98.08 219 B 1 +ATOM 4489 C CB . GLU B ? 219 ? -3.931 27.609 9.523 1.0 95.87 219 B 1 +ATOM 4490 C CG . GLU B ? 219 ? -3.412 28.366 10.764 1.0 87.87 219 B 1 +ATOM 4491 C CD . GLU B ? 219 ? -4.316 29.581 11.029 1.0 89.9 219 B 1 +ATOM 4492 O OE1 . GLU B ? 219 ? -4.950 29.682 12.101 1.0 84.33 219 B 1 +ATOM 4493 O OE2 . GLU B ? 219 ? -4.521 30.399 10.102 1.0 86.24 219 B 1 +ATOM 4494 N N . ASP B ? 220 ? -4.955 24.594 9.087 1.0 98.59 220 B 1 +ATOM 4495 C CA . ASP B ? 220 ? -6.085 23.910 8.465 1.0 98.63 220 B 1 +ATOM 4496 C C . ASP B ? 220 ? -7.065 24.947 7.888 1.0 98.52 220 B 1 +ATOM 4497 O O . ASP B ? 220 ? -7.397 25.947 8.533 1.0 98.03 220 B 1 +ATOM 4498 C CB . ASP B ? 220 ? -6.789 23.015 9.501 1.0 98.63 220 B 1 +ATOM 4499 C CG . ASP B ? 220 ? -5.915 21.880 10.048 1.0 98.69 220 B 1 +ATOM 4500 O OD1 . ASP B ? 220 ? -5.214 21.208 9.267 1.0 98.01 220 B 1 +ATOM 4501 O OD2 . ASP B ? 220 ? -5.952 21.607 11.269 1.0 98.05 220 B 1 +ATOM 4502 N N . GLU B ? 221 ? -7.569 24.707 6.676 1.0 98.56 221 B 1 +ATOM 4503 C CA . GLU B ? 221 ? -8.423 25.683 5.979 1.0 98.34 221 B 1 +ATOM 4504 C C . GLU B ? 221 ? -9.907 25.596 6.363 1.0 98.17 221 B 1 +ATOM 4505 O O . GLU B ? 221 ? -10.610 26.608 6.323 1.0 96.92 221 B 1 +ATOM 4506 C CB . GLU B ? 221 ? -8.279 25.517 4.460 1.0 97.87 221 B 1 +ATOM 4507 C CG . GLU B ? 221 ? -6.933 26.012 3.905 1.0 96.64 221 B 1 +ATOM 4508 C CD . GLU B ? 221 ? -7.011 26.031 2.374 1.0 96.99 221 B 1 +ATOM 4509 O OE1 . GLU B ? 221 ? -7.372 27.082 1.790 1.0 94.05 221 B 1 +ATOM 4510 O OE2 . GLU B ? 221 ? -6.804 24.974 1.747 1.0 94.56 221 B 1 +ATOM 4511 N N . GLU B ? 222 ? -10.404 24.395 6.711 1.0 98.38 222 B 1 +ATOM 4512 C CA . GLU B ? 222 ? -11.850 24.147 6.832 1.0 98.26 222 B 1 +ATOM 4513 C C . GLU B ? 222 ? -12.485 24.747 8.088 1.0 98.18 222 B 1 +ATOM 4514 O O . GLU B ? 222 ? -13.620 25.222 8.027 1.0 97.17 222 B 1 +ATOM 4515 C CB . GLU B ? 222 ? -12.147 22.641 6.781 1.0 97.61 222 B 1 +ATOM 4516 C CG . GLU B ? 222 ? -11.902 21.987 5.415 1.0 94.32 222 B 1 +ATOM 4517 C CD . GLU B ? 222 ? -12.805 22.496 4.283 1.0 96.09 222 B 1 +ATOM 4518 O OE1 . GLU B ? 222 ? -12.498 22.164 3.113 1.0 91.77 222 B 1 +ATOM 4519 O OE2 . GLU B ? 222 ? -13.777 23.240 4.536 1.0 92.75 222 B 1 +ATOM 4520 N N . TYR B ? 223 ? -11.785 24.765 9.222 1.0 98.32 223 B 1 +ATOM 4521 C CA . TYR B ? 223 ? -12.368 25.175 10.506 1.0 98.1 223 B 1 +ATOM 4522 C C . TYR B ? 223 ? -12.886 26.621 10.520 1.0 98.04 223 B 1 +ATOM 4523 O O . TYR B ? 223 ? -13.754 26.965 11.327 1.0 96.95 223 B 1 +ATOM 4524 C CB . TYR B ? 223 ? -11.361 24.938 11.639 1.0 97.61 223 B 1 +ATOM 4525 C CG . TYR B ? 223 ? -10.379 26.063 11.873 1.0 97.69 223 B 1 +ATOM 4526 C CD1 . TYR B ? 223 ? -9.149 26.114 11.192 1.0 96.81 223 B 1 +ATOM 4527 C CD2 . TYR B ? 223 ? -10.698 27.075 12.804 1.0 96.9 223 B 1 +ATOM 4528 C CE1 . TYR B ? 223 ? -8.241 27.156 11.442 1.0 95.86 223 B 1 +ATOM 4529 C CE2 . TYR B ? 223 ? -9.798 28.125 13.060 1.0 95.95 223 B 1 +ATOM 4530 C CZ . TYR B ? 223 ? -8.566 28.160 12.381 1.0 95.92 223 B 1 +ATOM 4531 O OH . TYR B ? 223 ? -7.686 29.179 12.644 1.0 94.3 223 B 1 +ATOM 4532 N N . LYS B ? 224 ? -12.395 27.460 9.607 1.0 97.77 224 B 1 +ATOM 4533 C CA . LYS B ? 224 ? -12.828 28.853 9.413 1.0 97.16 224 B 1 +ATOM 4534 C C . LYS B ? 224 ? -14.025 28.977 8.462 1.0 97.49 224 B 1 +ATOM 4535 O O . LYS B ? 224 ? -14.658 30.029 8.415 1.0 95.82 224 B 1 +ATOM 4536 C CB . LYS B ? 224 ? -11.640 29.697 8.908 1.0 95.22 224 B 1 +ATOM 4537 C CG . LYS B ? 224 ? -10.462 29.732 9.904 1.0 92.02 224 B 1 +ATOM 4538 C CD . LYS B ? 224 ? -9.288 30.581 9.390 1.0 88.07 224 B 1 +ATOM 4539 C CE . LYS B ? 224 ? -8.131 30.478 10.394 1.0 80.3 224 B 1 +ATOM 4540 N NZ . LYS B ? 224 ? -6.882 31.136 9.941 1.0 73.34 224 B 1 +ATOM 4541 N N . LYS B ? 225 ? -14.341 27.937 7.695 1.0 97.6 225 B 1 +ATOM 4542 C CA . LYS B ? 225 ? -15.366 27.941 6.641 1.0 97.42 225 B 1 +ATOM 4543 C C . LYS B ? 225 ? -16.734 27.505 7.173 1.0 97.69 225 B 1 +ATOM 4544 O O . LYS B ? 225 ? -17.329 26.535 6.705 1.0 96.12 225 B 1 +ATOM 4545 C CB . LYS B ? 225 ? -14.900 27.100 5.442 1.0 96.55 225 B 1 +ATOM 4546 C CG . LYS B ? 225 ? -13.649 27.682 4.769 1.0 94.96 225 B 1 +ATOM 4547 C CD . LYS B ? 225 ? -13.284 26.853 3.530 1.0 91.99 225 B 1 +ATOM 4548 C CE . LYS B ? 225 ? -12.050 27.449 2.848 1.0 87.32 225 B 1 +ATOM 4549 N NZ . LYS B ? 225 ? -11.633 26.639 1.684 1.0 80.49 225 B 1 +ATOM 4550 N N . VAL B ? 226 ? -17.262 28.229 8.151 1.0 97.74 226 B 1 +ATOM 4551 C CA . VAL B ? 226 ? -18.553 27.933 8.779 1.0 98.03 226 B 1 +ATOM 4552 C C . VAL B ? 226 ? -19.409 29.188 8.919 1.0 98.19 226 B 1 +ATOM 4553 O O . VAL B ? 226 ? -18.925 30.264 9.264 1.0 97.46 226 B 1 +ATOM 4554 C CB . VAL B ? 226 ? -18.349 27.200 10.122 1.0 97.36 226 B 1 +ATOM 4555 C CG1 . VAL B ? 226 ? -17.680 28.058 11.202 1.0 95.96 226 B 1 +ATOM 4556 C CG2 . VAL B ? 226 ? -19.675 26.654 10.665 1.0 95.36 226 B 1 +ATOM 4557 N N . ASN B ? 227 ? -20.716 29.042 8.663 1.0 98.05 227 B 1 +ATOM 4558 C CA . ASN B ? 227 ? -21.739 30.027 9.005 1.0 98.08 227 B 1 +ATOM 4559 C C . ASN B ? 227 ? -22.806 29.332 9.859 1.0 98.33 227 B 1 +ATOM 4560 O O . ASN B ? 227 ? -23.667 28.625 9.335 1.0 97.84 227 B 1 +ATOM 4561 C CB . ASN B ? 227 ? -22.297 30.662 7.717 1.0 97.32 227 B 1 +ATOM 4562 C CG . ASN B ? 227 ? -23.346 31.728 8.000 1.0 95.67 227 B 1 +ATOM 4563 O OD1 . ASN B ? 227 ? -24.018 31.739 9.007 1.0 90.54 227 B 1 +ATOM 4564 N ND2 . ASN B ? 227 ? -23.527 32.662 7.091 1.0 88.6 227 B 1 +ATOM 4565 N N . PHE B ? 228 ? -22.750 29.543 11.172 1.0 98.24 228 B 1 +ATOM 4566 C CA . PHE B ? 228 ? -23.623 28.873 12.138 1.0 98.31 228 B 1 +ATOM 4567 C C . PHE B ? 228 ? -25.114 29.139 11.897 1.0 98.32 228 B 1 +ATOM 4568 O O . PHE B ? 228 ? -25.926 28.231 12.038 1.0 97.4 228 B 1 +ATOM 4569 C CB . PHE B ? 228 ? -23.227 29.292 13.558 1.0 97.97 228 B 1 +ATOM 4570 C CG . PHE B ? 228 ? -21.833 28.864 13.966 1.0 98.12 228 B 1 +ATOM 4571 C CD1 . PHE B ? 228 ? -21.518 27.498 14.062 1.0 96.86 228 B 1 +ATOM 4572 C CD2 . PHE B ? 228 ? -20.845 29.823 14.258 1.0 96.87 228 B 1 +ATOM 4573 C CE1 . PHE B ? 228 ? -20.228 27.090 14.444 1.0 96.01 228 B 1 +ATOM 4574 C CE2 . PHE B ? 228 ? -19.554 29.423 14.642 1.0 96.05 228 B 1 +ATOM 4575 C CZ . PHE B ? 228 ? -19.244 28.052 14.736 1.0 96.93 228 B 1 +ATOM 4576 N N . GLU B ? 229 ? -25.493 30.350 11.476 1.0 98.26 229 B 1 +ATOM 4577 C CA . GLU B ? 229 ? -26.893 30.696 11.191 1.0 98.1 229 B 1 +ATOM 4578 C C . GLU B ? 229 ? -27.441 29.981 9.951 1.0 98.23 229 B 1 +ATOM 4579 O O . GLU B ? 229 ? -28.652 29.783 9.820 1.0 97.1 229 B 1 +ATOM 4580 C CB . GLU B ? 229 ? -27.018 32.201 10.953 1.0 97.39 229 B 1 +ATOM 4581 C CG . GLU B ? 229 ? -26.646 33.059 12.166 1.0 87.29 229 B 1 +ATOM 4582 C CD . GLU B ? 229 ? -26.905 34.548 11.914 1.0 78.63 229 B 1 +ATOM 4583 O OE1 . GLU B ? 229 ? -26.775 35.319 12.889 1.0 70.02 229 B 1 +ATOM 4584 O OE2 . GLU B ? 229 ? -27.242 34.905 10.754 1.0 70.45 229 B 1 +ATOM 4585 N N . LYS B ? 230 ? -26.565 29.605 9.033 1.0 98.08 230 B 1 +ATOM 4586 C CA . LYS B ? 230 ? -26.933 28.935 7.787 1.0 98.11 230 B 1 +ATOM 4587 C C . LYS B ? 230 ? -27.099 27.426 7.967 1.0 98.41 230 B 1 +ATOM 4588 O O . LYS B ? 230 ? -27.900 26.834 7.252 1.0 97.78 230 B 1 +ATOM 4589 C CB . LYS B ? 230 ? -25.899 29.293 6.711 1.0 97.03 230 B 1 +ATOM 4590 C CG . LYS B ? 230 ? -26.442 29.118 5.289 1.0 89.39 230 B 1 +ATOM 4591 C CD . LYS B ? 230 ? -25.379 29.505 4.256 1.0 88.52 230 B 1 +ATOM 4592 C CE . LYS B ? 230 ? -25.943 29.372 2.836 1.0 80.7 230 B 1 +ATOM 4593 N NZ . LYS B ? 230 ? -24.904 29.613 1.811 1.0 73.47 230 B 1 +ATOM 4594 N N . ILE B ? 231 ? -26.389 26.815 8.917 1.0 98.39 231 B 1 +ATOM 4595 C CA . ILE B ? 231 ? -26.370 25.358 9.149 1.0 98.53 231 B 1 +ATOM 4596 C C . ILE B ? 231 ? -27.778 24.742 9.207 1.0 98.52 231 B 1 +ATOM 4597 O O . ILE B ? 231 ? -28.055 23.854 8.400 1.0 98.23 231 B 1 +ATOM 4598 C CB . ILE B ? 231 ? -25.495 24.990 10.373 1.0 98.43 231 B 1 +ATOM 4599 C CG1 . ILE B ? 231 ? -24.014 25.282 10.057 1.0 97.88 231 B 1 +ATOM 4600 C CG2 . ILE B ? 231 ? -25.676 23.512 10.775 1.0 98.06 231 B 1 +ATOM 4601 C CD1 . ILE B ? 231 ? -23.041 25.021 11.215 1.0 96.65 231 B 1 +ATOM 4602 N N . PRO B ? 232 ? -28.713 25.205 10.068 1.0 98.36 232 B 1 +ATOM 4603 C CA . PRO B ? 232 ? -30.042 24.587 10.178 1.0 98.06 232 B 1 +ATOM 4604 C C . PRO B ? 232 ? -30.940 24.812 8.951 1.0 98.15 232 B 1 +ATOM 4605 O O . PRO B ? 232 ? -31.980 24.172 8.819 1.0 97.3 232 B 1 +ATOM 4606 C CB . PRO B ? 232 ? -30.653 25.183 11.454 1.0 97.13 232 B 1 +ATOM 4607 C CG . PRO B ? 232 ? -29.965 26.539 11.600 1.0 94.82 232 B 1 +ATOM 4608 C CD . PRO B ? 232 ? -28.564 26.261 11.069 1.0 97.6 232 B 1 +ATOM 4609 N N . LYS B ? 233 ? -30.560 25.700 8.044 1.0 98.24 233 B 1 +ATOM 4610 C CA . LYS B ? 233 ? -31.318 26.054 6.829 1.0 98.1 233 B 1 +ATOM 4611 C C . LYS B ? 233 ? -30.800 25.356 5.569 1.0 98.21 233 B 1 +ATOM 4612 O O . LYS B ? 233 ? -31.380 25.530 4.496 1.0 96.87 233 B 1 +ATOM 4613 C CB . LYS B ? 233 ? -31.307 27.583 6.649 1.0 97.44 233 B 1 +ATOM 4614 C CG . LYS B ? 233 ? -31.902 28.339 7.852 1.0 95.11 233 B 1 +ATOM 4615 C CD . LYS B ? 233 ? -31.778 29.858 7.655 1.0 91.32 233 B 1 +ATOM 4616 C CE . LYS B ? 233 ? -32.256 30.575 8.925 1.0 83.68 233 B 1 +ATOM 4617 N NZ . LYS B ? 233 ? -31.896 32.015 8.937 1.0 74.49 233 B 1 +ATOM 4618 N N . LEU B ? 234 ? -29.709 24.615 5.666 1.0 98.33 234 B 1 +ATOM 4619 C CA . LEU B ? 234 ? -29.122 23.921 4.522 1.0 98.47 234 B 1 +ATOM 4620 C C . LEU B ? 234 ? -30.043 22.808 4.021 1.0 98.52 234 B 1 +ATOM 4621 O O . LEU B ? 234 ? -30.702 22.119 4.797 1.0 98.11 234 B 1 +ATOM 4622 C CB . LEU B ? 234 ? -27.727 23.381 4.864 1.0 98.28 234 B 1 +ATOM 4623 C CG . LEU B ? 234 ? -26.674 24.469 5.137 1.0 97.56 234 B 1 +ATOM 4624 C CD1 . LEU B ? 234 ? -25.348 23.809 5.492 1.0 96.99 234 B 1 +ATOM 4625 C CD2 . LEU B ? 234 ? -26.443 25.389 3.935 1.0 96.82 234 B 1 +ATOM 4626 N N . LYS B ? 235 ? -30.056 22.609 2.703 1.0 98.37 235 B 1 +ATOM 4627 C CA . LYS B ? 235 ? -30.733 21.466 2.088 1.0 98.36 235 B 1 +ATOM 4628 C C . LYS B ? 235 ? -29.926 20.188 2.325 1.0 98.65 235 B 1 +ATOM 4629 O O . LYS B ? 235 ? -28.697 20.266 2.412 1.0 98.27 235 B 1 +ATOM 4630 C CB . LYS B ? 235 ? -30.962 21.710 0.593 1.0 97.29 235 B 1 +ATOM 4631 C CG . LYS B ? 235 ? -31.978 22.836 0.344 1.0 85.45 235 B 1 +ATOM 4632 C CD . LYS B ? 235 ? -32.294 22.947 -1.152 1.0 79.17 235 B 1 +ATOM 4633 C CE . LYS B ? 235 ? -33.347 24.037 -1.387 1.0 66.01 235 B 1 +ATOM 4634 N NZ . LYS B ? 235 ? -33.747 24.109 -2.817 1.0 55.97 235 B 1 +ATOM 4635 N N . PRO B ? 236 ? -30.599 19.027 2.354 1.0 98.63 236 B 1 +ATOM 4636 C CA . PRO B ? 236 ? -29.922 17.737 2.301 1.0 98.68 236 B 1 +ATOM 4637 C C . PRO B ? 236 ? -28.947 17.675 1.118 1.0 98.72 236 B 1 +ATOM 4638 O O . PRO B ? 236 ? -29.261 18.156 0.027 1.0 98.36 236 B 1 +ATOM 4639 C CB . PRO B ? 236 ? -31.029 16.694 2.177 1.0 98.31 236 B 1 +ATOM 4640 C CG . PRO B ? 236 ? -32.246 17.381 2.781 1.0 96.31 236 B 1 +ATOM 4641 C CD . PRO B ? 236 ? -32.041 18.839 2.387 1.0 98.32 236 B 1 +ATOM 4642 N N . ALA B ? 237 ? -27.768 17.106 1.333 1.0 98.68 237 B 1 +ATOM 4643 C CA . ALA B ? 237 ? -26.694 17.083 0.339 1.0 98.65 237 B 1 +ATOM 4644 C C . ALA B ? 237 ? -26.694 15.831 -0.554 1.0 98.63 237 B 1 +ATOM 4645 O O . ALA B ? 237 ? -26.137 15.870 -1.649 1.0 98.07 237 B 1 +ATOM 4646 C CB . ALA B ? 237 ? -25.359 17.246 1.075 1.0 98.48 237 B 1 +ATOM 4647 N N . PHE B ? 238 ? -27.300 14.737 -0.095 1.0 98.71 238 B 1 +ATOM 4648 C CA . PHE B ? 238 ? -27.187 13.428 -0.752 1.0 98.66 238 B 1 +ATOM 4649 C C . PHE B ? 238 ? -28.529 12.826 -1.161 1.0 98.5 238 B 1 +ATOM 4650 O O . PHE B ? 238 ? -28.662 12.340 -2.285 1.0 97.34 238 B 1 +ATOM 4651 C CB . PHE B ? 238 ? -26.422 12.477 0.169 1.0 98.56 238 B 1 +ATOM 4652 C CG . PHE B ? 238 ? -25.010 12.922 0.465 1.0 98.73 238 B 1 +ATOM 4653 C CD1 . PHE B ? 238 ? -23.990 12.697 -0.476 1.0 98.37 238 B 1 +ATOM 4654 C CD2 . PHE B ? 238 ? -24.709 13.601 1.660 1.0 98.37 238 B 1 +ATOM 4655 C CE1 . PHE B ? 238 ? -22.680 13.133 -0.222 1.0 98.13 238 B 1 +ATOM 4656 C CE2 . PHE B ? 238 ? -23.398 14.043 1.920 1.0 98.07 238 B 1 +ATOM 4657 C CZ . PHE B ? 238 ? -22.384 13.805 0.978 1.0 98.38 238 B 1 +ATOM 4658 N N . THR B ? 239 ? -29.527 12.857 -0.283 1.0 98.5 239 B 1 +ATOM 4659 C CA . THR B ? 239 ? -30.884 12.370 -0.557 1.0 98.34 239 B 1 +ATOM 4660 C C . THR B ? 239 ? -31.902 13.463 -0.242 1.0 98.34 239 B 1 +ATOM 4661 O O . THR B ? 239 ? -31.692 14.291 0.637 1.0 97.66 239 B 1 +ATOM 4662 C CB . THR B ? 239 ? -31.203 11.066 0.194 1.0 97.74 239 B 1 +ATOM 4663 O OG1 . THR B ? 239 ? -31.273 11.268 1.573 1.0 92.84 239 B 1 +ATOM 4664 C CG2 . THR B ? 239 ? -30.161 9.976 -0.056 1.0 92.03 239 B 1 +ATOM 4665 N N . SER B ? 240 ? -33.010 13.489 -0.983 1.0 98.05 240 B 1 +ATOM 4666 C CA . SER B ? 240 ? -34.003 14.569 -0.887 1.0 97.54 240 B 1 +ATOM 4667 C C . SER B ? 240 ? -34.670 14.675 0.487 1.0 97.44 240 B 1 +ATOM 4668 O O . SER B ? 240 ? -35.005 15.773 0.919 1.0 95.11 240 B 1 +ATOM 4669 C CB . SER B ? 240 ? -35.067 14.400 -1.974 1.0 96.38 240 B 1 +ATOM 4670 O OG . SER B ? 240 ? -35.434 13.046 -2.135 1.0 84.3 240 B 1 +ATOM 4671 N N . GLU B ? 241 ? -34.817 13.552 1.192 1.0 97.27 241 B 1 +ATOM 4672 C CA . GLU B ? 241 ? -35.353 13.472 2.559 1.0 96.67 241 B 1 +ATOM 4673 C C . GLU B ? 241 ? -34.262 13.196 3.607 1.0 97.37 241 B 1 +ATOM 4674 O O . GLU B ? 241 ? -34.560 12.830 4.743 1.0 95.29 241 B 1 +ATOM 4675 C CB . GLU B ? 241 ? -36.436 12.390 2.638 1.0 94.61 241 B 1 +ATOM 4676 C CG . GLU B ? 241 ? -37.617 12.608 1.693 1.0 85.69 241 B 1 +ATOM 4677 C CD . GLU B ? 241 ? -38.743 11.587 1.933 1.0 73.79 241 B 1 +ATOM 4678 O OE1 . GLU B ? 241 ? -39.804 11.744 1.290 1.0 65.33 241 B 1 +ATOM 4679 O OE2 . GLU B ? 241 ? -38.552 10.643 2.755 1.0 66.98 241 B 1 +ATOM 4680 N N . GLY B ? 242 ? -33.003 13.342 3.230 1.0 97.95 242 B 1 +ATOM 4681 C CA . GLY B ? 242 ? -31.873 13.068 4.098 1.0 98.26 242 B 1 +ATOM 4682 C C . GLY B ? 242 ? -31.656 14.132 5.173 1.0 98.63 242 B 1 +ATOM 4683 O O . GLY B ? 242 ? -32.160 15.254 5.106 1.0 98.28 242 B 1 +ATOM 4684 N N . SER B ? 243 ? -30.861 13.783 6.163 1.0 98.71 243 B 1 +ATOM 4685 C CA . SER B ? 243 ? -30.453 14.664 7.262 1.0 98.75 243 B 1 +ATOM 4686 C C . SER B ? 243 ? -29.008 15.151 7.137 1.0 98.79 243 B 1 +ATOM 4687 O O . SER B ? 243 ? -28.632 16.145 7.757 1.0 98.46 243 B 1 +ATOM 4688 C CB . SER B ? 243 ? -30.672 13.936 8.589 1.0 98.56 243 B 1 +ATOM 4689 O OG . SER B ? 243 ? -30.012 12.689 8.601 1.0 98.08 243 B 1 +ATOM 4690 N N . VAL B ? 244 ? -28.202 14.482 6.318 1.0 98.88 244 B 1 +ATOM 4691 C CA . VAL B ? 244 ? -26.811 14.862 6.067 1.0 98.9 244 B 1 +ATOM 4692 C C . VAL B ? 244 ? -26.755 16.069 5.129 1.0 98.89 244 B 1 +ATOM 4693 O O . VAL B ? 244 ? -27.368 16.094 4.061 1.0 98.78 244 B 1 +ATOM 4694 C CB . VAL B ? 244 ? -25.989 13.680 5.532 1.0 98.86 244 B 1 +ATOM 4695 C CG1 . VAL B ? 244 ? -24.518 14.059 5.366 1.0 98.49 244 B 1 +ATOM 4696 C CG2 . VAL B ? 244 ? -26.043 12.481 6.492 1.0 98.37 244 B 1 +ATOM 4697 N N . THR B ? 245 ? -26.001 17.085 5.537 1.0 98.84 245 B 1 +ATOM 4698 C CA . THR B ? 245 ? -25.818 18.341 4.793 1.0 98.84 245 B 1 +ATOM 4699 C C . THR B ? 245 ? -24.340 18.649 4.583 1.0 98.84 245 B 1 +ATOM 4700 O O . THR B ? 245 ? -23.468 18.001 5.162 1.0 98.66 245 B 1 +ATOM 4701 C CB . THR B ? 245 ? -26.486 19.524 5.507 1.0 98.73 245 B 1 +ATOM 4702 O OG1 . THR B ? 245 ? -25.786 19.871 6.677 1.0 97.94 245 B 1 +ATOM 4703 C CG2 . THR B ? 245 ? -27.944 19.267 5.863 1.0 97.51 245 B 1 +ATOM 4704 N N . ALA B ? 246 ? -24.043 19.677 3.807 1.0 98.78 246 B 1 +ATOM 4705 C CA . ALA B ? 246 ? -22.669 20.137 3.616 1.0 98.73 246 B 1 +ATOM 4706 C C . ALA B ? 246 ? -21.979 20.597 4.918 1.0 98.76 246 B 1 +ATOM 4707 O O . ALA B ? 246 ? -20.756 20.626 4.973 1.0 98.45 246 B 1 +ATOM 4708 C CB . ALA B ? 246 ? -22.681 21.258 2.575 1.0 98.38 246 B 1 +ATOM 4709 N N . ALA B ? 247 ? -22.736 20.959 5.958 1.0 98.76 247 B 1 +ATOM 4710 C CA . ALA B ? 247 ? -22.184 21.437 7.228 1.0 98.75 247 B 1 +ATOM 4711 C C . ALA B ? 247 ? -22.003 20.338 8.292 1.0 98.81 247 B 1 +ATOM 4712 O O . ALA B ? 247 ? -21.189 20.508 9.192 1.0 98.57 247 B 1 +ATOM 4713 C CB . ALA B ? 247 ? -23.074 22.558 7.758 1.0 98.48 247 B 1 +ATOM 4714 N N . ASN B ? 248 ? -22.750 19.233 8.213 1.0 98.82 248 B 1 +ATOM 4715 C CA . ASN B ? 248 ? -22.656 18.104 9.148 1.0 98.85 248 B 1 +ATOM 4716 C C . ASN B ? 248 ? -22.002 16.848 8.534 1.0 98.9 248 B 1 +ATOM 4717 O O . ASN B ? 248 ? -21.946 15.792 9.171 1.0 98.79 248 B 1 +ATOM 4718 C CB . ASN B ? 248 ? -24.027 17.869 9.812 1.0 98.74 248 B 1 +ATOM 4719 C CG . ASN B ? 248 ? -25.093 17.299 8.888 1.0 98.82 248 B 1 +ATOM 4720 O OD1 . ASN B ? 248 ? -24.832 16.612 7.919 1.0 95.28 248 B 1 +ATOM 4721 N ND2 . ASN B ? 248 ? -26.351 17.541 9.190 1.0 94.85 248 B 1 +ATOM 4722 N N . ALA B ? 249 ? -21.487 16.974 7.313 1.0 98.91 249 B 1 +ATOM 4723 C CA . ALA B ? 249 ? -20.600 16.027 6.658 1.0 98.9 249 B 1 +ATOM 4724 C C . ALA B ? 249 ? -19.162 16.563 6.645 1.0 98.9 249 B 1 +ATOM 4725 O O . ALA B ? 249 ? -18.942 17.770 6.659 1.0 98.75 249 B 1 +ATOM 4726 C CB . ALA B ? 249 ? -21.108 15.790 5.233 1.0 98.78 249 B 1 +ATOM 4727 N N . SER B ? 250 ? -18.187 15.671 6.555 1.0 98.89 250 B 1 +ATOM 4728 C CA . SER B ? 250 ? -16.823 16.062 6.202 1.0 98.86 250 B 1 +ATOM 4729 C C . SER B ? 250 ? -16.742 16.515 4.739 1.0 98.83 250 B 1 +ATOM 4730 O O . SER B ? 250 ? -17.575 16.158 3.905 1.0 98.59 250 B 1 +ATOM 4731 C CB . SER B ? 250 ? -15.838 14.927 6.494 1.0 98.72 250 B 1 +ATOM 4732 O OG . SER B ? 250 ? -16.127 13.776 5.730 1.0 98.29 250 B 1 +ATOM 4733 N N . THR B ? 251 ? -15.713 17.285 4.417 1.0 98.77 251 B 1 +ATOM 4734 C CA . THR B ? 251 ? -15.473 17.846 3.082 1.0 98.77 251 B 1 +ATOM 4735 C C . THR B ? 251 ? -14.500 16.998 2.256 1.0 98.79 251 B 1 +ATOM 4736 O O . THR B ? 251 ? -13.954 15.995 2.728 1.0 98.43 251 B 1 +ATOM 4737 C CB . THR B ? 251 ? -14.990 19.297 3.222 1.0 98.48 251 B 1 +ATOM 4738 O OG1 . THR B ? 251 ? -13.980 19.368 4.198 1.0 97.31 251 B 1 +ATOM 4739 C CG2 . THR B ? 251 ? -16.119 20.228 3.671 1.0 97.02 251 B 1 +ATOM 4740 N N . LEU B ? 252 ? -14.290 17.382 1.003 1.0 98.8 252 B 1 +ATOM 4741 C CA . LEU B ? 252 ? -13.216 16.857 0.157 1.0 98.78 252 B 1 +ATOM 4742 C C . LEU B ? 252 ? -11.929 17.615 0.486 1.0 98.78 252 B 1 +ATOM 4743 O O . LEU B ? 252 ? -11.929 18.848 0.439 1.0 98.38 252 B 1 +ATOM 4744 C CB . LEU B ? 252 ? -13.576 17.027 -1.325 1.0 98.55 252 B 1 +ATOM 4745 C CG . LEU B ? 252 ? -14.907 16.394 -1.763 1.0 97.38 252 B 1 +ATOM 4746 C CD1 . LEU B ? 252 ? -15.139 16.668 -3.250 1.0 95.53 252 B 1 +ATOM 4747 C CD2 . LEU B ? 252 ? -14.938 14.884 -1.547 1.0 95.07 252 B 1 +ATOM 4748 N N . ASN B ? 253 ? -10.845 16.905 0.811 1.0 98.85 253 B 1 +ATOM 4749 C CA . ASN B ? 253 ? -9.648 17.550 1.350 1.0 98.91 253 B 1 +ATOM 4750 C C . ASN B ? 253 ? -8.338 16.910 0.881 1.0 98.92 253 B 1 +ATOM 4751 O O . ASN B ? 253 ? -8.308 15.782 0.387 1.0 98.82 253 B 1 +ATOM 4752 C CB . ASN B ? 253 ? -9.742 17.559 2.885 1.0 98.85 253 B 1 +ATOM 4753 C CG . ASN B ? 253 ? -10.905 18.379 3.409 1.0 98.81 253 B 1 +ATOM 4754 O OD1 . ASN B ? 253 ? -11.926 17.848 3.813 1.0 89.11 253 B 1 +ATOM 4755 N ND2 . ASN B ? 253 ? -10.783 19.685 3.418 1.0 89.12 253 B 1 +ATOM 4756 N N . ASP B ? 254 ? -7.252 17.645 1.119 1.0 98.92 254 B 1 +ATOM 4757 C CA . ASP B ? 254 ? -5.879 17.245 0.834 1.0 98.92 254 B 1 +ATOM 4758 C C . ASP B ? 254 ? -5.044 17.280 2.120 1.0 98.94 254 B 1 +ATOM 4759 O O . ASP B ? 254 ? -5.182 18.190 2.938 1.0 98.84 254 B 1 +ATOM 4760 C CB . ASP B ? 254 ? -5.273 18.186 -0.218 1.0 98.84 254 B 1 +ATOM 4761 C CG . ASP B ? 254 ? -6.118 18.342 -1.481 1.0 98.72 254 B 1 +ATOM 4762 O OD1 . ASP B ? 254 ? -6.622 17.325 -2.005 1.0 97.94 254 B 1 +ATOM 4763 O OD2 . ASP B ? 254 ? -6.257 19.476 -1.982 1.0 97.72 254 B 1 +ATOM 4764 N N . GLY B ? 255 ? -4.152 16.309 2.300 1.0 98.92 255 B 1 +ATOM 4765 C CA . GLY B ? 255 ? -3.246 16.287 3.445 1.0 98.94 255 B 1 +ATOM 4766 C C . GLY B ? 255 ? -2.576 14.941 3.693 1.0 98.97 255 B 1 +ATOM 4767 O O . GLY B ? 255 ? -2.911 13.920 3.088 1.0 98.93 255 B 1 +ATOM 4768 N N . ALA B ? 256 ? -1.616 14.935 4.620 1.0 98.96 256 B 1 +ATOM 4769 C CA . ALA B ? 256 ? -0.921 13.727 5.048 1.0 98.97 256 B 1 +ATOM 4770 C C . ALA B ? 256 ? -0.577 13.766 6.541 1.0 98.97 256 B 1 +ATOM 4771 O O . ALA B ? 256 ? -0.296 14.825 7.101 1.0 98.93 256 B 1 +ATOM 4772 C CB . ALA B ? 256 ? 0.328 13.528 4.188 1.0 98.94 256 B 1 +ATOM 4773 N N . ALA B ? 257 ? -0.565 12.596 7.178 1.0 98.96 257 B 1 +ATOM 4774 C CA . ALA B ? 257 ? -0.155 12.408 8.564 1.0 98.97 257 B 1 +ATOM 4775 C C . ALA B ? 257 ? 0.737 11.170 8.683 1.0 98.97 257 B 1 +ATOM 4776 O O . ALA B ? 257 ? 0.423 10.118 8.123 1.0 98.93 257 B 1 +ATOM 4777 C CB . ALA B ? 257 ? -1.394 12.295 9.453 1.0 98.94 257 B 1 +ATOM 4778 N N . MET B ? 258 ? 1.837 11.282 9.426 1.0 98.98 258 B 1 +ATOM 4779 C CA . MET B ? 258 ? 2.811 10.206 9.596 1.0 98.98 258 B 1 +ATOM 4780 C C . MET B ? 258 ? 3.196 10.031 11.063 1.0 98.98 258 B 1 +ATOM 4781 O O . MET B ? 258 ? 3.196 10.983 11.845 1.0 98.92 258 B 1 +ATOM 4782 C CB . MET B ? 258 ? 4.058 10.470 8.744 1.0 98.94 258 B 1 +ATOM 4783 C CG . MET B ? 258 ? 3.778 10.548 7.244 1.0 98.48 258 B 1 +ATOM 4784 S SD . MET B ? 258 ? 3.278 8.998 6.462 1.0 98.26 258 B 1 +ATOM 4785 C CE . MET B ? 258 ? 2.738 9.639 4.867 1.0 94.97 258 B 1 +ATOM 4786 N N . VAL B ? 259 ? 3.560 8.800 11.417 1.0 98.97 259 B 1 +ATOM 4787 C CA . VAL B ? 259 ? 4.090 8.434 12.733 1.0 98.97 259 B 1 +ATOM 4788 C C . VAL B ? 259 ? 5.391 7.654 12.576 1.0 98.97 259 B 1 +ATOM 4789 O O . VAL B ? 259 ? 5.583 6.929 11.601 1.0 98.93 259 B 1 +ATOM 4790 C CB . VAL B ? 259 ? 3.070 7.654 13.588 1.0 98.92 259 B 1 +ATOM 4791 C CG1 . VAL B ? 259 ? 1.815 8.481 13.868 1.0 98.57 259 B 1 +ATOM 4792 C CG2 . VAL B ? 259 ? 2.637 6.323 12.958 1.0 98.09 259 B 1 +ATOM 4793 N N . VAL B ? 260 ? 6.279 7.792 13.557 1.0 98.95 260 B 1 +ATOM 4794 C CA . VAL B ? 260 ? 7.508 7.000 13.671 1.0 98.96 260 B 1 +ATOM 4795 C C . VAL B ? 260 ? 7.336 6.029 14.831 1.0 98.95 260 B 1 +ATOM 4796 O O . VAL B ? 260 ? 6.999 6.436 15.946 1.0 98.9 260 B 1 +ATOM 4797 C CB . VAL B ? 260 ? 8.753 7.883 13.855 1.0 98.92 260 B 1 +ATOM 4798 C CG1 . VAL B ? 260 ? 10.029 7.042 13.791 1.0 98.63 260 B 1 +ATOM 4799 C CG2 . VAL B ? 260 ? 8.846 8.974 12.780 1.0 98.62 260 B 1 +ATOM 4800 N N . MET B ? 261 ? 7.556 4.753 14.557 1.0 98.94 261 B 1 +ATOM 4801 C CA . MET B ? 261 ? 7.334 3.645 15.479 1.0 98.93 261 B 1 +ATOM 4802 C C . MET B ? 261 ? 8.600 2.800 15.631 1.0 98.93 261 B 1 +ATOM 4803 O O . MET B ? 261 ? 9.357 2.599 14.681 1.0 98.79 261 B 1 +ATOM 4804 C CB . MET B ? 261 ? 6.162 2.779 14.993 1.0 98.86 261 B 1 +ATOM 4805 C CG . MET B ? 261 ? 4.846 3.560 14.838 1.0 98.46 261 B 1 +ATOM 4806 S SD . MET B ? 261 ? 3.502 2.624 14.054 1.0 98.4 261 B 1 +ATOM 4807 C CE . MET B ? 261 ? 3.217 1.340 15.294 1.0 94.64 261 B 1 +ATOM 4808 N N . THR B ? 262 ? 8.813 2.290 16.840 1.0 98.83 262 B 1 +ATOM 4809 C CA . THR B ? 262 ? 9.913 1.376 17.159 1.0 98.83 262 B 1 +ATOM 4810 C C . THR B ? 262 ? 9.493 0.458 18.310 1.0 98.79 262 B 1 +ATOM 4811 O O . THR B ? 262 ? 8.337 0.479 18.748 1.0 98.57 262 B 1 +ATOM 4812 C CB . THR B ? 262 ? 11.202 2.178 17.438 1.0 98.73 262 B 1 +ATOM 4813 O OG1 . THR B ? 262 ? 12.313 1.328 17.581 1.0 97.59 262 B 1 +ATOM 4814 C CG2 . THR B ? 262 ? 11.128 3.039 18.701 1.0 97.62 262 B 1 +ATOM 4815 N N . THR B ? 263 ? 10.411 -0.364 18.801 1.0 98.65 263 B 1 +ATOM 4816 C CA . THR B ? 263 ? 10.230 -1.136 20.036 1.0 98.53 263 B 1 +ATOM 4817 C C . THR B ? 263 ? 10.793 -0.372 21.236 1.0 98.55 263 B 1 +ATOM 4818 O O . THR B ? 263 ? 11.587 0.562 21.087 1.0 98.3 263 B 1 +ATOM 4819 C CB . THR B ? 263 ? 10.870 -2.526 19.920 1.0 98.11 263 B 1 +ATOM 4820 O OG1 . THR B ? 263 ? 12.266 -2.415 19.763 1.0 96.51 263 B 1 +ATOM 4821 C CG2 . THR B ? 263 ? 10.317 -3.320 18.735 1.0 96.3 263 B 1 +ATOM 4822 N N . VAL B ? 264 ? 10.428 -0.792 22.449 1.0 98.33 264 B 1 +ATOM 4823 C CA . VAL B ? 264 ? 11.027 -0.258 23.691 1.0 98.18 264 B 1 +ATOM 4824 C C . VAL B ? 264 ? 12.557 -0.374 23.663 1.0 98.23 264 B 1 +ATOM 4825 O O . VAL B ? 264 ? 13.255 0.580 24.017 1.0 97.73 264 B 1 +ATOM 4826 C CB . VAL B ? 264 ? 10.445 -0.989 24.918 1.0 97.39 264 B 1 +ATOM 4827 C CG1 . VAL B ? 264 ? 11.165 -0.622 26.219 1.0 90.75 264 B 1 +ATOM 4828 C CG2 . VAL B ? 264 ? 8.963 -0.634 25.098 1.0 91.31 264 B 1 +ATOM 4829 N N . ASP B ? 265 ? 13.088 -1.498 23.176 1.0 98.04 265 B 1 +ATOM 4830 C CA . ASP B ? 265 ? 14.534 -1.702 23.031 1.0 97.82 265 B 1 +ATOM 4831 C C . ASP B ? 265 ? 15.144 -0.787 21.961 1.0 98.18 265 B 1 +ATOM 4832 O O . ASP B ? 265 ? 16.192 -0.183 22.192 1.0 97.74 265 B 1 +ATOM 4833 C CB . ASP B ? 265 ? 14.829 -3.163 22.673 1.0 96.84 265 B 1 +ATOM 4834 C CG . ASP B ? 265 ? 14.461 -4.148 23.778 1.0 94.4 265 B 1 +ATOM 4835 O OD1 . ASP B ? 265 ? 14.626 -3.792 24.968 1.0 90.59 265 B 1 +ATOM 4836 O OD2 . ASP B ? 265 ? 14.029 -5.260 23.398 1.0 89.36 265 B 1 +ATOM 4837 N N . GLY B ? 266 ? 14.471 -0.626 20.825 1.0 98.03 266 B 1 +ATOM 4838 C CA . GLY B ? 266 ? 14.895 0.276 19.753 1.0 98.22 266 B 1 +ATOM 4839 C C . GLY B ? 266 ? 14.954 1.735 20.212 1.0 98.47 266 B 1 +ATOM 4840 O O . GLY B ? 266 ? 15.931 2.437 19.940 1.0 98.29 266 B 1 +ATOM 4841 N N . ALA B ? 267 ? 13.962 2.175 20.993 1.0 98.48 267 B 1 +ATOM 4842 C CA . ALA B ? 267 ? 13.961 3.516 21.576 1.0 98.57 267 B 1 +ATOM 4843 C C . ALA B ? 267 ? 15.153 3.723 22.532 1.0 98.54 267 B 1 +ATOM 4844 O O . ALA B ? 267 ? 15.859 4.727 22.427 1.0 98.27 267 B 1 +ATOM 4845 C CB . ALA B ? 267 ? 12.619 3.755 22.276 1.0 98.52 267 B 1 +ATOM 4846 N N . LYS B ? 268 ? 15.435 2.751 23.409 1.0 98.45 268 B 1 +ATOM 4847 C CA . LYS B ? 268 ? 16.616 2.789 24.289 1.0 98.32 268 B 1 +ATOM 4848 C C . LYS B ? 268 ? 17.923 2.833 23.501 1.0 98.34 268 B 1 +ATOM 4849 O O . LYS B ? 268 ? 18.771 3.674 23.782 1.0 97.69 268 B 1 +ATOM 4850 C CB . LYS B ? 268 ? 16.625 1.575 25.230 1.0 97.75 268 B 1 +ATOM 4851 C CG . LYS B ? 268 ? 16.023 1.899 26.597 1.0 84.73 268 B 1 +ATOM 4852 C CD . LYS B ? 268 ? 16.106 0.669 27.499 1.0 81.55 268 B 1 +ATOM 4853 C CE . LYS B ? 268 ? 15.621 0.993 28.914 1.0 70.44 268 B 1 +ATOM 4854 N NZ . LYS B ? 268 ? 15.562 -0.230 29.748 1.0 61.84 268 B 1 +ATOM 4855 N N . LYS B ? 269 ? 18.076 1.946 22.524 1.0 98.15 269 B 1 +ATOM 4856 C CA . LYS B ? 269 ? 19.277 1.818 21.691 1.0 98.04 269 B 1 +ATOM 4857 C C . LYS B ? 269 ? 19.617 3.107 20.945 1.0 98.16 269 B 1 +ATOM 4858 O O . LYS B ? 269 ? 20.788 3.458 20.827 1.0 97.49 269 B 1 +ATOM 4859 C CB . LYS B ? 269 ? 19.027 0.659 20.720 1.0 97.31 269 B 1 +ATOM 4860 C CG . LYS B ? 269 ? 20.149 0.404 19.700 1.0 94.09 269 B 1 +ATOM 4861 C CD . LYS B ? 269 ? 19.672 -0.742 18.812 1.0 92.49 269 B 1 +ATOM 4862 C CE . LYS B ? 269 ? 20.537 -0.995 17.586 1.0 85.88 269 B 1 +ATOM 4863 N NZ . LYS B ? 269 ? 19.813 -1.929 16.695 1.0 81.71 269 B 1 +ATOM 4864 N N . HIS B ? 270 ? 18.603 3.816 20.466 1.0 98.24 270 B 1 +ATOM 4865 C CA . HIS B ? 270 ? 18.764 5.057 19.708 1.0 98.18 270 B 1 +ATOM 4866 C C . HIS B ? 270 ? 18.619 6.331 20.561 1.0 98.22 270 B 1 +ATOM 4867 O O . HIS B ? 270 ? 18.685 7.433 20.019 1.0 97.27 270 B 1 +ATOM 4868 C CB . HIS B ? 270 ? 17.820 5.026 18.501 1.0 97.99 270 B 1 +ATOM 4869 C CG . HIS B ? 270 ? 18.210 3.974 17.496 1.0 97.59 270 B 1 +ATOM 4870 N ND1 . HIS B ? 270 ? 19.356 3.987 16.723 1.0 88.62 270 B 1 +ATOM 4871 C CD2 . HIS B ? 270 ? 17.541 2.814 17.204 1.0 89.03 270 B 1 +ATOM 4872 C CE1 . HIS B ? 270 ? 19.367 2.870 15.984 1.0 89.68 270 B 1 +ATOM 4873 N NE2 . HIS B ? 270 ? 18.283 2.132 16.247 1.0 91.55 270 B 1 +ATOM 4874 N N . GLY B ? 271 ? 18.436 6.208 21.883 1.0 98.07 271 B 1 +ATOM 4875 C CA . GLY B ? 271 ? 18.279 7.349 22.791 1.0 97.94 271 B 1 +ATOM 4876 C C . GLY B ? 271 ? 17.012 8.170 22.540 1.0 98.1 271 B 1 +ATOM 4877 O O . GLY B ? 271 ? 16.998 9.378 22.777 1.0 96.95 271 B 1 +ATOM 4878 N N . LEU B ? 272 ? 15.956 7.527 22.050 1.0 98.21 272 B 1 +ATOM 4879 C CA . LEU B ? 272 ? 14.685 8.170 21.728 1.0 98.31 272 B 1 +ATOM 4880 C C . LEU B ? 272 ? 13.763 8.160 22.942 1.0 98.26 272 B 1 +ATOM 4881 O O . LEU B ? 272 ? 13.731 7.204 23.717 1.0 97.54 272 B 1 +ATOM 4882 C CB . LEU B ? 272 ? 14.019 7.466 20.535 1.0 98.25 272 B 1 +ATOM 4883 C CG . LEU B ? 272 ? 14.913 7.318 19.293 1.0 97.92 272 B 1 +ATOM 4884 C CD1 . LEU B ? 272 ? 14.180 6.513 18.228 1.0 97.21 272 B 1 +ATOM 4885 C CD2 . LEU B ? 272 ? 15.311 8.673 18.703 1.0 97.15 272 B 1 +ATOM 4886 N N . LYS B ? 273 ? 12.953 9.212 23.078 1.0 97.81 273 B 1 +ATOM 4887 C CA . LYS B ? 273 ? 11.936 9.292 24.121 1.0 97.45 273 B 1 +ATOM 4888 C C . LYS B ? 273 ? 10.601 8.782 23.578 1.0 98.04 273 B 1 +ATOM 4889 O O . LYS B ? 273 ? 10.009 9.469 22.743 1.0 97.32 273 B 1 +ATOM 4890 C CB . LYS B ? 273 ? 11.867 10.730 24.652 1.0 95.42 273 B 1 +ATOM 4891 C CG . LYS B ? 273 ? 11.045 10.789 25.944 1.0 87.28 273 B 1 +ATOM 4892 C CD . LYS B ? 273 ? 11.041 12.209 26.522 1.0 81.51 273 B 1 +ATOM 4893 C CE . LYS B ? 273 ? 10.262 12.198 27.840 1.0 71.11 273 B 1 +ATOM 4894 N NZ . LYS B ? 273 ? 10.203 13.540 28.459 1.0 61.93 273 B 1 +ATOM 4895 N N . PRO B ? 274 ? 10.086 7.626 24.048 1.0 98.34 274 B 1 +ATOM 4896 C CA . PRO B ? 274 ? 8.757 7.175 23.663 1.0 98.45 274 B 1 +ATOM 4897 C C . PRO B ? 274 ? 7.691 8.178 24.103 1.0 98.58 274 B 1 +ATOM 4898 O O . PRO B ? 274 ? 7.717 8.682 25.226 1.0 98.12 274 B 1 +ATOM 4899 C CB . PRO B ? 274 ? 8.568 5.800 24.307 1.0 97.8 274 B 1 +ATOM 4900 C CG . PRO B ? 274 ? 9.987 5.334 24.608 1.0 95.19 274 B 1 +ATOM 4901 C CD . PRO B ? 274 ? 10.717 6.638 24.904 1.0 97.75 274 B 1 +ATOM 4902 N N . LEU B ? 275 ? 6.739 8.465 23.223 1.0 98.75 275 B 1 +ATOM 4903 C CA . LEU B ? 275 ? 5.618 9.372 23.477 1.0 98.74 275 B 1 +ATOM 4904 C C . LEU B ? 275 ? 4.386 8.616 23.975 1.0 98.77 275 B 1 +ATOM 4905 O O . LEU B ? 275 ? 3.719 9.063 24.905 1.0 98.39 275 B 1 +ATOM 4906 C CB . LEU B ? 275 ? 5.297 10.161 22.194 1.0 98.61 275 B 1 +ATOM 4907 C CG . LEU B ? 275 ? 6.446 11.022 21.637 1.0 98.14 275 B 1 +ATOM 4908 C CD1 . LEU B ? 275 ? 5.994 11.693 20.345 1.0 97.28 275 B 1 +ATOM 4909 C CD2 . LEU B ? 275 ? 6.880 12.113 22.620 1.0 96.95 275 B 1 +ATOM 4910 N N . ALA B ? 276 ? 4.105 7.469 23.363 1.0 98.78 276 B 1 +ATOM 4911 C CA . ALA B ? 276 ? 3.015 6.574 23.733 1.0 98.86 276 B 1 +ATOM 4912 C C . ALA B ? 276 ? 3.359 5.126 23.359 1.0 98.89 276 B 1 +ATOM 4913 O O . ALA B ? 276 ? 4.172 4.889 22.465 1.0 98.78 276 B 1 +ATOM 4914 C CB . ALA B ? 276 ? 1.732 7.043 23.031 1.0 98.77 276 B 1 +ATOM 4915 N N . ARG B ? 277 ? 2.718 4.151 24.016 1.0 98.78 277 B 1 +ATOM 4916 C CA . ARG B ? 277 ? 2.776 2.728 23.653 1.0 98.72 277 B 1 +ATOM 4917 C C . ARG B ? 277 ? 1.460 2.260 23.041 1.0 98.82 277 B 1 +ATOM 4918 O O . ARG B ? 277 ? 0.395 2.780 23.380 1.0 98.7 277 B 1 +ATOM 4919 C CB . ARG B ? 277 ? 3.191 1.870 24.861 1.0 98.03 277 B 1 +ATOM 4920 C CG . ARG B ? 277 ? 2.166 1.898 26.005 1.0 95.02 277 B 1 +ATOM 4921 C CD . ARG B ? 277 ? 2.610 1.058 27.209 1.0 93.96 277 B 1 +ATOM 4922 N NE . ARG B ? 277 ? 3.854 1.593 27.806 1.0 88.5 277 B 1 +ATOM 4923 C CZ . ARG B ? 277 ? 4.472 1.131 28.873 1.0 87.53 277 B 1 +ATOM 4924 N NH1 . ARG B ? 277 ? 4.015 0.124 29.546 1.0 78.95 277 B 1 +ATOM 4925 N NH2 . ARG B ? 277 ? 5.576 1.688 29.278 1.0 79.18 277 B 1 +ATOM 4926 N N . MET B ? 278 ? 1.530 1.251 22.189 1.0 98.74 278 B 1 +ATOM 4927 C CA . MET B ? 278 ? 0.349 0.563 21.669 1.0 98.71 278 B 1 +ATOM 4928 C C . MET B ? 278 ? -0.224 -0.368 22.748 1.0 98.66 278 B 1 +ATOM 4929 O O . MET B ? 278 ? 0.524 -1.114 23.376 1.0 98.25 278 B 1 +ATOM 4930 C CB . MET B ? 278 ? 0.753 -0.208 20.405 1.0 98.46 278 B 1 +ATOM 4931 C CG . MET B ? 278 ? -0.443 -0.793 19.650 1.0 96.57 278 B 1 +ATOM 4932 S SD . MET B ? 278 ? -1.527 0.420 18.848 1.0 96.7 278 B 1 +ATOM 4933 C CE . MET B ? 278 ? -0.483 0.894 17.452 1.0 92.99 278 B 1 +ATOM 4934 N N . LEU B ? 279 ? -1.539 -0.344 22.958 1.0 98.67 279 B 1 +ATOM 4935 C CA . LEU B ? 279 ? -2.235 -1.298 23.834 1.0 98.6 279 B 1 +ATOM 4936 C C . LEU B ? 279 ? -3.082 -2.299 23.043 1.0 98.39 279 B 1 +ATOM 4937 O O . LEU B ? 279 ? -3.182 -3.459 23.427 1.0 97.81 279 B 1 +ATOM 4938 C CB . LEU B ? 279 ? -3.105 -0.560 24.863 1.0 98.62 279 B 1 +ATOM 4939 C CG . LEU B ? 279 ? -2.375 0.399 25.817 1.0 98.2 279 B 1 +ATOM 4940 C CD1 . LEU B ? 279 ? -3.378 0.934 26.840 1.0 97.64 279 B 1 +ATOM 4941 C CD2 . LEU B ? 279 ? -1.233 -0.267 26.578 1.0 97.43 279 B 1 +ATOM 4942 N N . ALA B ? 280 ? -3.694 -1.853 21.949 1.0 98.63 280 B 1 +ATOM 4943 C CA . ALA B ? 280 ? -4.446 -2.711 21.042 1.0 98.66 280 B 1 +ATOM 4944 C C . ALA B ? 280 ? -4.598 -2.066 19.664 1.0 98.75 280 B 1 +ATOM 4945 O O . ALA B ? 280 ? -4.659 -0.844 19.534 1.0 98.63 280 B 1 +ATOM 4946 C CB . ALA B ? 280 ? -5.830 -2.998 21.641 1.0 98.41 280 B 1 +ATOM 4947 N N . TYR B ? 281 ? -4.745 -2.900 18.647 1.0 98.72 281 B 1 +ATOM 4948 C CA . TYR B ? 281 ? -5.221 -2.518 17.321 1.0 98.64 281 B 1 +ATOM 4949 C C . TYR B ? 281 ? -6.147 -3.610 16.789 1.0 98.56 281 B 1 +ATOM 4950 O O . TYR B ? 281 ? -6.017 -4.781 17.155 1.0 98.12 281 B 1 +ATOM 4951 C CB . TYR B ? 281 ? -4.044 -2.237 16.374 1.0 98.49 281 B 1 +ATOM 4952 C CG . TYR B ? 281 ? -3.090 -3.401 16.176 1.0 98.53 281 B 1 +ATOM 4953 C CD1 . TYR B ? 281 ? -1.957 -3.534 17.007 1.0 98.1 281 B 1 +ATOM 4954 C CD2 . TYR B ? 281 ? -3.325 -4.355 15.169 1.0 98.06 281 B 1 +ATOM 4955 C CE1 . TYR B ? 281 ? -1.068 -4.605 16.836 1.0 97.72 281 B 1 +ATOM 4956 C CE2 . TYR B ? 281 ? -2.441 -5.436 14.988 1.0 97.69 281 B 1 +ATOM 4957 C CZ . TYR B ? 281 ? -1.312 -5.556 15.827 1.0 97.85 281 B 1 +ATOM 4958 O OH . TYR B ? 281 ? -0.449 -6.607 15.660 1.0 96.95 281 B 1 +ATOM 4959 N N . GLY B ? 282 ? -7.101 -3.239 15.952 1.0 98.68 282 B 1 +ATOM 4960 C CA . GLY B ? 282 ? -8.053 -4.192 15.403 1.0 98.66 282 B 1 +ATOM 4961 C C . GLY B ? 282 ? -8.959 -3.581 14.349 1.0 98.81 282 B 1 +ATOM 4962 O O . GLY B ? 282 ? -8.974 -2.371 14.124 1.0 98.62 282 B 1 +ATOM 4963 N N . ASP B ? 283 ? -9.735 -4.452 13.723 1.0 98.79 283 B 1 +ATOM 4964 C CA . ASP B ? 283 ? -10.682 -4.091 12.683 1.0 98.74 283 B 1 +ATOM 4965 C C . ASP B ? 283 ? -12.022 -4.794 12.933 1.0 98.75 283 B 1 +ATOM 4966 O O . ASP B ? 283 ? -12.090 -5.897 13.486 1.0 98.3 283 B 1 +ATOM 4967 C CB . ASP B ? 283 ? -10.111 -4.469 11.308 1.0 98.37 283 B 1 +ATOM 4968 C CG . ASP B ? 283 ? -8.840 -3.710 10.912 1.0 97.02 283 B 1 +ATOM 4969 O OD1 . ASP B ? 283 ? -8.974 -2.575 10.402 1.0 91.93 283 B 1 +ATOM 4970 O OD2 . ASP B ? 283 ? -7.737 -4.287 10.989 1.0 91.24 283 B 1 +ATOM 4971 N N . ALA B ? 284 ? -13.102 -4.157 12.499 1.0 98.76 284 B 1 +ATOM 4972 C CA . ALA B ? 284 ? -14.428 -4.747 12.401 1.0 98.75 284 B 1 +ATOM 4973 C C . ALA B ? 284 ? -15.034 -4.412 11.036 1.0 98.78 284 B 1 +ATOM 4974 O O . ALA B ? 284 ? -14.636 -3.443 10.391 1.0 98.37 284 B 1 +ATOM 4975 C CB . ALA B ? 284 ? -15.298 -4.258 13.562 1.0 98.41 284 B 1 +ATOM 4976 N N . ALA B ? 285 ? -15.999 -5.207 10.594 1.0 98.66 285 B 1 +ATOM 4977 C CA . ALA B ? 285 ? -16.739 -4.946 9.370 1.0 98.67 285 B 1 +ATOM 4978 C C . ALA B ? 285 ? -18.181 -5.451 9.475 1.0 98.66 285 B 1 +ATOM 4979 O O . ALA B ? 285 ? -18.490 -6.346 10.262 1.0 98.2 285 B 1 +ATOM 4980 C CB . ALA B ? 285 ? -15.984 -5.554 8.178 1.0 98.37 285 B 1 +ATOM 4981 N N . THR B ? 286 ? -19.061 -4.845 8.672 1.0 98.58 286 B 1 +ATOM 4982 C CA . THR B ? 286 ? -20.486 -5.167 8.555 1.0 98.56 286 B 1 +ATOM 4983 C C . THR B ? 286 ? -20.959 -4.914 7.117 1.0 98.59 286 B 1 +ATOM 4984 O O . THR B ? 286 ? -20.133 -4.787 6.203 1.0 98.13 286 B 1 +ATOM 4985 C CB . THR B ? 286 ? -21.279 -4.374 9.614 1.0 98.13 286 B 1 +ATOM 4986 O OG1 . THR B ? 286 ? -22.615 -4.829 9.636 1.0 96.31 286 B 1 +ATOM 4987 C CG2 . THR B ? 286 ? -21.298 -2.861 9.392 1.0 95.91 286 B 1 +ATOM 4988 N N . HIS B ? 287 ? -22.266 -4.852 6.888 1.0 98.44 287 B 1 +ATOM 4989 C CA . HIS B ? 287 ? -22.813 -4.534 5.570 1.0 98.39 287 B 1 +ATOM 4990 C C . HIS B ? 287 ? -22.276 -3.192 5.047 1.0 98.49 287 B 1 +ATOM 4991 O O . HIS B ? 287 ? -22.227 -2.222 5.802 1.0 98.19 287 B 1 +ATOM 4992 C CB . HIS B ? 287 ? -24.343 -4.519 5.623 1.0 98.12 287 B 1 +ATOM 4993 C CG . HIS B ? 287 ? -24.923 -5.885 5.847 1.0 95.81 287 B 1 +ATOM 4994 N ND1 . HIS B ? 287 ? -25.018 -6.887 4.905 1.0 84.5 287 B 1 +ATOM 4995 C CD2 . HIS B ? 287 ? -25.415 -6.395 7.025 1.0 84.81 287 B 1 +ATOM 4996 C CE1 . HIS B ? 287 ? -25.561 -7.963 5.498 1.0 87.12 287 B 1 +ATOM 4997 N NE2 . HIS B ? 287 ? -25.811 -7.704 6.789 1.0 88.21 287 B 1 +ATOM 4998 N N . PRO B ? 288 ? -21.907 -3.096 3.759 1.0 98.38 288 B 1 +ATOM 4999 C CA . PRO B ? 288 ? -21.284 -1.897 3.185 1.0 98.33 288 B 1 +ATOM 5000 C C . PRO B ? 288 ? -22.024 -0.587 3.479 1.0 98.39 288 B 1 +ATOM 5001 O O . PRO B ? 288 ? -21.409 0.396 3.896 1.0 98.24 288 B 1 +ATOM 5002 C CB . PRO B ? 288 ? -21.209 -2.183 1.685 1.0 98.2 288 B 1 +ATOM 5003 C CG . PRO B ? 288 ? -21.001 -3.694 1.637 1.0 97.73 288 B 1 +ATOM 5004 C CD . PRO B ? 288 ? -21.880 -4.186 2.784 1.0 98.39 288 B 1 +ATOM 5005 N N . ILE B ? 289 ? -23.350 -0.593 3.338 1.0 98.53 289 B 1 +ATOM 5006 C CA . ILE B ? 289 ? -24.201 0.583 3.579 1.0 98.61 289 B 1 +ATOM 5007 C C . ILE B ? 289 ? -24.182 1.052 5.044 1.0 98.67 289 B 1 +ATOM 5008 O O . ILE B ? 289 ? -24.491 2.206 5.335 1.0 98.4 289 B 1 +ATOM 5009 C CB . ILE B ? 289 ? -25.632 0.279 3.079 1.0 98.37 289 B 1 +ATOM 5010 C CG1 . ILE B ? 289 ? -26.424 1.586 2.881 1.0 96.85 289 B 1 +ATOM 5011 C CG2 . ILE B ? 289 ? -26.388 -0.697 4.015 1.0 96.49 289 B 1 +ATOM 5012 C CD1 . ILE B ? 289 ? -27.751 1.405 2.130 1.0 94.77 289 B 1 +ATOM 5013 N N . ASP B ? 290 ? -23.795 0.176 5.968 1.0 98.69 290 B 1 +ATOM 5014 C CA . ASP B ? 290 ? -23.791 0.423 7.407 1.0 98.7 290 B 1 +ATOM 5015 C C . ASP B ? 290 ? -22.402 0.792 7.955 1.0 98.74 290 B 1 +ATOM 5016 O O . ASP B ? 290 ? -22.174 0.700 9.163 1.0 98.41 290 B 1 +ATOM 5017 C CB . ASP B ? 290 ? -24.437 -0.774 8.132 1.0 98.54 290 B 1 +ATOM 5018 C CG . ASP B ? 290 ? -25.947 -0.835 7.896 1.0 98.36 290 B 1 +ATOM 5019 O OD1 . ASP B ? 290 ? -26.602 0.225 8.017 1.0 96.92 290 B 1 +ATOM 5020 O OD2 . ASP B ? 290 ? -26.499 -1.909 7.595 1.0 96.88 290 B 1 +ATOM 5021 N N . PHE B ? 291 ? -21.479 1.266 7.117 1.0 98.73 291 B 1 +ATOM 5022 C CA . PHE B ? 291 ? -20.139 1.662 7.585 1.0 98.73 291 B 1 +ATOM 5023 C C . PHE B ? 291 ? -20.178 2.632 8.783 1.0 98.79 291 B 1 +ATOM 5024 O O . PHE B ? 291 ? -19.289 2.597 9.635 1.0 98.6 291 B 1 +ATOM 5025 C CB . PHE B ? 291 ? -19.319 2.270 6.433 1.0 98.5 291 B 1 +ATOM 5026 C CG . PHE B ? 291 ? -19.728 3.671 6.016 1.0 98.56 291 B 1 +ATOM 5027 C CD1 . PHE B ? 291 ? -20.536 3.867 4.888 1.0 97.48 291 B 1 +ATOM 5028 C CD2 . PHE B ? 291 ? -19.349 4.788 6.791 1.0 97.43 291 B 1 +ATOM 5029 C CE1 . PHE B ? 291 ? -20.982 5.158 4.551 1.0 96.46 291 B 1 +ATOM 5030 C CE2 . PHE B ? 291 ? -19.799 6.080 6.466 1.0 96.15 291 B 1 +ATOM 5031 C CZ . PHE B ? 291 ? -20.624 6.259 5.346 1.0 97.13 291 B 1 +ATOM 5032 N N . GLY B ? 292 ? -21.207 3.463 8.872 1.0 98.67 292 B 1 +ATOM 5033 C CA . GLY B ? 292 ? -21.366 4.449 9.944 1.0 98.67 292 B 1 +ATOM 5034 C C . GLY B ? 292 ? -21.506 3.845 11.344 1.0 98.78 292 B 1 +ATOM 5035 O O . GLY B ? 292 ? -21.164 4.504 12.328 1.0 98.51 292 B 1 +ATOM 5036 N N . ILE B ? 293 ? -21.946 2.592 11.456 1.0 98.83 293 B 1 +ATOM 5037 C CA . ILE B ? 293 ? -22.085 1.879 12.740 1.0 98.79 293 B 1 +ATOM 5038 C C . ILE B ? 293 ? -20.841 1.056 13.106 1.0 98.82 293 B 1 +ATOM 5039 O O . ILE B ? 293 ? -20.689 0.643 14.255 1.0 98.46 293 B 1 +ATOM 5040 C CB . ILE B ? 293 ? -23.378 1.030 12.790 1.0 98.44 293 B 1 +ATOM 5041 C CG1 . ILE B ? 293 ? -23.281 -0.266 11.958 1.0 96.68 293 B 1 +ATOM 5042 C CG2 . ILE B ? 293 ? -24.598 1.878 12.363 1.0 95.54 293 B 1 +ATOM 5043 C CD1 . ILE B ? 293 ? -24.474 -1.216 12.120 1.0 94.37 293 B 1 +ATOM 5044 N N . ALA B ? 294 ? -19.934 0.822 12.155 1.0 98.84 294 B 1 +ATOM 5045 C CA . ALA B ? 294 ? -18.779 -0.051 12.353 1.0 98.86 294 B 1 +ATOM 5046 C C . ALA B ? 294 ? -17.792 0.417 13.452 1.0 98.89 294 B 1 +ATOM 5047 O O . ALA B ? 294 ? -17.239 -0.449 14.139 1.0 98.81 294 B 1 +ATOM 5048 C CB . ALA B ? 294 ? -18.100 -0.293 10.995 1.0 98.77 294 B 1 +ATOM 5049 N N . PRO B ? 295 ? -17.599 1.724 13.728 1.0 98.9 295 B 1 +ATOM 5050 C CA . PRO B ? 295 ? -16.820 2.169 14.891 1.0 98.91 295 B 1 +ATOM 5051 C C . PRO B ? 295 ? -17.356 1.636 16.224 1.0 98.92 295 B 1 +ATOM 5052 O O . PRO B ? 295 ? -16.571 1.212 17.074 1.0 98.87 295 B 1 +ATOM 5053 C CB . PRO B ? 295 ? -16.837 3.699 14.842 1.0 98.86 295 B 1 +ATOM 5054 C CG . PRO B ? 295 ? -16.987 3.986 13.351 1.0 98.47 295 B 1 +ATOM 5055 C CD . PRO B ? 295 ? -17.923 2.868 12.895 1.0 98.85 295 B 1 +ATOM 5056 N N . ALA B ? 296 ? -18.681 1.563 16.385 1.0 98.88 296 B 1 +ATOM 5057 C CA . ALA B ? 296 ? -19.302 0.994 17.584 1.0 98.86 296 B 1 +ATOM 5058 C C . ALA B ? 296 ? -19.043 -0.519 17.739 1.0 98.85 296 B 1 +ATOM 5059 O O . ALA B ? 296 ? -19.140 -1.048 18.845 1.0 98.57 296 B 1 +ATOM 5060 C CB . ALA B ? 296 ? -20.802 1.307 17.560 1.0 98.71 296 B 1 +ATOM 5061 N N . SER B ? 297 ? -18.668 -1.211 16.661 1.0 98.85 297 B 1 +ATOM 5062 C CA . SER B ? 297 ? -18.277 -2.627 16.681 1.0 98.78 297 B 1 +ATOM 5063 C C . SER B ? 297 ? -16.778 -2.828 16.930 1.0 98.85 297 B 1 +ATOM 5064 O O . SER B ? 297 ? -16.391 -3.783 17.601 1.0 98.58 297 B 1 +ATOM 5065 C CB . SER B ? 297 ? -18.663 -3.303 15.365 1.0 98.3 297 B 1 +ATOM 5066 O OG . SER B ? 297 ? -20.059 -3.229 15.163 1.0 90.84 297 B 1 +ATOM 5067 N N . VAL B ? 298 ? -15.921 -1.949 16.411 1.0 98.88 298 B 1 +ATOM 5068 C CA . VAL B ? 298 ? -14.465 -2.078 16.598 1.0 98.91 298 B 1 +ATOM 5069 C C . VAL B ? 298 ? -14.019 -1.675 18.003 1.0 98.92 298 B 1 +ATOM 5070 O O . VAL B ? 298 ? -13.132 -2.318 18.562 1.0 98.86 298 B 1 +ATOM 5071 C CB . VAL B ? 298 ? -13.672 -1.350 15.496 1.0 98.8 298 B 1 +ATOM 5072 C CG1 . VAL B ? 298 ? -13.547 0.159 15.700 1.0 98.09 298 B 1 +ATOM 5073 C CG2 . VAL B ? 298 ? -12.264 -1.943 15.367 1.0 97.21 298 B 1 +ATOM 5074 N N . ILE B ? 299 ? -14.654 -0.667 18.605 1.0 98.92 299 B 1 +ATOM 5075 C CA . ILE B ? 299 ? -14.295 -0.171 19.942 1.0 98.93 299 B 1 +ATOM 5076 C C . ILE B ? 299 ? -14.373 -1.281 21.008 1.0 98.91 299 B 1 +ATOM 5077 O O . ILE B ? 299 ? -13.368 -1.508 21.683 1.0 98.87 299 B 1 +ATOM 5078 C CB . ILE B ? 299 ? -15.098 1.102 20.296 1.0 98.92 299 B 1 +ATOM 5079 C CG1 . ILE B ? 299 ? -14.554 2.299 19.486 1.0 98.77 299 B 1 +ATOM 5080 C CG2 . ILE B ? 299 ? -15.041 1.408 21.808 1.0 98.78 299 B 1 +ATOM 5081 C CD1 . ILE B ? 299 ? -15.479 3.524 19.499 1.0 98.45 299 B 1 +ATOM 5082 N N . PRO B ? 300 ? -15.477 -2.045 21.147 1.0 98.9 300 B 1 +ATOM 5083 C CA . PRO B ? 300 ? -15.525 -3.175 22.085 1.0 98.84 300 B 1 +ATOM 5084 C C . PRO B ? 300 ? -14.455 -4.239 21.813 1.0 98.79 300 B 1 +ATOM 5085 O O . PRO B ? 300 ? -13.924 -4.844 22.747 1.0 98.55 300 B 1 +ATOM 5086 C CB . PRO B ? 300 ? -16.931 -3.763 21.951 1.0 98.67 300 B 1 +ATOM 5087 C CG . PRO B ? 300 ? -17.767 -2.588 21.457 1.0 97.75 300 B 1 +ATOM 5088 C CD . PRO B ? 300 ? -16.790 -1.840 20.556 1.0 98.72 300 B 1 +ATOM 5089 N N . LYS B ? 301 ? -14.105 -4.460 20.543 1.0 98.8 301 B 1 +ATOM 5090 C CA . LYS B ? 301 ? -13.065 -5.416 20.139 1.0 98.66 301 B 1 +ATOM 5091 C C . LYS B ? 301 ? -11.689 -5.007 20.665 1.0 98.65 301 B 1 +ATOM 5092 O O . LYS B ? 301 ? -11.017 -5.812 21.301 1.0 98.24 301 B 1 +ATOM 5093 C CB . LYS B ? 301 ? -13.052 -5.557 18.605 1.0 98.16 301 B 1 +ATOM 5094 C CG . LYS B ? 301 ? -13.332 -6.981 18.117 1.0 90.24 301 B 1 +ATOM 5095 C CD . LYS B ? 301 ? -13.280 -7.020 16.588 1.0 90.09 301 B 1 +ATOM 5096 C CE . LYS B ? 301 ? -13.540 -8.430 16.036 1.0 82.74 301 B 1 +ATOM 5097 N NZ . LYS B ? 301 ? -13.453 -8.445 14.551 1.0 75.72 301 B 1 +ATOM 5098 N N . VAL B ? 302 ? -11.287 -3.752 20.436 1.0 98.67 302 B 1 +ATOM 5099 C CA . VAL B ? 302 ? -9.970 -3.261 20.880 1.0 98.74 302 B 1 +ATOM 5100 C C . VAL B ? 302 ? -9.908 -3.051 22.396 1.0 98.71 302 B 1 +ATOM 5101 O O . VAL B ? 302 ? -8.881 -3.345 22.998 1.0 98.59 302 B 1 +ATOM 5102 C CB . VAL B ? 302 ? -9.498 -2.007 20.113 1.0 98.69 302 B 1 +ATOM 5103 C CG1 . VAL B ? 302 ? -9.282 -2.343 18.634 1.0 98.15 302 B 1 +ATOM 5104 C CG2 . VAL B ? 302 ? -10.439 -0.807 20.221 1.0 97.2 302 B 1 +ATOM 5105 N N . LEU B ? 303 ? -11.012 -2.654 23.040 1.0 98.8 303 B 1 +ATOM 5106 C CA . LEU B ? 303 ? -11.107 -2.618 24.507 1.0 98.77 303 B 1 +ATOM 5107 C C . LEU B ? 303 ? -10.850 -4.005 25.105 1.0 98.62 303 B 1 +ATOM 5108 O O . LEU B ? 303 ? -10.014 -4.149 25.998 1.0 98.41 303 B 1 +ATOM 5109 C CB . LEU B ? 303 ? -12.491 -2.102 24.937 1.0 98.81 303 B 1 +ATOM 5110 C CG . LEU B ? 303 ? -12.694 -0.583 24.804 1.0 98.57 303 B 1 +ATOM 5111 C CD1 . LEU B ? 303 ? -14.171 -0.251 25.023 1.0 98.23 303 B 1 +ATOM 5112 C CD2 . LEU B ? 303 ? -11.883 0.198 25.836 1.0 98.17 303 B 1 +ATOM 5113 N N . LYS B ? 304 ? -11.506 -5.042 24.570 1.0 98.62 304 B 1 +ATOM 5114 C CA . LYS B ? 304 ? -11.309 -6.423 25.022 1.0 98.43 304 B 1 +ATOM 5115 C C . LYS B ? 304 ? -9.869 -6.904 24.809 1.0 98.22 304 B 1 +ATOM 5116 O O . LYS B ? 304 ? -9.326 -7.572 25.684 1.0 97.7 304 B 1 +ATOM 5117 C CB . LYS B ? 304 ? -12.329 -7.330 24.320 1.0 98.27 304 B 1 +ATOM 5118 C CG . LYS B ? 304 ? -12.295 -8.761 24.879 1.0 94.54 304 B 1 +ATOM 5119 C CD . LYS B ? 304 ? -13.352 -9.636 24.199 1.0 90.03 304 B 1 +ATOM 5120 C CE . LYS B ? 304 ? -13.300 -11.048 24.794 1.0 80.42 304 B 1 +ATOM 5121 N NZ . LYS B ? 304 ? -14.288 -11.954 24.161 1.0 70.77 304 B 1 +ATOM 5122 N N . LEU B ? 305 ? -9.252 -6.563 23.680 1.0 98.18 305 B 1 +ATOM 5123 C CA . LEU B ? 305 ? -7.849 -6.898 23.396 1.0 97.75 305 B 1 +ATOM 5124 C C . LEU B ? 305 ? -6.880 -6.211 24.372 1.0 97.75 305 B 1 +ATOM 5125 O O . LEU B ? 305 ? -5.906 -6.828 24.794 1.0 97.06 305 B 1 +ATOM 5126 C CB . LEU B ? 305 ? -7.507 -6.511 21.945 1.0 97.25 305 B 1 +ATOM 5127 C CG . LEU B ? 305 ? -8.111 -7.435 20.870 1.0 95.77 305 B 1 +ATOM 5128 C CD1 . LEU B ? 305 ? -7.920 -6.804 19.490 1.0 94.15 305 B 1 +ATOM 5129 C CD2 . LEU B ? 305 ? -7.453 -8.815 20.862 1.0 93.98 305 B 1 +ATOM 5130 N N . ALA B ? 306 ? -7.170 -4.970 24.767 1.0 97.92 306 B 1 +ATOM 5131 C CA . ALA B ? 306 ? -6.374 -4.225 25.745 1.0 98.14 306 B 1 +ATOM 5132 C C . ALA B ? 306 ? -6.676 -4.607 27.210 1.0 98.18 306 B 1 +ATOM 5133 O O . ALA B ? 306 ? -5.959 -4.178 28.113 1.0 97.85 306 B 1 +ATOM 5134 C CB . ALA B ? 306 ? -6.595 -2.729 25.498 1.0 98.24 306 B 1 +ATOM 5135 N N . GLY B ? 307 ? -7.731 -5.386 27.464 1.0 98.11 307 B 1 +ATOM 5136 C CA . GLY B ? 307 ? -8.201 -5.699 28.821 1.0 98.12 307 B 1 +ATOM 5137 C C . GLY B ? 307 ? -8.794 -4.487 29.549 1.0 98.41 307 B 1 +ATOM 5138 O O . GLY B ? 307 ? -8.666 -4.383 30.768 1.0 97.94 307 B 1 +ATOM 5139 N N . LEU B ? 308 ? -9.415 -3.573 28.815 1.0 98.46 308 B 1 +ATOM 5140 C CA . LEU B ? 308 ? -9.944 -2.305 29.320 1.0 98.65 308 B 1 +ATOM 5141 C C . LEU B ? 308 ? -11.468 -2.220 29.189 1.0 98.73 308 B 1 +ATOM 5142 O O . LEU B ? 308 ? -12.109 -2.951 28.432 1.0 98.5 308 B 1 +ATOM 5143 C CB . LEU B ? 308 ? -9.252 -1.135 28.593 1.0 98.58 308 B 1 +ATOM 5144 C CG . LEU B ? 308 ? -7.735 -1.020 28.818 1.0 98.24 308 B 1 +ATOM 5145 C CD1 . LEU B ? 308 ? -7.197 0.132 27.971 1.0 97.58 308 B 1 +ATOM 5146 C CD2 . LEU B ? 308 ? -7.369 -0.756 30.277 1.0 97.49 308 B 1 +ATOM 5147 N N . GLN B ? 309 ? -12.052 -1.265 29.910 1.0 98.73 309 B 1 +ATOM 5148 C CA . GLN B ? 309 ? -13.448 -0.850 29.792 1.0 98.71 309 B 1 +ATOM 5149 C C . GLN B ? 309 ? -13.529 0.589 29.273 1.0 98.82 309 B 1 +ATOM 5150 O O . GLN B ? 309 ? -12.548 1.330 29.296 1.0 98.57 309 B 1 +ATOM 5151 C CB . GLN B ? 309 ? -14.151 -0.990 31.152 1.0 98.31 309 B 1 +ATOM 5152 C CG . GLN B ? 309 ? -14.156 -2.437 31.664 1.0 94.79 309 B 1 +ATOM 5153 C CD . GLN B ? 309 ? -14.987 -2.631 32.935 1.0 87.65 309 B 1 +ATOM 5154 O OE1 . GLN B ? 309 ? -15.460 -1.712 33.591 1.0 76.56 309 B 1 +ATOM 5155 N NE2 . GLN B ? 309 ? -15.211 -3.864 33.336 1.0 73.44 309 B 1 +ATOM 5156 N N . ILE B ? 310 ? -14.725 1.011 28.856 1.0 98.77 310 B 1 +ATOM 5157 C CA . ILE B ? 310 ? -14.976 2.384 28.370 1.0 98.78 310 B 1 +ATOM 5158 C C . ILE B ? 310 ? -14.479 3.447 29.366 1.0 98.78 310 B 1 +ATOM 5159 O O . ILE B ? 310 ? -13.845 4.419 28.967 1.0 98.5 310 B 1 +ATOM 5160 C CB . ILE B ? 310 ? -16.485 2.550 28.064 1.0 98.58 310 B 1 +ATOM 5161 C CG1 . ILE B ? 310 ? -16.841 1.742 26.793 1.0 97.34 310 B 1 +ATOM 5162 C CG2 . ILE B ? 310 ? -16.891 4.027 27.896 1.0 97.75 310 B 1 +ATOM 5163 C CD1 . ILE B ? 310 ? -18.343 1.559 26.565 1.0 93.28 310 B 1 +ATOM 5164 N N . LYS B ? 311 ? -14.711 3.235 30.667 1.0 98.65 311 B 1 +ATOM 5165 C CA . LYS B ? 311 ? -14.309 4.163 31.742 1.0 98.49 311 B 1 +ATOM 5166 C C . LYS B ? 311 ? -12.796 4.374 31.864 1.0 98.6 311 B 1 +ATOM 5167 O O . LYS B ? 311 ? -12.383 5.358 32.463 1.0 98.1 311 B 1 +ATOM 5168 C CB . LYS B ? 311 ? -14.900 3.677 33.077 1.0 97.92 311 B 1 +ATOM 5169 C CG . LYS B ? 311 ? -14.266 2.353 33.540 1.0 92.43 311 B 1 +ATOM 5170 C CD . LYS B ? 311 ? -14.811 1.885 34.892 1.0 88.28 311 B 1 +ATOM 5171 C CE . LYS B ? 311 ? -14.013 0.634 35.259 1.0 76.4 311 B 1 +ATOM 5172 N NZ . LYS B ? 311 ? -14.449 0.037 36.541 1.0 67.86 311 B 1 +ATOM 5173 N N . ASP B ? 312 ? -11.989 3.452 31.324 1.0 98.7 312 B 1 +ATOM 5174 C CA . ASP B ? 312 ? -10.525 3.509 31.402 1.0 98.73 312 B 1 +ATOM 5175 C C . ASP B ? 312 ? -9.912 4.388 30.297 1.0 98.8 312 B 1 +ATOM 5176 O O . ASP B ? 312 ? -8.705 4.657 30.322 1.0 98.61 312 B 1 +ATOM 5177 C CB . ASP B ? 312 ? -9.947 2.084 31.346 1.0 98.62 312 B 1 +ATOM 5178 C CG . ASP B ? 312 ? -10.508 1.147 32.424 1.0 98.4 312 B 1 +ATOM 5179 O OD1 . ASP B ? 312 ? -10.567 1.558 33.607 1.0 97.04 312 B 1 +ATOM 5180 O OD2 . ASP B ? 312 ? -10.903 0.013 32.066 1.0 96.98 312 B 1 +ATOM 5181 N N . ILE B ? 313 ? -10.729 4.828 29.339 1.0 98.83 313 B 1 +ATOM 5182 C CA . ILE B ? 313 ? -10.319 5.720 28.253 1.0 98.89 313 B 1 +ATOM 5183 C C . ILE B ? 313 ? -10.541 7.179 28.666 1.0 98.88 313 B 1 +ATOM 5184 O O . ILE B ? 313 ? -11.654 7.590 28.997 1.0 98.77 313 B 1 +ATOM 5185 C CB . ILE B ? 313 ? -11.055 5.370 26.942 1.0 98.87 313 B 1 +ATOM 5186 C CG1 . ILE B ? 313 ? -10.882 3.889 26.522 1.0 98.55 313 B 1 +ATOM 5187 C CG2 . ILE B ? 313 ? -10.611 6.301 25.800 1.0 98.7 313 B 1 +ATOM 5188 C CD1 . ILE B ? 313 ? -9.427 3.419 26.318 1.0 98.25 313 B 1 +ATOM 5189 N N . ASP B ? 314 ? -9.477 7.966 28.608 1.0 98.86 314 B 1 +ATOM 5190 C CA . ASP B ? 314 ? -9.498 9.391 28.952 1.0 98.82 314 B 1 +ATOM 5191 C C . ASP B ? 314 ? -9.982 10.264 27.788 1.0 98.83 314 B 1 +ATOM 5192 O O . ASP B ? 314 ? -10.712 11.234 28.009 1.0 98.52 314 B 1 +ATOM 5193 C CB . ASP B ? 314 ? -8.092 9.821 29.373 1.0 98.72 314 B 1 +ATOM 5194 C CG . ASP B ? 314 ? -7.636 9.102 30.642 1.0 98.27 314 B 1 +ATOM 5195 O OD1 . ASP B ? 314 ? -8.042 9.568 31.738 1.0 95.05 314 B 1 +ATOM 5196 O OD2 . ASP B ? 314 ? -6.860 8.128 30.518 1.0 95.36 314 B 1 +ATOM 5197 N N . LEU B ? 315 ? -9.566 9.931 26.558 1.0 98.91 315 B 1 +ATOM 5198 C CA . LEU B ? 315 ? -9.903 10.649 25.328 1.0 98.92 315 B 1 +ATOM 5199 C C . LEU B ? 315 ? -10.242 9.686 24.188 1.0 98.95 315 B 1 +ATOM 5200 O O . LEU B ? 315 ? -9.593 8.655 23.996 1.0 98.88 315 B 1 +ATOM 5201 C CB . LEU B ? 315 ? -8.746 11.577 24.905 1.0 98.78 315 B 1 +ATOM 5202 C CG . LEU B ? 315 ? -8.424 12.738 25.864 1.0 97.82 315 B 1 +ATOM 5203 C CD1 . LEU B ? 315 ? -7.250 13.540 25.300 1.0 96.46 315 B 1 +ATOM 5204 C CD2 . LEU B ? 315 ? -9.602 13.697 26.048 1.0 96.57 315 B 1 +ATOM 5205 N N . TRP B ? 316 ? -11.222 10.082 23.394 1.0 98.95 316 B 1 +ATOM 5206 C CA . TRP B ? 316 ? -11.684 9.375 22.206 1.0 98.96 316 B 1 +ATOM 5207 C C . TRP B ? 316 ? -11.495 10.250 20.970 1.0 98.95 316 B 1 +ATOM 5208 O O . TRP B ? 316 ? -11.901 11.413 20.957 1.0 98.85 316 B 1 +ATOM 5209 C CB . TRP B ? 316 ? -13.158 9.002 22.365 1.0 98.93 316 B 1 +ATOM 5210 C CG . TRP B ? 316 ? -13.494 8.175 23.563 1.0 98.94 316 B 1 +ATOM 5211 C CD1 . TRP B ? 316 ? -13.750 8.658 24.801 1.0 98.74 316 B 1 +ATOM 5212 C CD2 . TRP B ? 316 ? -13.599 6.720 23.652 1.0 98.91 316 B 1 +ATOM 5213 N NE1 . TRP B ? 316 ? -14.013 7.594 25.662 1.0 98.77 316 B 1 +ATOM 5214 C CE2 . TRP B ? 316 ? -13.933 6.390 24.996 1.0 98.85 316 B 1 +ATOM 5215 C CE3 . TRP B ? 316 ? -13.448 5.664 22.732 1.0 98.83 316 B 1 +ATOM 5216 C CZ2 . TRP B ? 316 ? -14.109 5.051 25.414 1.0 98.69 316 B 1 +ATOM 5217 C CZ3 . TRP B ? 316 ? -13.626 4.328 23.144 1.0 98.55 316 B 1 +ATOM 5218 C CH2 . TRP B ? 316 ? -13.950 4.028 24.474 1.0 98.51 316 B 1 +ATOM 5219 N N . GLU B ? 317 ? -10.951 9.667 19.915 1.0 98.97 317 B 1 +ATOM 5220 C CA . GLU B ? 317 ? -10.942 10.226 18.567 1.0 98.97 317 B 1 +ATOM 5221 C C . GLU B ? 317 ? -11.770 9.305 17.666 1.0 98.97 317 B 1 +ATOM 5222 O O . GLU B ? 317 ? -11.327 8.226 17.274 1.0 98.91 317 B 1 +ATOM 5223 C CB . GLU B ? 317 ? -9.499 10.379 18.070 1.0 98.91 317 B 1 +ATOM 5224 C CG . GLU B ? 317 ? -8.820 11.662 18.578 1.0 97.61 317 B 1 +ATOM 5225 C CD . GLU B ? 317 ? -9.355 12.936 17.909 1.0 98.47 317 B 1 +ATOM 5226 O OE1 . GLU B ? 317 ? -9.304 14.008 18.547 1.0 96.31 317 B 1 +ATOM 5227 O OE2 . GLU B ? 317 ? -9.801 12.865 16.735 1.0 96.79 317 B 1 +ATOM 5228 N N . ILE B ? 318 ? -12.990 9.711 17.356 1.0 98.96 318 B 1 +ATOM 5229 C CA . ILE B ? 318 ? -13.891 8.992 16.445 1.0 98.95 318 B 1 +ATOM 5230 C C . ILE B ? 318 ? -14.020 9.838 15.183 1.0 98.95 318 B 1 +ATOM 5231 O O . ILE B ? 318 ? -14.610 10.917 15.222 1.0 98.84 318 B 1 +ATOM 5232 C CB . ILE B ? 318 ? -15.258 8.701 17.101 1.0 98.87 318 B 1 +ATOM 5233 C CG1 . ILE B ? 318 ? -15.083 7.887 18.410 1.0 98.0 318 B 1 +ATOM 5234 C CG2 . ILE B ? 318 ? -16.159 7.936 16.105 1.0 98.57 318 B 1 +ATOM 5235 C CD1 . ILE B ? 318 ? -16.374 7.739 19.218 1.0 94.6 318 B 1 +ATOM 5236 N N . ASN B ? 319 ? -13.457 9.377 14.073 1.0 98.91 319 B 1 +ATOM 5237 C CA . ASN B ? 319 ? -13.388 10.194 12.866 1.0 98.91 319 B 1 +ATOM 5238 C C . ASN B ? 319 ? -14.783 10.593 12.364 1.0 98.91 319 B 1 +ATOM 5239 O O . ASN B ? 319 ? -15.614 9.744 12.047 1.0 98.83 319 B 1 +ATOM 5240 C CB . ASN B ? 319 ? -12.569 9.483 11.785 1.0 98.89 319 B 1 +ATOM 5241 C CG . ASN B ? 319 ? -12.348 10.402 10.593 1.0 98.83 319 B 1 +ATOM 5242 O OD1 . ASN B ? 319 ? -11.702 11.430 10.690 1.0 93.07 319 B 1 +ATOM 5243 N ND2 . ASN B ? 319 ? -12.899 10.078 9.446 1.0 92.77 319 B 1 +ATOM 5244 N N . GLU B ? 320 ? -15.010 11.891 12.234 1.0 98.92 320 B 1 +ATOM 5245 C CA . GLU B ? 320 ? -16.286 12.511 11.870 1.0 98.9 320 B 1 +ATOM 5246 C C . GLU B ? 320 ? -16.534 12.479 10.350 1.0 98.9 320 B 1 +ATOM 5247 O O . GLU B ? 320 ? -16.766 13.521 9.729 1.0 98.71 320 B 1 +ATOM 5248 C CB . GLU B ? 320 ? -16.331 13.958 12.410 1.0 98.81 320 B 1 +ATOM 5249 C CG . GLU B ? 320 ? -16.166 14.061 13.933 1.0 98.74 320 B 1 +ATOM 5250 C CD . GLU B ? 320 ? -16.069 15.512 14.436 1.0 98.86 320 B 1 +ATOM 5251 O OE1 . GLU B ? 320 ? -16.077 15.703 15.671 1.0 98.14 320 B 1 +ATOM 5252 O OE2 . GLU B ? 320 ? -15.949 16.459 13.620 1.0 98.43 320 B 1 +ATOM 5253 N N . ALA B ? 321 ? -16.494 11.303 9.730 1.0 98.92 321 B 1 +ATOM 5254 C CA . ALA B ? 321 ? -16.833 11.177 8.308 1.0 98.89 321 B 1 +ATOM 5255 C C . ALA B ? 321 ? -18.168 11.870 7.984 1.0 98.9 321 B 1 +ATOM 5256 O O . ALA B ? 321 ? -18.299 12.583 6.990 1.0 98.7 321 B 1 +ATOM 5257 C CB . ALA B ? 321 ? -16.881 9.687 7.961 1.0 98.69 321 B 1 +ATOM 5258 N N . PHE B ? 322 ? -19.117 11.691 8.876 1.0 98.95 322 B 1 +ATOM 5259 C CA . PHE B ? 322 ? -20.364 12.445 8.993 1.0 98.95 322 B 1 +ATOM 5260 C C . PHE B ? 322 ? -20.681 12.572 10.486 1.0 98.94 322 B 1 +ATOM 5261 O O . PHE B ? 322 ? -20.347 11.661 11.245 1.0 98.83 322 B 1 +ATOM 5262 C CB . PHE B ? 322 ? -21.491 11.706 8.255 1.0 98.9 322 B 1 +ATOM 5263 C CG . PHE B ? 322 ? -21.191 11.412 6.798 1.0 98.92 322 B 1 +ATOM 5264 C CD1 . PHE B ? 322 ? -21.448 12.386 5.821 1.0 98.63 322 B 1 +ATOM 5265 C CD2 . PHE B ? 322 ? -20.584 10.201 6.419 1.0 98.65 322 B 1 +ATOM 5266 C CE1 . PHE B ? 322 ? -21.088 12.165 4.483 1.0 98.56 322 B 1 +ATOM 5267 C CE2 . PHE B ? 322 ? -20.217 9.972 5.080 1.0 98.51 322 B 1 +ATOM 5268 C CZ . PHE B ? 322 ? -20.463 10.962 4.115 1.0 98.68 322 B 1 +ATOM 5269 N N . ALA B ? 323 ? -21.355 13.653 10.915 1.0 98.92 323 B 1 +ATOM 5270 C CA . ALA B ? 323 ? -21.723 13.844 12.327 1.0 98.92 323 B 1 +ATOM 5271 C C . ALA B ? 323 ? -22.509 12.655 12.912 1.0 98.92 323 B 1 +ATOM 5272 O O . ALA B ? 323 ? -22.364 12.327 14.090 1.0 98.83 323 B 1 +ATOM 5273 C CB . ALA B ? 323 ? -22.529 15.142 12.447 1.0 98.87 323 B 1 +ATOM 5274 N N . VAL B ? 324 ? -23.278 11.956 12.085 1.0 98.87 324 B 1 +ATOM 5275 C CA . VAL B ? 324 ? -24.025 10.753 12.489 1.0 98.8 324 B 1 +ATOM 5276 C C . VAL B ? 324 ? -23.122 9.644 13.049 1.0 98.87 324 B 1 +ATOM 5277 O O . VAL B ? 324 ? -23.556 8.898 13.922 1.0 98.65 324 B 1 +ATOM 5278 C CB . VAL B ? 324 ? -24.892 10.244 11.314 1.0 97.68 324 B 1 +ATOM 5279 C CG1 . VAL B ? 324 ? -24.099 9.524 10.215 1.0 90.87 324 B 1 +ATOM 5280 C CG2 . VAL B ? 324 ? -26.000 9.307 11.788 1.0 92.36 324 B 1 +ATOM 5281 N N . VAL B ? 325 ? -21.871 9.543 12.598 1.0 98.9 325 B 1 +ATOM 5282 C CA . VAL B ? 325 ? -20.947 8.461 12.991 1.0 98.91 325 B 1 +ATOM 5283 C C . VAL B ? 325 ? -20.548 8.555 14.472 1.0 98.93 325 B 1 +ATOM 5284 O O . VAL B ? 325 ? -20.808 7.604 15.212 1.0 98.87 325 B 1 +ATOM 5285 C CB . VAL B ? 325 ? -19.717 8.395 12.059 1.0 98.85 325 B 1 +ATOM 5286 C CG1 . VAL B ? 325 ? -18.746 7.286 12.484 1.0 98.52 325 B 1 +ATOM 5287 C CG2 . VAL B ? 325 ? -20.127 8.135 10.604 1.0 98.5 325 B 1 +ATOM 5288 N N . PRO B ? 326 ? -19.965 9.659 14.964 1.0 98.95 326 B 1 +ATOM 5289 C CA . PRO B ? 326 ? -19.687 9.803 16.395 1.0 98.94 326 B 1 +ATOM 5290 C C . PRO B ? 326 ? -20.971 9.830 17.231 1.0 98.94 326 B 1 +ATOM 5291 O O . PRO B ? 326 ? -20.988 9.220 18.294 1.0 98.87 326 B 1 +ATOM 5292 C CB . PRO B ? 326 ? -18.864 11.086 16.536 1.0 98.83 326 B 1 +ATOM 5293 C CG . PRO B ? 326 ? -19.256 11.896 15.302 1.0 98.16 326 B 1 +ATOM 5294 C CD . PRO B ? 326 ? -19.471 10.821 14.246 1.0 98.82 326 B 1 +ATOM 5295 N N . LEU B ? 327 ? -22.065 10.437 16.743 1.0 98.92 327 B 1 +ATOM 5296 C CA . LEU B ? 327 ? -23.347 10.459 17.461 1.0 98.9 327 B 1 +ATOM 5297 C C . LEU B ? 327 ? -23.896 9.052 17.712 1.0 98.87 327 B 1 +ATOM 5298 O O . LEU B ? 327 ? -24.245 8.720 18.848 1.0 98.74 327 B 1 +ATOM 5299 C CB . LEU B ? 327 ? -24.377 11.286 16.676 1.0 98.88 327 B 1 +ATOM 5300 C CG . LEU B ? 327 ? -24.162 12.807 16.749 1.0 98.61 327 B 1 +ATOM 5301 C CD1 . LEU B ? 327 ? -25.084 13.492 15.742 1.0 98.14 327 B 1 +ATOM 5302 C CD2 . LEU B ? 327 ? -24.477 13.362 18.139 1.0 98.12 327 B 1 +ATOM 5303 N N . TYR B ? 328 ? -23.946 8.206 16.673 1.0 98.9 328 B 1 +ATOM 5304 C CA . TYR B ? 328 ? -24.358 6.808 16.817 1.0 98.89 328 B 1 +ATOM 5305 C C . TYR B ? 328 ? -23.445 6.058 17.791 1.0 98.88 328 B 1 +ATOM 5306 O O . TYR B ? 328 ? -23.924 5.350 18.677 1.0 98.78 328 B 1 +ATOM 5307 C CB . TYR B ? 328 ? -24.358 6.124 15.446 1.0 98.86 328 B 1 +ATOM 5308 C CG . TYR B ? 328 ? -24.682 4.647 15.540 1.0 98.78 328 B 1 +ATOM 5309 C CD1 . TYR B ? 328 ? -23.651 3.697 15.693 1.0 98.42 328 B 1 +ATOM 5310 C CD2 . TYR B ? 328 ? -26.023 4.218 15.560 1.0 98.44 328 B 1 +ATOM 5311 C CE1 . TYR B ? 328 ? -23.955 2.335 15.862 1.0 98.05 328 B 1 +ATOM 5312 C CE2 . TYR B ? 328 ? -26.339 2.858 15.724 1.0 98.05 328 B 1 +ATOM 5313 C CZ . TYR B ? 328 ? -25.299 1.921 15.879 1.0 98.14 328 B 1 +ATOM 5314 O OH . TYR B ? 328 ? -25.604 0.593 16.051 1.0 97.29 328 B 1 +ATOM 5315 N N . THR B ? 329 ? -22.137 6.249 17.660 1.0 98.91 329 B 1 +ATOM 5316 C CA . THR B ? 329 ? -21.140 5.566 18.491 1.0 98.9 329 B 1 +ATOM 5317 C C . THR B ? 329 ? -21.280 5.955 19.964 1.0 98.89 329 B 1 +ATOM 5318 O O . THR B ? 329 ? -21.339 5.082 20.826 1.0 98.79 329 B 1 +ATOM 5319 C CB . THR B ? 329 ? -19.719 5.855 17.992 1.0 98.86 329 B 1 +ATOM 5320 O OG1 . THR B ? 329 ? -19.604 5.578 16.615 1.0 97.93 329 B 1 +ATOM 5321 C CG2 . THR B ? 329 ? -18.689 4.980 18.701 1.0 98.01 329 B 1 +ATOM 5322 N N . MET B ? 330 ? -21.408 7.247 20.262 1.0 98.89 330 B 1 +ATOM 5323 C CA . MET B ? 330 ? -21.617 7.752 21.624 1.0 98.82 330 B 1 +ATOM 5324 C C . MET B ? 330 ? -22.917 7.224 22.240 1.0 98.77 330 B 1 +ATOM 5325 O O . MET B ? 330 ? -22.892 6.718 23.359 1.0 98.48 330 B 1 +ATOM 5326 C CB . MET B ? 330 ? -21.633 9.285 21.629 1.0 98.64 330 B 1 +ATOM 5327 C CG . MET B ? 330 ? -20.251 9.896 21.371 1.0 97.34 330 B 1 +ATOM 5328 S SD . MET B ? 330 ? -20.174 11.697 21.594 1.0 96.81 330 B 1 +ATOM 5329 C CE . MET B ? 330 ? -21.283 12.274 20.297 1.0 90.08 330 B 1 +ATOM 5330 N N . LYS B ? 331 ? -24.043 7.284 21.508 1.0 98.72 331 B 1 +ATOM 5331 C CA . LYS B ? 331 ? -25.338 6.764 21.978 1.0 98.47 331 B 1 +ATOM 5332 C C . LYS B ? 331 ? -25.293 5.260 22.245 1.0 98.54 331 B 1 +ATOM 5333 O O . LYS B ? 331 ? -25.802 4.802 23.262 1.0 97.97 331 B 1 +ATOM 5334 C CB . LYS B ? 331 ? -26.450 7.077 20.956 1.0 97.56 331 B 1 +ATOM 5335 C CG . LYS B ? 331 ? -26.985 8.517 21.064 1.0 83.34 331 B 1 +ATOM 5336 C CD . LYS B ? 331 ? -28.151 8.737 20.085 1.0 81.61 331 B 1 +ATOM 5337 C CE . LYS B ? 331 ? -28.793 10.111 20.301 1.0 70.95 331 B 1 +ATOM 5338 N NZ . LYS B ? 331 ? -29.937 10.366 19.385 1.0 64.17 331 B 1 +ATOM 5339 N N . THR B ? 332 ? -24.688 4.501 21.343 1.0 98.68 332 B 1 +ATOM 5340 C CA . THR B ? 332 ? -24.671 3.032 21.407 1.0 98.68 332 B 1 +ATOM 5341 C C . THR B ? 332 ? -23.769 2.510 22.521 1.0 98.72 332 B 1 +ATOM 5342 O O . THR B ? 332 ? -24.110 1.533 23.183 1.0 98.29 332 B 1 +ATOM 5343 C CB . THR B ? 332 ? -24.231 2.440 20.060 1.0 98.39 332 B 1 +ATOM 5344 O OG1 . THR B ? 332 ? -25.097 2.899 19.046 1.0 95.19 332 B 1 +ATOM 5345 C CG2 . THR B ? 332 ? -24.297 0.914 20.025 1.0 94.84 332 B 1 +ATOM 5346 N N . LEU B ? 333 ? -22.633 3.152 22.751 1.0 98.77 333 B 1 +ATOM 5347 C CA . LEU B ? 333 ? -21.643 2.724 23.748 1.0 98.79 333 B 1 +ATOM 5348 C C . LEU B ? 333 ? -21.729 3.496 25.074 1.0 98.74 333 B 1 +ATOM 5349 O O . LEU B ? 333 ? -21.058 3.121 26.034 1.0 98.25 333 B 1 +ATOM 5350 C CB . LEU B ? 333 ? -20.237 2.814 23.137 1.0 98.77 333 B 1 +ATOM 5351 C CG . LEU B ? 333 ? -20.007 1.952 21.878 1.0 98.45 333 B 1 +ATOM 5352 C CD1 . LEU B ? 333 ? -18.558 2.126 21.422 1.0 97.99 333 B 1 +ATOM 5353 C CD2 . LEU B ? 333 ? -20.243 0.462 22.124 1.0 97.82 333 B 1 +ATOM 5354 N N . GLY B ? 334 ? -22.539 4.562 25.141 1.0 98.58 334 B 1 +ATOM 5355 C CA . GLY B ? 334 ? -22.627 5.429 26.319 1.0 98.46 334 B 1 +ATOM 5356 C C . GLY B ? 334 ? -21.336 6.211 26.574 1.0 98.56 334 B 1 +ATOM 5357 O O . GLY B ? 334 ? -20.864 6.269 27.707 1.0 97.63 334 B 1 +ATOM 5358 N N . LEU B ? 335 ? -20.742 6.781 25.524 1.0 98.63 335 B 1 +ATOM 5359 C CA . LEU B ? 335 ? -19.516 7.578 25.649 1.0 98.65 335 B 1 +ATOM 5360 C C . LEU B ? 335 ? -19.832 8.993 26.136 1.0 98.53 335 B 1 +ATOM 5361 O O . LEU B ? 335 ? -20.821 9.601 25.732 1.0 98.0 335 B 1 +ATOM 5362 C CB . LEU B ? 335 ? -18.734 7.615 24.326 1.0 98.63 335 B 1 +ATOM 5363 C CG . LEU B ? 335 ? -18.424 6.244 23.696 1.0 98.24 335 B 1 +ATOM 5364 C CD1 . LEU B ? 335 ? -17.571 6.443 22.445 1.0 97.8 335 B 1 +ATOM 5365 C CD2 . LEU B ? 335 ? -17.681 5.306 24.641 1.0 97.77 335 B 1 +ATOM 5366 N N . ASP B ? 336 ? -18.949 9.541 26.962 1.0 98.31 336 B 1 +ATOM 5367 C CA . ASP B ? 336 ? -19.020 10.929 27.419 1.0 98.27 336 B 1 +ATOM 5368 C C . ASP B ? 336 ? -18.565 11.881 26.304 1.0 98.47 336 B 1 +ATOM 5369 O O . ASP B ? 336 ? -17.384 11.919 25.946 1.0 98.03 336 B 1 +ATOM 5370 C CB . ASP B ? 336 ? -18.169 11.064 28.691 1.0 97.67 336 B 1 +ATOM 5371 C CG . ASP B ? 336 ? -18.113 12.481 29.268 1.0 97.08 336 B 1 +ATOM 5372 O OD1 . ASP B ? 336 ? -18.750 13.408 28.714 1.0 95.46 336 B 1 +ATOM 5373 O OD2 . ASP B ? 336 ? -17.378 12.651 30.263 1.0 93.96 336 B 1 +ATOM 5374 N N . GLU B ? 337 ? -19.492 12.690 25.781 1.0 98.26 337 B 1 +ATOM 5375 C CA . GLU B ? 337 ? -19.225 13.662 24.710 1.0 98.23 337 B 1 +ATOM 5376 C C . GLU B ? 337 ? -18.105 14.658 25.071 1.0 98.48 337 B 1 +ATOM 5377 O O . GLU B ? 337 ? -17.397 15.142 24.193 1.0 98.11 337 B 1 +ATOM 5378 C CB . GLU B ? 337 ? -20.526 14.408 24.372 1.0 97.25 337 B 1 +ATOM 5379 C CG . GLU B ? 337 ? -20.389 15.295 23.119 1.0 91.41 337 B 1 +ATOM 5380 C CD . GLU B ? 337 ? -21.687 16.035 22.757 1.0 88.29 337 B 1 +ATOM 5381 O OE1 . GLU B ? 337 ? -22.109 15.945 21.584 1.0 81.01 337 B 1 +ATOM 5382 O OE2 . GLU B ? 337 ? -22.241 16.722 23.646 1.0 81.92 337 B 1 +ATOM 5383 N N . SER B ? 338 ? -17.903 14.945 26.368 1.0 98.55 338 B 1 +ATOM 5384 C CA . SER B ? 338 ? -16.825 15.836 26.818 1.0 98.55 338 B 1 +ATOM 5385 C C . SER B ? 338 ? -15.418 15.254 26.612 1.0 98.69 338 B 1 +ATOM 5386 O O . SER B ? 338 ? -14.438 15.995 26.666 1.0 98.32 338 B 1 +ATOM 5387 C CB . SER B ? 338 ? -17.036 16.231 28.282 1.0 98.18 338 B 1 +ATOM 5388 O OG . SER B ? 338 ? -16.674 15.200 29.176 1.0 93.63 338 B 1 +ATOM 5389 N N . LYS B ? 339 ? -15.324 13.949 26.338 1.0 98.73 339 B 1 +ATOM 5390 C CA . LYS B ? 339 ? -14.073 13.228 26.062 1.0 98.81 339 B 1 +ATOM 5391 C C . LYS B ? 339 ? -13.897 12.843 24.595 1.0 98.88 339 B 1 +ATOM 5392 O O . LYS B ? 339 ? -12.826 12.373 24.219 1.0 98.7 339 B 1 +ATOM 5393 C CB . LYS B ? 339 ? -14.012 11.973 26.935 1.0 98.61 339 B 1 +ATOM 5394 C CG . LYS B ? 339 ? -14.022 12.292 28.437 1.0 97.66 339 B 1 +ATOM 5395 C CD . LYS B ? 339 ? -13.841 10.989 29.215 1.0 95.55 339 B 1 +ATOM 5396 C CE . LYS B ? 339 ? -13.798 11.260 30.714 1.0 89.48 339 B 1 +ATOM 5397 N NZ . LYS B ? 339 ? -13.475 10.010 31.435 1.0 81.25 339 B 1 +ATOM 5398 N N . VAL B ? 340 ? -14.929 13.001 23.772 1.0 98.87 340 B 1 +ATOM 5399 C CA . VAL B ? 340 ? -14.922 12.607 22.358 1.0 98.9 340 B 1 +ATOM 5400 C C . VAL B ? 340 ? -14.587 13.810 21.488 1.0 98.91 340 B 1 +ATOM 5401 O O . VAL B ? 340 ? -15.279 14.820 21.556 1.0 98.78 340 B 1 +ATOM 5402 C CB . VAL B ? 340 ? -16.266 11.981 21.941 1.0 98.83 340 B 1 +ATOM 5403 C CG1 . VAL B ? 340 ? -16.256 11.556 20.469 1.0 98.39 340 B 1 +ATOM 5404 C CG2 . VAL B ? 340 ? -16.589 10.738 22.780 1.0 98.33 340 B 1 +ATOM 5405 N N . ASN B ? 341 ? -13.569 13.680 20.650 1.0 98.89 341 B 1 +ATOM 5406 C CA . ASN B ? 341 ? -13.143 14.695 19.673 1.0 98.9 341 B 1 +ATOM 5407 C C . ASN B ? 341 ? -13.029 16.099 20.290 1.0 98.88 341 B 1 +ATOM 5408 O O . ASN B ? 341 ? -13.586 17.071 19.778 1.0 98.57 341 B 1 +ATOM 5409 C CB . ASN B ? 341 ? -14.061 14.656 18.435 1.0 98.85 341 B 1 +ATOM 5410 C CG . ASN B ? 341 ? -14.094 13.316 17.720 1.0 98.86 341 B 1 +ATOM 5411 O OD1 . ASN B ? 341 ? -13.348 12.393 17.985 1.0 95.37 341 B 1 +ATOM 5412 N ND2 . ASN B ? 341 ? -14.988 13.174 16.771 1.0 94.48 341 B 1 +ATOM 5413 N N . ILE B ? 342 ? -12.311 16.216 21.405 1.0 98.92 342 B 1 +ATOM 5414 C CA . ILE B ? 342 ? -12.268 17.450 22.210 1.0 98.88 342 B 1 +ATOM 5415 C C . ILE B ? 342 ? -11.702 18.669 21.465 1.0 98.9 342 B 1 +ATOM 5416 O O . ILE B ? 342 ? -11.992 19.803 21.833 1.0 98.65 342 B 1 +ATOM 5417 C CB . ILE B ? 342 ? -11.502 17.232 23.530 1.0 98.69 342 B 1 +ATOM 5418 C CG1 . ILE B ? 342 ? -10.027 16.825 23.306 1.0 96.96 342 B 1 +ATOM 5419 C CG2 . ILE B ? 342 ? -12.251 16.203 24.406 1.0 95.57 342 B 1 +ATOM 5420 C CD1 . ILE B ? 342 ? -9.175 16.955 24.575 1.0 94.48 342 B 1 +ATOM 5421 N N . HIS B ? 343 ? -10.940 18.433 20.407 1.0 98.84 343 B 1 +ATOM 5422 C CA . HIS B ? 343 ? -10.358 19.471 19.545 1.0 98.85 343 B 1 +ATOM 5423 C C . HIS B ? 343 ? -11.016 19.536 18.156 1.0 98.84 343 B 1 +ATOM 5424 O O . HIS B ? 343 ? -10.420 20.034 17.198 1.0 98.48 343 B 1 +ATOM 5425 C CB . HIS B ? 343 ? -8.837 19.274 19.479 1.0 98.74 343 B 1 +ATOM 5426 C CG . HIS B ? 343 ? -8.155 19.291 20.821 1.0 98.79 343 B 1 +ATOM 5427 N ND1 . HIS B ? 343 ? -7.147 18.446 21.219 1.0 92.1 343 B 1 +ATOM 5428 C CD2 . HIS B ? 343 ? -8.399 20.126 21.883 1.0 92.8 343 B 1 +ATOM 5429 C CE1 . HIS B ? 343 ? -6.793 18.764 22.471 1.0 94.65 343 B 1 +ATOM 5430 N NE2 . HIS B ? 343 ? -7.538 19.785 22.920 1.0 95.77 343 B 1 +ATOM 5431 N N . GLY B ? 344 ? -12.267 19.066 18.052 1.0 98.78 344 B 1 +ATOM 5432 C CA . GLY B ? 344 ? -12.977 18.927 16.783 1.0 98.77 344 B 1 +ATOM 5433 C C . GLY B ? 344 ? -12.596 17.644 16.049 1.0 98.83 344 B 1 +ATOM 5434 O O . GLY B ? 344 ? -11.898 16.776 16.573 1.0 98.33 344 B 1 +ATOM 5435 N N . GLY B ? 345 ? -13.075 17.514 14.818 1.0 98.87 345 B 1 +ATOM 5436 C CA . GLY B ? 345 ? -12.838 16.343 13.989 1.0 98.88 345 B 1 +ATOM 5437 C C . GLY B ? 345 ? -13.072 16.633 12.511 1.0 98.93 345 B 1 +ATOM 5438 O O . GLY B ? 345 ? -13.115 17.788 12.082 1.0 98.78 345 B 1 +ATOM 5439 N N . ALA B ? 346 ? -13.233 15.583 11.715 1.0 98.93 346 B 1 +ATOM 5440 C CA . ALA B ? 346 ? -13.261 15.685 10.256 1.0 98.94 346 B 1 +ATOM 5441 C C . ALA B ? 346 ? -14.374 16.586 9.691 1.0 98.93 346 B 1 +ATOM 5442 O O . ALA B ? 346 ? -14.192 17.148 8.617 1.0 98.75 346 B 1 +ATOM 5443 C CB . ALA B ? 346 ? -13.345 14.272 9.675 1.0 98.87 346 B 1 +ATOM 5444 N N . VAL B ? 347 ? -15.492 16.775 10.393 1.0 98.94 347 B 1 +ATOM 5445 C CA . VAL B ? 347 ? -16.551 17.719 9.975 1.0 98.94 347 B 1 +ATOM 5446 C C . VAL B ? 347 ? -16.015 19.151 9.883 1.0 98.93 347 B 1 +ATOM 5447 O O . VAL B ? 347 ? -16.345 19.872 8.945 1.0 98.74 347 B 1 +ATOM 5448 C CB . VAL B ? 347 ? -17.763 17.641 10.925 1.0 98.83 347 B 1 +ATOM 5449 C CG1 . VAL B ? 347 ? -18.752 18.803 10.751 1.0 97.61 347 B 1 +ATOM 5450 C CG2 . VAL B ? 347 ? -18.559 16.352 10.677 1.0 97.39 347 B 1 +ATOM 5451 N N . SER B ? 348 ? -15.180 19.571 10.829 1.0 98.92 348 B 1 +ATOM 5452 C CA . SER B ? 348 ? -14.662 20.944 10.919 1.0 98.89 348 B 1 +ATOM 5453 C C . SER B ? 348 ? -13.203 21.099 10.491 1.0 98.84 348 B 1 +ATOM 5454 O O . SER B ? 348 ? -12.807 22.182 10.066 1.0 98.52 348 B 1 +ATOM 5455 C CB . SER B ? 348 ? -14.850 21.478 12.337 1.0 98.79 348 B 1 +ATOM 5456 O OG . SER B ? 348 ? -14.130 20.715 13.284 1.0 98.48 348 B 1 +ATOM 5457 N N . LEU B ? 349 ? -12.403 20.043 10.579 1.0 98.91 349 B 1 +ATOM 5458 C CA . LEU B ? 349 ? -10.996 20.040 10.154 1.0 98.88 349 B 1 +ATOM 5459 C C . LEU B ? 349 ? -10.821 19.593 8.696 1.0 98.86 349 B 1 +ATOM 5460 O O . LEU B ? 349 ? -9.857 19.984 8.044 1.0 98.52 349 B 1 +ATOM 5461 C CB . LEU B ? 349 ? -10.174 19.146 11.099 1.0 98.8 349 B 1 +ATOM 5462 C CG . LEU B ? 349 ? -10.092 19.635 12.557 1.0 98.54 349 B 1 +ATOM 5463 C CD1 . LEU B ? 349 ? -9.388 18.579 13.414 1.0 98.0 349 B 1 +ATOM 5464 C CD2 . LEU B ? 349 ? -9.306 20.945 12.677 1.0 97.81 349 B 1 +ATOM 5465 N N . GLY B ? 350 ? -11.747 18.779 8.185 1.0 98.88 350 B 1 +ATOM 5466 C CA . GLY B ? 350 ? -11.660 18.138 6.877 1.0 98.89 350 B 1 +ATOM 5467 C C . GLY B ? 350 ? -11.238 16.670 6.949 1.0 98.93 350 B 1 +ATOM 5468 O O . GLY B ? 350 ? -10.781 16.164 7.980 1.0 98.81 350 B 1 +ATOM 5469 N N . HIS B ? 351 ? -11.404 15.969 5.822 1.0 98.89 351 B 1 +ATOM 5470 C CA . HIS B ? 351 ? -11.176 14.530 5.721 1.0 98.92 351 B 1 +ATOM 5471 C C . HIS B ? 351 ? -10.463 14.121 4.418 1.0 98.94 351 B 1 +ATOM 5472 O O . HIS B ? 351 ? -11.103 13.616 3.489 1.0 98.83 351 B 1 +ATOM 5473 C CB . HIS B ? 351 ? -12.513 13.804 5.935 1.0 98.82 351 B 1 +ATOM 5474 C CG . HIS B ? 351 ? -12.400 12.300 5.965 1.0 98.82 351 B 1 +ATOM 5475 N ND1 . HIS B ? 351 ? -11.281 11.560 6.293 1.0 96.65 351 B 1 +ATOM 5476 C CD2 . HIS B ? 351 ? -13.404 11.402 5.705 1.0 96.47 351 B 1 +ATOM 5477 C CE1 . HIS B ? 351 ? -11.605 10.257 6.218 1.0 97.34 351 B 1 +ATOM 5478 N NE2 . HIS B ? 351 ? -12.885 10.125 5.874 1.0 97.57 351 B 1 +ATOM 5479 N N . PRO B ? 352 ? -9.141 14.280 4.324 1.0 98.94 352 B 1 +ATOM 5480 C CA . PRO B ? 352 ? -8.346 13.576 3.324 1.0 98.94 352 B 1 +ATOM 5481 C C . PRO B ? 352 ? -8.414 12.080 3.666 1.0 98.94 352 B 1 +ATOM 5482 O O . PRO B ? 352 ? -7.895 11.650 4.696 1.0 98.84 352 B 1 +ATOM 5483 C CB . PRO B ? 352 ? -6.926 14.149 3.412 1.0 98.91 352 B 1 +ATOM 5484 C CG . PRO B ? 352 ? -7.045 15.364 4.346 1.0 98.56 352 B 1 +ATOM 5485 C CD . PRO B ? 352 ? -8.280 15.056 5.189 1.0 98.91 352 B 1 +ATOM 5486 N N . ILE B ? 353 ? -9.114 11.282 2.856 1.0 98.94 353 B 1 +ATOM 5487 C CA . ILE B ? 353 ? -9.637 9.972 3.280 1.0 98.92 353 B 1 +ATOM 5488 C C . ILE B ? 353 ? -8.553 8.965 3.694 1.0 98.93 353 B 1 +ATOM 5489 O O . ILE B ? 353 ? -8.705 8.286 4.707 1.0 98.79 353 B 1 +ATOM 5490 C CB . ILE B ? 353 ? -10.636 9.399 2.239 1.0 98.79 353 B 1 +ATOM 5491 C CG1 . ILE B ? 353 ? -10.053 9.360 0.810 1.0 98.29 353 B 1 +ATOM 5492 C CG2 . ILE B ? 353 ? -11.949 10.215 2.288 1.0 98.08 353 B 1 +ATOM 5493 C CD1 . ILE B ? 353 ? -11.001 8.757 -0.246 1.0 97.72 353 B 1 +ATOM 5494 N N . GLY B ? 354 ? -7.425 8.915 2.990 1.0 98.92 354 B 1 +ATOM 5495 C CA . GLY B ? 354 ? -6.285 8.073 3.372 1.0 98.92 354 B 1 +ATOM 5496 C C . GLY B ? 354 ? -5.520 8.581 4.602 1.0 98.94 354 B 1 +ATOM 5497 O O . GLY B ? 354 ? -4.958 7.783 5.351 1.0 98.83 354 B 1 +ATOM 5498 N N . MET B ? 355 ? -5.537 9.889 4.853 1.0 98.93 355 B 1 +ATOM 5499 C CA . MET B ? 355 ? -4.812 10.534 5.960 1.0 98.94 355 B 1 +ATOM 5500 C C . MET B ? 355 ? -5.470 10.312 7.324 1.0 98.95 355 B 1 +ATOM 5501 O O . MET B ? 355 ? -4.786 10.076 8.318 1.0 98.85 355 B 1 +ATOM 5502 C CB . MET B ? 355 ? -4.708 12.043 5.674 1.0 98.8 355 B 1 +ATOM 5503 C CG . MET B ? 355 ? -4.134 12.891 6.821 1.0 98.53 355 B 1 +ATOM 5504 S SD . MET B ? 355 ? -4.313 14.669 6.539 1.0 98.21 355 B 1 +ATOM 5505 C CE . MET B ? 355 ? -3.598 15.362 8.039 1.0 95.88 355 B 1 +ATOM 5506 N N . SER B ? 356 ? -6.791 10.445 7.399 1.0 98.95 356 B 1 +ATOM 5507 C CA . SER B ? 356 ? -7.510 10.683 8.659 1.0 98.95 356 B 1 +ATOM 5508 C C . SER B ? 356 ? -7.267 9.628 9.743 1.0 98.95 356 B 1 +ATOM 5509 O O . SER B ? 356 ? -7.124 9.982 10.908 1.0 98.9 356 B 1 +ATOM 5510 C CB . SER B ? 356 ? -9.005 10.815 8.386 1.0 98.9 356 B 1 +ATOM 5511 O OG . SER B ? 356 ? -9.238 12.011 7.659 1.0 98.51 356 B 1 +ATOM 5512 N N . GLY B ? 357 ? -7.156 8.355 9.375 1.0 98.95 357 B 1 +ATOM 5513 C CA . GLY B ? 357 ? -6.864 7.276 10.323 1.0 98.94 357 B 1 +ATOM 5514 C C . GLY B ? 357 ? -5.514 7.418 11.034 1.0 98.96 357 B 1 +ATOM 5515 O O . GLY B ? 357 ? -5.393 7.037 12.195 1.0 98.88 357 B 1 +ATOM 5516 N N . ALA B ? 358 ? -4.516 8.009 10.377 1.0 98.96 358 B 1 +ATOM 5517 C CA . ALA B ? 358 ? -3.232 8.320 11.006 1.0 98.97 358 B 1 +ATOM 5518 C C . ALA B ? 358 ? -3.276 9.650 11.774 1.0 98.97 358 B 1 +ATOM 5519 O O . ALA B ? 358 ? -2.691 9.747 12.849 1.0 98.93 358 B 1 +ATOM 5520 C CB . ALA B ? 358 ? -2.140 8.321 9.935 1.0 98.94 358 B 1 +ATOM 5521 N N . ARG B ? 359 ? -4.007 10.660 11.265 1.0 98.98 359 B 1 +ATOM 5522 C CA . ARG B ? 359 ? -4.168 11.967 11.917 1.0 98.97 359 B 1 +ATOM 5523 C C . ARG B ? 359 ? -4.695 11.834 13.346 1.0 98.97 359 B 1 +ATOM 5524 O O . ARG B ? 359 ? -4.113 12.401 14.258 1.0 98.94 359 B 1 +ATOM 5525 C CB . ARG B ? 359 ? -5.101 12.863 11.084 1.0 98.92 359 B 1 +ATOM 5526 C CG . ARG B ? 359 ? -5.206 14.279 11.680 1.0 98.47 359 B 1 +ATOM 5527 C CD . ARG B ? 359 ? -6.272 15.144 10.984 1.0 97.43 359 B 1 +ATOM 5528 N NE . ARG B ? 359 ? -7.646 14.661 11.173 1.0 95.45 359 B 1 +ATOM 5529 C CZ . ARG B ? 359 ? -8.388 14.759 12.273 1.0 96.04 359 B 1 +ATOM 5530 N NH1 . ARG B ? 359 ? -7.962 15.318 13.368 1.0 90.64 359 B 1 +ATOM 5531 N NH2 . ARG B ? 359 ? -9.602 14.298 12.277 1.0 92.45 359 B 1 +ATOM 5532 N N . ILE B ? 360 ? -5.769 11.066 13.528 1.0 98.97 360 B 1 +ATOM 5533 C CA . ILE B ? 360 ? -6.411 10.929 14.845 1.0 98.97 360 B 1 +ATOM 5534 C C . ILE B ? 360 ? -5.526 10.177 15.852 1.0 98.97 360 B 1 +ATOM 5535 O O . ILE B ? 360 ? -5.508 10.524 17.025 1.0 98.92 360 B 1 +ATOM 5536 C CB . ILE B ? 360 ? -7.821 10.303 14.722 1.0 98.93 360 B 1 +ATOM 5537 C CG1 . ILE B ? 360 ? -7.788 8.860 14.181 1.0 98.63 360 B 1 +ATOM 5538 C CG2 . ILE B ? 360 ? -8.737 11.213 13.875 1.0 98.38 360 B 1 +ATOM 5539 C CD1 . ILE B ? 360 ? -9.164 8.177 14.116 1.0 98.31 360 B 1 +ATOM 5540 N N . VAL B ? 361 ? -4.738 9.199 15.401 1.0 98.97 361 B 1 +ATOM 5541 C CA . VAL B ? 361 ? -3.763 8.507 16.265 1.0 98.97 361 B 1 +ATOM 5542 C C . VAL B ? 361 ? -2.622 9.453 16.649 1.0 98.96 361 B 1 +ATOM 5543 O O . VAL B ? 361 ? -2.291 9.562 17.824 1.0 98.9 361 B 1 +ATOM 5544 C CB . VAL B ? 361 ? -3.224 7.225 15.597 1.0 98.93 361 B 1 +ATOM 5545 C CG1 . VAL B ? 361 ? -2.146 6.540 16.448 1.0 98.59 361 B 1 +ATOM 5546 C CG2 . VAL B ? 361 ? -4.350 6.202 15.383 1.0 98.56 361 B 1 +ATOM 5547 N N . GLY B ? 362 ? -2.067 10.176 15.684 1.0 98.95 362 B 1 +ATOM 5548 C CA . GLY B ? 362 ? -1.020 11.173 15.935 1.0 98.93 362 B 1 +ATOM 5549 C C . GLY B ? 362 ? -1.478 12.284 16.886 1.0 98.92 362 B 1 +ATOM 5550 O O . GLY B ? 362 ? -0.725 12.691 17.770 1.0 98.75 362 B 1 +ATOM 5551 N N . HIS B ? 363 ? -2.737 12.707 16.765 1.0 98.92 363 B 1 +ATOM 5552 C CA . HIS B ? 363 ? -3.328 13.698 17.663 1.0 98.9 363 B 1 +ATOM 5553 C C . HIS B ? 363 ? -3.390 13.195 19.115 1.0 98.88 363 B 1 +ATOM 5554 O O . HIS B ? 363 ? -2.968 13.902 20.031 1.0 98.71 363 B 1 +ATOM 5555 C CB . HIS B ? 363 ? -4.713 14.100 17.150 1.0 98.84 363 B 1 +ATOM 5556 C CG . HIS B ? 363 ? -5.257 15.273 17.913 1.0 98.74 363 B 1 +ATOM 5557 N ND1 . HIS B ? 363 ? -4.654 16.516 17.983 1.0 95.83 363 B 1 +ATOM 5558 C CD2 . HIS B ? 363 ? -6.371 15.305 18.707 1.0 96.4 363 B 1 +ATOM 5559 C CE1 . HIS B ? 363 ? -5.394 17.270 18.802 1.0 97.04 363 B 1 +ATOM 5560 N NE2 . HIS B ? 363 ? -6.445 16.576 19.258 1.0 97.11 363 B 1 +ATOM 5561 N N . LEU B ? 364 ? -3.829 11.947 19.329 1.0 98.93 364 B 1 +ATOM 5562 C CA . LEU B ? 364 ? -3.799 11.328 20.661 1.0 98.92 364 B 1 +ATOM 5563 C C . LEU B ? 364 ? -2.370 11.210 21.213 1.0 98.91 364 B 1 +ATOM 5564 O O . LEU B ? 364 ? -2.143 11.525 22.378 1.0 98.78 364 B 1 +ATOM 5565 C CB . LEU B ? 364 ? -4.469 9.946 20.624 1.0 98.89 364 B 1 +ATOM 5566 C CG . LEU B ? 364 ? -5.999 9.969 20.467 1.0 98.63 364 B 1 +ATOM 5567 C CD1 . LEU B ? 364 ? -6.496 8.528 20.331 1.0 98.36 364 B 1 +ATOM 5568 C CD2 . LEU B ? 364 ? -6.705 10.604 21.664 1.0 98.31 364 B 1 +ATOM 5569 N N . VAL B ? 365 ? -1.389 10.821 20.386 1.0 98.92 365 B 1 +ATOM 5570 C CA . VAL B ? 365 ? 0.032 10.729 20.787 1.0 98.88 365 B 1 +ATOM 5571 C C . VAL B ? 365 ? 0.553 12.056 21.359 1.0 98.81 365 B 1 +ATOM 5572 O O . VAL B ? 365 ? 1.350 12.052 22.303 1.0 98.43 365 B 1 +ATOM 5573 C CB . VAL B ? 365 ? 0.902 10.265 19.596 1.0 98.76 365 B 1 +ATOM 5574 C CG1 . VAL B ? 365 ? 2.409 10.420 19.834 1.0 98.03 365 B 1 +ATOM 5575 C CG2 . VAL B ? 365 ? 0.658 8.780 19.287 1.0 98.16 365 B 1 +ATOM 5576 N N . HIS B ? 366 ? 0.091 13.199 20.838 1.0 98.77 366 B 1 +ATOM 5577 C CA . HIS B ? 366 ? 0.499 14.526 21.311 1.0 98.63 366 B 1 +ATOM 5578 C C . HIS B ? 366 ? -0.385 15.091 22.431 1.0 98.47 366 B 1 +ATOM 5579 O O . HIS B ? 366 ? 0.115 15.825 23.290 1.0 97.72 366 B 1 +ATOM 5580 C CB . HIS B ? 366 ? 0.574 15.482 20.118 1.0 98.39 366 B 1 +ATOM 5581 C CG . HIS B ? 366 ? 1.796 15.238 19.275 1.0 98.37 366 B 1 +ATOM 5582 N ND1 . HIS B ? 366 ? 3.111 15.333 19.713 1.0 92.74 366 B 1 +ATOM 5583 C CD2 . HIS B ? 366 ? 1.825 14.871 17.951 1.0 92.79 366 B 1 +ATOM 5584 C CE1 . HIS B ? 366 ? 3.902 15.039 18.674 1.0 95.02 366 B 1 +ATOM 5585 N NE2 . HIS B ? 366 ? 3.162 14.754 17.588 1.0 95.56 366 B 1 +ATOM 5586 N N . THR B ? 367 ? -1.673 14.742 22.437 1.0 98.71 367 B 1 +ATOM 5587 C CA . THR B ? 367 ? -2.688 15.371 23.302 1.0 98.59 367 B 1 +ATOM 5588 C C . THR B ? 367 ? -2.834 14.701 24.668 1.0 98.64 367 B 1 +ATOM 5589 O O . THR B ? 367 ? -3.035 15.391 25.672 1.0 97.94 367 B 1 +ATOM 5590 C CB . THR B ? 367 ? -4.041 15.394 22.574 1.0 97.7 367 B 1 +ATOM 5591 O OG1 . THR B ? 367 ? -3.893 16.151 21.394 1.0 86.88 367 B 1 +ATOM 5592 C CG2 . THR B ? 367 ? -5.142 16.068 23.391 1.0 84.79 367 B 1 +ATOM 5593 N N . LEU B ? 368 ? -2.725 13.371 24.732 1.0 98.73 368 B 1 +ATOM 5594 C CA . LEU B ? 368 ? -2.817 12.640 25.995 1.0 98.75 368 B 1 +ATOM 5595 C C . LEU B ? 368 ? -1.749 13.122 26.990 1.0 98.67 368 B 1 +ATOM 5596 O O . LEU B ? 368 ? -0.615 13.445 26.622 1.0 98.39 368 B 1 +ATOM 5597 C CB . LEU B ? 368 ? -2.678 11.129 25.746 1.0 98.74 368 B 1 +ATOM 5598 C CG . LEU B ? 368 ? -3.872 10.468 25.036 1.0 98.5 368 B 1 +ATOM 5599 C CD1 . LEU B ? 368 ? -3.465 9.063 24.586 1.0 98.25 368 B 1 +ATOM 5600 C CD2 . LEU B ? 368 ? -5.091 10.346 25.944 1.0 98.23 368 B 1 +ATOM 5601 N N . LYS B ? 369 ? -2.102 13.119 28.280 1.0 98.71 369 B 1 +ATOM 5602 C CA . LYS B ? 369 ? -1.162 13.349 29.381 1.0 98.66 369 B 1 +ATOM 5603 C C . LYS B ? 369 ? -0.530 12.020 29.815 1.0 98.77 369 B 1 +ATOM 5604 O O . LYS B ? 369 ? -1.157 10.975 29.631 1.0 98.46 369 B 1 +ATOM 5605 C CB . LYS B ? 369 ? -1.873 14.043 30.547 1.0 98.27 369 B 1 +ATOM 5606 C CG . LYS B ? 369 ? -2.396 15.433 30.154 1.0 96.01 369 B 1 +ATOM 5607 C CD . LYS B ? 369 ? -3.111 16.084 31.338 1.0 89.83 369 B 1 +ATOM 5608 C CE . LYS B ? 369 ? -3.695 17.428 30.896 1.0 82.62 369 B 1 +ATOM 5609 N NZ . LYS B ? 369 ? -4.512 18.043 31.972 1.0 70.97 369 B 1 +ATOM 5610 N N . PRO B ? 370 ? 0.668 12.029 30.420 1.0 98.53 370 B 1 +ATOM 5611 C CA . PRO B ? 370 ? 1.311 10.811 30.912 1.0 98.53 370 B 1 +ATOM 5612 C C . PRO B ? 370 ? 0.368 9.946 31.760 1.0 98.57 370 B 1 +ATOM 5613 O O . PRO B ? 370 ? -0.312 10.459 32.647 1.0 97.94 370 B 1 +ATOM 5614 C CB . PRO B ? 370 ? 2.523 11.292 31.712 1.0 98.2 370 B 1 +ATOM 5615 C CG . PRO B ? 370 ? 2.898 12.602 31.022 1.0 97.16 370 B 1 +ATOM 5616 C CD . PRO B ? 370 ? 1.539 13.185 30.646 1.0 98.29 370 B 1 +ATOM 5617 N N . GLY B ? 371 ? 0.319 8.644 31.462 1.0 98.23 371 B 1 +ATOM 5618 C CA . GLY B ? 371 ? -0.560 7.663 32.109 1.0 98.14 371 B 1 +ATOM 5619 C C . GLY B ? 371 ? -1.991 7.602 31.559 1.0 98.46 371 B 1 +ATOM 5620 O O . GLY B ? 371 ? -2.696 6.635 31.846 1.0 97.51 371 B 1 +ATOM 5621 N N . GLN B ? 372 ? -2.426 8.582 30.764 1.0 98.69 372 B 1 +ATOM 5622 C CA . GLN B ? 372 ? -3.748 8.547 30.134 1.0 98.76 372 B 1 +ATOM 5623 C C . GLN B ? 372 ? -3.799 7.560 28.965 1.0 98.83 372 B 1 +ATOM 5624 O O . GLN B ? 372 ? -2.814 7.351 28.253 1.0 98.67 372 B 1 +ATOM 5625 C CB . GLN B ? 372 ? -4.185 9.942 29.661 1.0 98.61 372 B 1 +ATOM 5626 C CG . GLN B ? 372 ? -4.454 10.898 30.829 1.0 98.07 372 B 1 +ATOM 5627 C CD . GLN B ? 372 ? -5.130 12.187 30.361 1.0 98.01 372 B 1 +ATOM 5628 O OE1 . GLN B ? 372 ? -4.743 12.832 29.395 1.0 94.64 372 B 1 +ATOM 5629 N NE2 . GLN B ? 372 ? -6.178 12.608 31.030 1.0 94.22 372 B 1 +ATOM 5630 N N . LYS B ? 373 ? -4.994 7.001 28.728 1.0 98.88 373 B 1 +ATOM 5631 C CA . LYS B ? 373 ? -5.291 6.122 27.598 1.0 98.92 373 B 1 +ATOM 5632 C C . LYS B ? 373 ? -6.196 6.821 26.593 1.0 98.94 373 B 1 +ATOM 5633 O O . LYS B ? 373 ? -7.154 7.495 26.971 1.0 98.84 373 B 1 +ATOM 5634 C CB . LYS B ? 373 ? -5.907 4.811 28.094 1.0 98.79 373 B 1 +ATOM 5635 C CG . LYS B ? 373 ? -4.980 4.063 29.068 1.0 97.88 373 B 1 +ATOM 5636 C CD . LYS B ? 373 ? -5.624 2.769 29.550 1.0 96.25 373 B 1 +ATOM 5637 C CE . LYS B ? 373 ? -4.810 2.133 30.684 1.0 91.69 373 B 1 +ATOM 5638 N NZ . LYS B ? 373 ? -4.986 2.868 31.961 1.0 86.32 373 B 1 +ATOM 5639 N N . GLY B ? 374 ? -5.911 6.641 25.319 1.0 98.94 374 B 1 +ATOM 5640 C CA . GLY B ? 374 ? -6.719 7.161 24.223 1.0 98.95 374 B 1 +ATOM 5641 C C . GLY B ? 374 ? -7.188 6.049 23.298 1.0 98.96 374 B 1 +ATOM 5642 O O . GLY B ? 374 ? -6.438 5.116 23.016 1.0 98.88 374 B 1 +ATOM 5643 N N . CYS B ? 375 ? -8.411 6.155 22.809 1.0 98.95 375 B 1 +ATOM 5644 C CA . CYS B ? 375 ? -8.946 5.253 21.790 1.0 98.96 375 B 1 +ATOM 5645 C C . CYS B ? 375 ? -9.265 6.029 20.512 1.0 98.96 375 B 1 +ATOM 5646 O O . CYS B ? 375 ? -10.024 6.998 20.541 1.0 98.92 375 B 1 +ATOM 5647 C CB . CYS B ? 375 ? -10.169 4.515 22.351 1.0 98.93 375 B 1 +ATOM 5648 S SG . CYS B ? 375 ? -10.815 3.325 21.133 1.0 98.76 375 B 1 +ATOM 5649 N N . ALA B ? 376 ? -8.714 5.587 19.395 1.0 98.97 376 B 1 +ATOM 5650 C CA . ALA B ? 376 ? -9.029 6.097 18.070 1.0 98.97 376 B 1 +ATOM 5651 C C . ALA B ? 376 ? -9.868 5.075 17.299 1.0 98.97 376 B 1 +ATOM 5652 O O . ALA B ? 376 ? -9.541 3.887 17.287 1.0 98.91 376 B 1 +ATOM 5653 C CB . ALA B ? 376 ? -7.729 6.446 17.339 1.0 98.91 376 B 1 +ATOM 5654 N N . ALA B ? 377 ? -10.930 5.518 16.631 1.0 98.96 377 B 1 +ATOM 5655 C CA . ALA B ? 377 ? -11.740 4.680 15.755 1.0 98.97 377 B 1 +ATOM 5656 C C . ALA B ? 377 ? -12.136 5.436 14.481 1.0 98.97 377 B 1 +ATOM 5657 O O . ALA B ? 377 ? -12.430 6.628 14.506 1.0 98.91 377 B 1 +ATOM 5658 C CB . ALA B ? 377 ? -12.965 4.168 16.522 1.0 98.93 377 B 1 +ATOM 5659 N N . ILE B ? 378 ? -12.157 4.730 13.352 1.0 98.95 378 B 1 +ATOM 5660 C CA . ILE B ? 378 ? -12.477 5.319 12.052 1.0 98.96 378 B 1 +ATOM 5661 C C . ILE B ? 378 ? -13.263 4.326 11.197 1.0 98.95 378 B 1 +ATOM 5662 O O . ILE B ? 378 ? -12.817 3.205 10.971 1.0 98.82 378 B 1 +ATOM 5663 C CB . ILE B ? 378 ? -11.196 5.851 11.367 1.0 98.92 378 B 1 +ATOM 5664 C CG1 . ILE B ? 378 ? -11.532 6.533 10.024 1.0 98.77 378 B 1 +ATOM 5665 C CG2 . ILE B ? 378 ? -10.111 4.769 11.180 1.0 98.74 378 B 1 +ATOM 5666 C CD1 . ILE B ? 378 ? -10.403 7.415 9.480 1.0 98.34 378 B 1 +ATOM 5667 N N . CYS B ? 379 ? -14.434 4.741 10.708 1.0 98.9 379 B 1 +ATOM 5668 C CA . CYS B ? 379 ? -15.189 3.964 9.731 1.0 98.86 379 B 1 +ATOM 5669 C C . CYS B ? 379 ? -14.516 4.008 8.354 1.0 98.87 379 B 1 +ATOM 5670 O O . CYS B ? 379 ? -13.765 4.934 8.034 1.0 98.7 379 B 1 +ATOM 5671 C CB . CYS B ? 379 ? -16.646 4.451 9.679 1.0 98.52 379 B 1 +ATOM 5672 S SG . CYS B ? 379 ? -16.756 6.190 9.177 1.0 97.85 379 B 1 +ATOM 5673 N N . ASN B ? 380 ? -14.821 3.022 7.515 1.0 98.77 380 B 1 +ATOM 5674 C CA . ASN B ? 380 ? -14.377 3.009 6.127 1.0 98.73 380 B 1 +ATOM 5675 C C . ASN B ? 380 ? -15.453 2.468 5.188 1.0 98.72 380 B 1 +ATOM 5676 O O . ASN B ? 380 ? -16.245 1.609 5.579 1.0 98.18 380 B 1 +ATOM 5677 C CB . ASN B ? 380 ? -13.040 2.261 6.017 1.0 98.36 380 B 1 +ATOM 5678 C CG . ASN B ? 380 ? -13.079 0.791 6.406 1.0 98.43 380 B 1 +ATOM 5679 O OD1 . ASN B ? 380 ? -12.578 0.391 7.446 1.0 93.48 380 B 1 +ATOM 5680 N ND2 . ASN B ? 380 ? -13.578 -0.069 5.555 1.0 92.4 380 B 1 +ATOM 5681 N N . GLY B ? 381 ? -15.467 2.937 3.938 1.0 98.36 381 B 1 +ATOM 5682 C CA . GLY B ? 381 ? -16.345 2.405 2.902 1.0 98.1 381 B 1 +ATOM 5683 C C . GLY B ? 381 ? -16.234 0.876 2.777 1.0 98.16 381 B 1 +ATOM 5684 O O . GLY B ? 381 ? -15.228 0.273 3.159 1.0 97.33 381 B 1 +ATOM 5685 N N . GLY B ? 382 ? -17.290 0.235 2.288 1.0 97.95 382 B 1 +ATOM 5686 C CA . GLY B ? 382 ? -17.391 -1.228 2.307 1.0 98.03 382 B 1 +ATOM 5687 C C . GLY B ? 382 ? -17.782 -1.811 3.674 1.0 98.38 382 B 1 +ATOM 5688 O O . GLY B ? 382 ? -17.681 -3.021 3.866 1.0 97.38 382 B 1 +ATOM 5689 N N . GLY B ? 383 ? -18.227 -0.978 4.618 1.0 98.44 383 B 1 +ATOM 5690 C CA . GLY B ? 383 ? -18.818 -1.414 5.891 1.0 98.54 383 B 1 +ATOM 5691 C C . GLY B ? 383 ? -17.825 -1.698 7.016 1.0 98.65 383 B 1 +ATOM 5692 O O . GLY B ? 383 ? -18.185 -2.356 7.992 1.0 97.92 383 B 1 +ATOM 5693 N N . GLY B ? 384 ? -16.586 -1.229 6.919 1.0 98.62 384 B 1 +ATOM 5694 C CA . GLY B ? 384 ? -15.549 -1.505 7.906 1.0 98.67 384 B 1 +ATOM 5695 C C . GLY B ? 384 ? -15.269 -0.370 8.894 1.0 98.81 384 B 1 +ATOM 5696 O O . GLY B ? 384 ? -15.726 0.761 8.744 1.0 98.61 384 B 1 +ATOM 5697 N N . ALA B ? 385 ? -14.450 -0.689 9.894 1.0 98.86 385 B 1 +ATOM 5698 C CA . ALA B ? 385 ? -13.791 0.285 10.752 1.0 98.9 385 B 1 +ATOM 5699 C C . ALA B ? 385 ? -12.433 -0.237 11.233 1.0 98.9 385 B 1 +ATOM 5700 O O . ALA B ? 385 ? -12.230 -1.443 11.373 1.0 98.78 385 B 1 +ATOM 5701 C CB . ALA B ? 385 ? -14.690 0.635 11.940 1.0 98.8 385 B 1 +ATOM 5702 N N . GLY B ? 386 ? -11.514 0.683 11.517 1.0 98.91 386 B 1 +ATOM 5703 C CA . GLY B ? 386 ? -10.295 0.425 12.277 1.0 98.92 386 B 1 +ATOM 5704 C C . GLY B ? 386 ? -10.394 1.021 13.679 1.0 98.95 386 B 1 +ATOM 5705 O O . GLY B ? 386 ? -11.069 2.035 13.880 1.0 98.89 386 B 1 +ATOM 5706 N N . GLY B ? 387 ? -9.708 0.412 14.637 1.0 98.94 387 B 1 +ATOM 5707 C CA . GLY B ? 387 ? -9.621 0.899 16.009 1.0 98.93 387 B 1 +ATOM 5708 C C . GLY B ? 387 ? -8.238 0.679 16.612 1.0 98.93 387 B 1 +ATOM 5709 O O . GLY B ? 387 ? -7.569 -0.310 16.318 1.0 98.76 387 B 1 +ATOM 5710 N N . MET B ? 388 ? -7.813 1.612 17.469 1.0 98.9 388 B 1 +ATOM 5711 C CA . MET B ? 388 ? -6.560 1.529 18.221 1.0 98.87 388 B 1 +ATOM 5712 C C . MET B ? 388 ? -6.735 2.079 19.628 1.0 98.94 388 B 1 +ATOM 5713 O O . MET B ? 388 ? -7.469 3.037 19.837 1.0 98.81 388 B 1 +ATOM 5714 C CB . MET B ? 388 ? -5.440 2.305 17.510 1.0 97.89 388 B 1 +ATOM 5715 C CG . MET B ? 388 ? -4.870 1.513 16.344 1.0 88.54 388 B 1 +ATOM 5716 S SD . MET B ? 388 ? -3.469 2.291 15.516 1.0 93.81 388 B 1 +ATOM 5717 C CE . MET B ? 388 ? -2.995 0.894 14.486 1.0 89.99 388 B 1 +ATOM 5718 N N . ILE B ? 389 ? -6.014 1.496 20.581 1.0 98.88 389 B 1 +ATOM 5719 C CA . ILE B ? 389 ? -5.866 2.043 21.931 1.0 98.89 389 B 1 +ATOM 5720 C C . ILE B ? 389 ? -4.381 2.241 22.201 1.0 98.87 389 B 1 +ATOM 5721 O O . ILE B ? 389 ? -3.574 1.341 21.978 1.0 98.77 389 B 1 +ATOM 5722 C CB . ILE B ? 389 ? -6.551 1.167 23.002 1.0 98.87 389 B 1 +ATOM 5723 C CG1 . ILE B ? 389 ? -8.048 0.974 22.668 1.0 98.48 389 B 1 +ATOM 5724 C CG2 . ILE B ? 389 ? -6.393 1.811 24.397 1.0 98.66 389 B 1 +ATOM 5725 C CD1 . ILE B ? 389 ? -8.789 0.038 23.622 1.0 97.84 389 B 1 +ATOM 5726 N N . ILE B ? 390 ? -4.033 3.422 22.690 1.0 98.9 390 B 1 +ATOM 5727 C CA . ILE B ? 390 ? -2.671 3.788 23.081 1.0 98.91 390 B 1 +ATOM 5728 C C . ILE B ? 390 ? -2.652 4.323 24.511 1.0 98.91 390 B 1 +ATOM 5729 O O . ILE B ? 390 ? -3.656 4.815 25.022 1.0 98.83 390 B 1 +ATOM 5730 C CB . ILE B ? 390 ? -2.032 4.782 22.081 1.0 98.83 390 B 1 +ATOM 5731 C CG1 . ILE B ? 390 ? -2.718 6.164 22.101 1.0 98.17 390 B 1 +ATOM 5732 C CG2 . ILE B ? 390 ? -2.027 4.182 20.663 1.0 97.89 390 B 1 +ATOM 5733 C CD1 . ILE B ? 390 ? -1.985 7.225 21.273 1.0 97.64 390 B 1 +ATOM 5734 N N . GLU B ? 391 ? -1.498 4.256 25.157 1.0 98.87 391 B 1 +ATOM 5735 C CA . GLU B ? 391 ? -1.241 4.850 26.472 1.0 98.85 391 B 1 +ATOM 5736 C C . GLU B ? 391 ? -0.090 5.845 26.362 1.0 98.86 391 B 1 +ATOM 5737 O O . GLU B ? 391 ? 0.974 5.518 25.833 1.0 98.7 391 B 1 +ATOM 5738 C CB . GLU B ? 391 ? -0.941 3.734 27.480 1.0 98.66 391 B 1 +ATOM 5739 C CG . GLU B ? 391 ? -0.611 4.242 28.889 1.0 97.96 391 B 1 +ATOM 5740 C CD . GLU B ? 391 ? -0.349 3.091 29.872 1.0 97.55 391 B 1 +ATOM 5741 O OE1 . GLU B ? 391 ? -0.729 3.228 31.052 1.0 93.81 391 B 1 +ATOM 5742 O OE2 . GLU B ? 391 ? 0.237 2.065 29.454 1.0 94.05 391 B 1 +ATOM 5743 N N . LYS B ? 392 ? -0.298 7.059 26.874 1.0 98.81 392 B 1 +ATOM 5744 C CA . LYS B ? 392 ? 0.733 8.100 26.910 1.0 98.78 392 B 1 +ATOM 5745 C C . LYS B ? 392 ? 1.810 7.737 27.924 1.0 98.75 392 B 1 +ATOM 5746 O O . LYS B ? 392 ? 1.502 7.342 29.046 1.0 98.12 392 B 1 +ATOM 5747 C CB . LYS B ? 392 ? 0.092 9.456 27.227 1.0 98.46 392 B 1 +ATOM 5748 C CG . LYS B ? 392 ? 1.061 10.640 27.119 1.0 96.48 392 B 1 +ATOM 5749 C CD . LYS B ? 392 ? 1.406 10.962 25.666 1.0 94.37 392 B 1 +ATOM 5750 C CE . LYS B ? 392 ? 2.232 12.247 25.578 1.0 92.19 392 B 1 +ATOM 5751 N NZ . LYS B ? 392 ? 2.229 12.793 24.201 1.0 89.79 392 B 1 +ATOM 5752 N N . LEU B ? 393 ? 3.066 7.910 27.529 1.0 97.89 393 B 1 +ATOM 5753 C CA . LEU B ? 393 ? 4.243 7.681 28.361 1.0 97.53 393 B 1 +ATOM 5754 C C . LEU B ? 393 ? 4.796 8.984 28.954 1.0 95.78 393 B 1 +ATOM 5755 O O . LEU B ? 393 ? 4.595 10.063 28.369 1.0 89.72 393 B 1 +ATOM 5756 C CB . LEU B ? 393 ? 5.289 6.898 27.557 1.0 96.59 393 B 1 +ATOM 5757 C CG . LEU B ? 393 ? 4.839 5.484 27.130 1.0 96.66 393 B 1 +ATOM 5758 C CD1 . LEU B ? 393 ? 5.907 4.835 26.257 1.0 94.6 393 B 1 +ATOM 5759 C CD2 . LEU B ? 393 ? 4.596 4.576 28.339 1.0 94.35 393 B 1 +ATOM 5760 O OXT . LEU B ? 393 ? 5.439 8.890 30.038 1.0 91.93 393 B 1 +HETATM 5761 N N1A . ACO C ? . ? 8.227 -13.871 -30.484 1.0 95.33 1 C 1 +HETATM 5762 C C2A . ACO C ? . ? 8.573 -13.270 -31.634 1.0 95.8 1 C 1 +HETATM 5763 N N3A . ACO C ? . ? 8.244 -12.020 -31.943 1.0 96.37 1 C 1 +HETATM 5764 C C4A . ACO C ? . ? 7.539 -11.329 -31.046 1.0 96.82 1 C 1 +HETATM 5765 C C5A . ACO C ? . ? 7.146 -11.863 -29.831 1.0 96.7 1 C 1 +HETATM 5766 C C6A . ACO C ? . ? 7.523 -13.200 -29.560 1.0 96.34 1 C 1 +HETATM 5767 N N6A . ACO C ? . ? 7.204 -13.804 -28.415 1.0 95.14 1 C 1 +HETATM 5768 N N7A . ACO C ? . ? 6.458 -10.921 -29.142 1.0 95.72 1 C 1 +HETATM 5769 C C8A . ACO C ? . ? 6.426 -9.839 -29.909 1.0 96.13 1 C 1 +HETATM 5770 N N9A . ACO C ? . ? 7.086 -10.082 -31.074 1.0 96.56 1 C 1 +HETATM 5771 C C1B . ACO C ? . ? 7.285 -9.172 -32.180 1.0 96.56 1 C 1 +HETATM 5772 C C2B . ACO C ? . ? 5.986 -8.771 -32.831 1.0 96.19 1 C 1 +HETATM 5773 O O2B . ACO C ? . ? 5.570 -9.711 -33.790 1.0 94.03 1 C 1 +HETATM 5774 C C3B . ACO C ? . ? 6.341 -7.435 -33.425 1.0 95.88 1 C 1 +HETATM 5775 O O3B . ACO C ? . ? 7.031 -7.654 -34.641 1.0 93.33 1 C 1 +HETATM 5776 P P3B . ACO C ? . ? 6.866 -6.643 -35.866 1.0 88.67 1 C 1 +HETATM 5777 O O7A . ACO C ? . ? 5.418 -6.717 -36.270 1.0 74.43 1 C 1 +HETATM 5778 O O8A . ACO C ? . ? 7.243 -5.264 -35.374 1.0 77.51 1 C 1 +HETATM 5779 O O9A . ACO C ? . ? 7.820 -7.172 -36.899 1.0 75.8 1 C 1 +HETATM 5780 C C4B . ACO C ? . ? 7.321 -6.867 -32.411 1.0 95.61 1 C 1 +HETATM 5781 O O4B . ACO C ? . ? 7.865 -7.976 -31.716 1.0 96.04 1 C 1 +HETATM 5782 C C5B . ACO C ? . ? 6.667 -5.941 -31.425 1.0 92.76 1 C 1 +HETATM 5783 O O5B . ACO C ? . ? 5.592 -6.656 -30.834 1.0 91.93 1 C 1 +HETATM 5784 P P1A . ACO C ? . ? 4.309 -5.936 -30.305 1.0 91.23 1 C 1 +HETATM 5785 O O1A . ACO C ? . ? 3.321 -6.958 -29.863 1.0 75.61 1 C 1 +HETATM 5786 O O2A . ACO C ? . ? 3.822 -4.932 -31.316 1.0 74.42 1 C 1 +HETATM 5787 O O3A . ACO C ? . ? 4.891 -5.193 -29.041 1.0 90.64 1 C 1 +HETATM 5788 P P2A . ACO C ? . ? 4.507 -3.813 -28.437 1.0 90.84 1 C 1 +HETATM 5789 O O4A . ACO C ? . ? 5.366 -2.775 -29.088 1.0 76.6 1 C 1 +HETATM 5790 O O5A . ACO C ? . ? 3.019 -3.634 -28.495 1.0 76.14 1 C 1 +HETATM 5791 O O6A . ACO C ? . ? 4.914 -3.987 -26.895 1.0 92.89 1 C 1 +HETATM 5792 C CBP . ACO C ? . ? 6.539 -4.170 -25.139 1.0 96.54 1 C 1 +HETATM 5793 C CCP . ACO C ? . ? 6.115 -4.601 -26.533 1.0 92.66 1 C 1 +HETATM 5794 C CDP . ACO C ? . ? 7.773 -4.973 -24.769 1.0 88.2 1 C 1 +HETATM 5795 C CEP . ACO C ? . ? 6.897 -2.675 -25.161 1.0 86.24 1 C 1 +HETATM 5796 C CAP . ACO C ? . ? 5.410 -4.424 -24.114 1.0 96.78 1 C 1 +HETATM 5797 O OAP . ACO C ? . ? 5.057 -5.779 -24.078 1.0 95.12 1 C 1 +HETATM 5798 C C9P . ACO C ? . ? 5.842 -4.017 -22.718 1.0 97.26 1 C 1 +HETATM 5799 O O9P . ACO C ? . ? 5.716 -2.843 -22.360 1.0 95.39 1 C 1 +HETATM 5800 N N8P . ACO C ? . ? 6.380 -4.969 -21.928 1.0 96.54 1 C 1 +HETATM 5801 C C7P . ACO C ? . ? 6.928 -4.656 -20.631 1.0 96.58 1 C 1 +HETATM 5802 C C6P . ACO C ? . ? 5.883 -4.720 -19.548 1.0 96.59 1 C 1 +HETATM 5803 C C5P . ACO C ? . ? 6.477 -4.343 -18.201 1.0 97.71 1 C 1 +HETATM 5804 O O5P . ACO C ? . ? 7.257 -3.405 -18.099 1.0 96.49 1 C 1 +HETATM 5805 N N4P . ACO C ? . ? 6.082 -5.061 -17.144 1.0 96.7 1 C 1 +HETATM 5806 C C3P . ACO C ? . ? 6.558 -4.808 -15.810 1.0 92.51 1 C 1 +HETATM 5807 C C2P . ACO C ? . ? 7.880 -5.524 -15.557 1.0 89.16 1 C 1 +HETATM 5808 S S1P . ACO C ? . ? 8.787 -4.650 -14.314 1.0 91.42 1 C 1 +HETATM 5809 C C . ACO C ? . ? 8.635 -5.565 -12.908 1.0 94.25 1 C 1 +HETATM 5810 O O . ACO C ? . ? 7.934 -6.533 -12.820 1.0 90.69 1 C 1 +HETATM 5811 C CH3 . ACO C ? . ? 9.450 -5.050 -11.733 1.0 88.39 1 C 1 +HETATM 5812 N N1A . ACO D ? . ? -21.543 26.149 7.498 1.0 95.23 1 D 1 +HETATM 5813 C C2A . ACO D ? . ? -22.587 26.718 6.864 1.0 95.71 1 D 1 +HETATM 5814 N N3A . ACO D ? . ? -22.885 26.515 5.586 1.0 96.29 1 D 1 +HETATM 5815 C C4A . ACO D ? . ? -22.097 25.680 4.897 1.0 96.68 1 D 1 +HETATM 5816 C C5A . ACO D ? . ? -21.001 25.042 5.467 1.0 96.61 1 D 1 +HETATM 5817 C C6A . ACO D ? . ? -20.734 25.303 6.833 1.0 96.21 1 D 1 +HETATM 5818 N N6A . ACO D ? . ? -19.708 24.739 7.475 1.0 94.9 1 D 1 +HETATM 5819 N N7A . ACO D ? . ? -20.409 24.267 4.524 1.0 95.6 1 D 1 +HETATM 5820 C C8A . ACO D ? . ? -21.119 24.425 3.410 1.0 96.06 1 D 1 +HETATM 5821 N N9A . ACO D ? . ? -22.152 25.282 3.630 1.0 96.49 1 D 1 +HETATM 5822 C C1B . ACO D ? . ? -23.160 25.719 2.689 1.0 96.61 1 D 1 +HETATM 5823 C C2B . ACO D ? . ? -22.565 26.495 1.540 1.0 96.09 1 D 1 +HETATM 5824 O O2B . ACO D ? . ? -22.387 27.856 1.863 1.0 94.05 1 D 1 +HETATM 5825 C C3B . ACO D ? . ? -23.582 26.254 0.458 1.0 95.82 1 D 1 +HETATM 5826 O O3B . ACO D ? . ? -24.667 27.142 0.669 1.0 93.4 1 D 1 +HETATM 5827 P P3B . ACO D ? . ? -25.459 27.752 -0.562 1.0 88.87 1 D 1 +HETATM 5828 O O7A . ACO D ? . ? -24.462 28.583 -1.314 1.0 75.45 1 D 1 +HETATM 5829 O O8A . ACO D ? . ? -25.976 26.592 -1.389 1.0 78.02 1 D 1 +HETATM 5830 O O9A . ACO D ? . ? -26.569 28.541 0.081 1.0 76.6 1 D 1 +HETATM 5831 C C4B . ACO D ? . ? -24.057 24.840 0.740 1.0 95.81 1 D 1 +HETATM 5832 O O4B . ACO D ? . ? -23.786 24.597 2.107 1.0 96.1 1 D 1 +HETATM 5833 C C5B . ACO D ? . ? -23.345 23.813 -0.090 1.0 92.97 1 D 1 +HETATM 5834 O O5B . ACO D ? . ? -21.941 23.994 0.116 1.0 92.21 1 D 1 +HETATM 5835 P P1A . ACO D ? . ? -20.878 23.650 -0.973 1.0 91.62 1 D 1 +HETATM 5836 O O1A . ACO D ? . ? -19.534 24.075 -0.500 1.0 76.25 1 D 1 +HETATM 5837 O O2A . ACO D ? . ? -21.312 24.190 -2.311 1.0 75.47 1 D 1 +HETATM 5838 O O3A . ACO D ? . ? -20.960 22.073 -0.968 1.0 90.95 1 D 1 +HETATM 5839 P P2A . ACO D ? . ? -20.804 21.069 -2.139 1.0 91.36 1 D 1 +HETATM 5840 O O4A . ACO D ? . ? -22.163 20.856 -2.733 1.0 77.61 1 D 1 +HETATM 5841 O O5A . ACO D ? . ? -19.699 21.518 -3.039 1.0 76.78 1 D 1 +HETATM 5842 O O6A . ACO D ? . ? -20.323 19.745 -1.387 1.0 93.23 1 D 1 +HETATM 5843 C CBP . ACO D ? . ? -20.714 17.850 0.021 1.0 96.88 1 D 1 +HETATM 5844 C CCP . ACO D ? . ? -20.917 19.339 -0.197 1.0 93.2 1 D 1 +HETATM 5845 C CDP . ACO D ? . ? -21.268 17.517 1.392 1.0 88.92 1 D 1 +HETATM 5846 C CEP . ACO D ? . ? -21.496 17.083 -1.044 1.0 87.13 1 D 1 +HETATM 5847 C CAP . ACO D ? . ? -19.213 17.485 -0.054 1.0 97.01 1 D 1 +HETATM 5848 O OAP . ACO D ? . ? -18.464 18.193 0.903 1.0 95.48 1 D 1 +HETATM 5849 C C9P . ACO D ? . ? -19.005 16.003 0.189 1.0 97.5 1 D 1 +HETATM 5850 O O9P . ACO D ? . ? -19.115 15.218 -0.750 1.0 96.07 1 D 1 +HETATM 5851 N N8P . ACO D ? . ? -18.730 15.612 1.450 1.0 96.94 1 D 1 +HETATM 5852 C C7P . ACO D ? . ? -18.641 14.217 1.802 1.0 96.77 1 D 1 +HETATM 5853 C C6P . ACO D ? . ? -17.237 13.693 1.624 1.0 96.73 1 D 1 +HETATM 5854 C C5P . ACO D ? . ? -17.180 12.206 1.953 1.0 97.83 1 D 1 +HETATM 5855 O O5P . ACO D ? . ? -18.066 11.449 1.597 1.0 96.78 1 D 1 +HETATM 5856 N N4P . ACO D ? . ? -16.103 11.782 2.637 1.0 96.8 1 D 1 +HETATM 5857 C C3P . ACO D ? . ? -15.911 10.404 3.010 1.0 92.69 1 D 1 +HETATM 5858 C C2P . ACO D ? . ? -16.630 10.100 4.327 1.0 89.22 1 D 1 +HETATM 5859 S S1P . ACO D ? . ? -17.020 8.384 4.374 1.0 92.29 1 D 1 +HETATM 5860 C C . ACO D ? . ? -15.913 7.664 5.410 1.0 94.67 1 D 1 +HETATM 5861 O O . ACO D ? . ? -14.991 8.262 5.889 1.0 90.68 1 D 1 +HETATM 5862 C CH3 . ACO D ? . ? -16.152 6.197 5.685 1.0 87.94 1 D 1 # diff --git a/tests/test_file_handlers.py b/tests/test_file_handlers.py index 7b89361..433a2e2 100644 --- a/tests/test_file_handlers.py +++ b/tests/test_file_handlers.py @@ -37,26 +37,88 @@ def test_cif_file(test_data): assert cif_file.h_score == 89 plddt_regions_check = { - 'v_low': [(0, 1), (393, 394)], - 'low': [(2, 2), (395, 395)], - 'confident': [(3, 4), (23, 23), (28, 28), (44, 44), (49, 49), (134, 141), - (176, 176), (180, 180), (200, 200), (206, 206), (208, 214), - (228, 228), (234, 234), (240, 240), (267, 267), (272, 272), - (330, 330), (396, 397), (416, 416), (421, 421), (437, 437), - (442, 442), (527, 534), (569, 569), (573, 573), (593, 593), - (599, 599), (601, 607), (610, 610), (621, 621), (627, 627), - (633, 633), (660, 660), (665, 665), (723, 723)], - 'v_high': [(5, 22), (24, 27), (29, 43), (45, 48), (50, 133), (142, 175), - (177, 179), (181, 199), (201, 205), (207, 207), (215, 227), - (229, 233), (235, 239), (241, 266), (268, 271), (273, 329), - (331, 392), (398, 415), (417, 420), (422, 436), (438, 441), - (443, 526), (535, 568), (570, 572), (574, 592), (594, 598), - (600, 600), (608, 609), (611, 620), (622, 626), (628, 632), - (634, 659), (661, 664), (666, 722), (724, 787)] + "v_low": [(0, 1), (393, 394)], + "low": [(2, 2), (395, 395)], + "confident": [ + (3, 4), + (23, 23), + (28, 28), + (44, 44), + (49, 49), + (134, 141), + (176, 176), + (180, 180), + (200, 200), + (206, 206), + (208, 214), + (228, 228), + (234, 234), + (240, 240), + (267, 267), + (272, 272), + (330, 330), + (396, 397), + (416, 416), + (421, 421), + (437, 437), + (442, 442), + (527, 534), + (569, 569), + (573, 573), + (593, 593), + (599, 599), + (601, 607), + (610, 610), + (621, 621), + (627, 627), + (633, 633), + (660, 660), + (665, 665), + (723, 723), + ], + "v_high": [ + (5, 22), + (24, 27), + (29, 43), + (45, 48), + (50, 133), + (142, 175), + (177, 179), + (181, 199), + (201, 205), + (207, 207), + (215, 227), + (229, 233), + (235, 239), + (241, 266), + (268, 271), + (273, 329), + (331, 392), + (398, 415), + (417, 420), + (422, 436), + (438, 441), + (443, 526), + (535, 568), + (570, 572), + (574, 592), + (594, 598), + (600, 600), + (608, 609), + (611, 620), + (622, 626), + (628, 632), + (634, 659), + (661, 664), + (666, 722), + (724, 787), + ], } plddts = cif_file.residue_plddts plddt_regions = get_plddt_regions(plddts) + print(f"PLDDT regions: {plddt_regions}") + assert plddt_regions_check == plddt_regions assert cif_file.name == "model" assert cif_file.pathway == test_cif @@ -97,10 +159,7 @@ def test_superpose_models(test_data): shutil.copyfile(model_1, f"{temp_dir}/model_1.cif") shutil.copyfile(model_2, f"{temp_dir}/model_2.cif") - models = [ - Path(f"{temp_dir}/model_1.cif"), - Path(f"{temp_dir}/model_2.cif") - ] + models = [Path(f"{temp_dir}/model_1.cif"), Path(f"{temp_dir}/model_2.cif")] file_handlers.superpose_models(models) superposed_atoms = [] @@ -114,17 +173,19 @@ def test_superpose_models(test_data): count += 1 ref_superposed_atoms = [ - ['10.299', '-14.127', '6.666'], - ['10.620', '-15.139', '7.638'], - ['10.542', '-14.683', '9.078'], - ['11.084', '-13.621', '9.438'], - ['9.916', '-15.513', '9.869'], - ['9.715', '-15.192', '11.280'], - ['10.118', '-16.294', '12.262'], - ['10.804', '-16.028', '13.251'], - ['8.250', '-14.827', '11.552'], - ['7.400', '-15.896', '11.121'], - ['7.871', '-13.566', '10.742'] + ["-4.804", "-5.203", "18.445"], + ["-4.255", "-5.653", "19.697"], + ["-3.629", "-7.029", "19.656"], + ["-4.233", "-7.987", "19.137"], + ["-2.464", "-7.105", "20.243"], + ["-1.709", "-8.355", "20.246"], + ["-1.191", "-8.799", "21.616"], + ["-1.343", "-9.963", "21.992"], + ["-0.512", "-8.272", "19.291"], + ["0.309", "-7.153", "19.645"], + ["-1.015", "-8.051", "17.846"], ] + print(f"Superposed atoms: {superposed_atoms}") + assert ref_superposed_atoms == superposed_atoms diff --git a/tests/test_utilities.py b/tests/test_utilities.py index 65fc3dc..41b79e6 100644 --- a/tests/test_utilities.py +++ b/tests/test_utilities.py @@ -113,3 +113,5 @@ def test_af3_pae_reorder(test_data): pae_obj.scores["token_chain_ids"][787 + 50 :] # noqa: E203 == pae_to_compare_tci[:51] ) + + cif.reorder_chains(["A", "B", "C", "D"])